{"question": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds -7.265439987182617, internal energy at 0K (U0) is below -15.557185173034668, and Gibbs free energy (G) equals -14.763945579528809?", "refer_dataset": "table60", "column names": ["homo", "U0", "G", "Cv"], "condition_column": {"homo": ">", "U0": "<", "G": "="}, "answer_column": {"Cv": "min"}, "condition": {"homo": ">-7.265439987182617", "U0": "<-15.557185173034668", "G": "=='-14.763945579528809'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds {}, internal energy at 0K (U0) is below {}, and Gibbs free energy (G) equals {}?"}
{"question": "What is the minimum Tc recorded for materials where formula contains Mg1.985Mn0.015B2?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "min"}, "condition": {"formula": "=='Mg1.985Mn0.015B2'"}, "tool": "calculate_data", "answer": 37.4, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Tc recorded for materials where formula contains {}?"}
{"question": "Determine the maximum irradiation time (h) for Bi type BiOCl, Main product CO, and loading > 0.142857143 g/l.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Main product", "loading (g/l)", "irradiation time(h)"], "condition_column": {"Bi type in photocatalyst": "=", "Main product": "=", "loading (g/l)": ">"}, "answer_column": {"irradiation time(h)": "max"}, "condition": {"Bi type in photocatalyst": "=='BiOCl'", "Main product": "=='CO'", "loading (g/l)": ">0.142857143"}, "tool": "calculate_data", "answer": 3.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum irradiation time (h) for Bi type {}, Main product {}, and loading > {} g/l."}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -1.77790756800166 and Gibbs free energy (G) under 4.59587971770934.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-1.77790756800166", "G": "<4.59587971770934"}, "tool": "calculate_data", "answer": -1.9151724103372094, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "Calculate the minimum COx when Cation3-mol < 0.0%, Anion2 = 0.0, and CH4-pressure > 0.25.", "refer_dataset": "table20", "column names": ["Cation3-mol", "Anion2", "CH4-pressure", "COx"], "condition_column": {"Cation3-mol": "<", "Anion2": "=", "CH4-pressure": ">"}, "answer_column": {"COx": "min"}, "condition": {"Cation3-mol": "<0.0", "Anion2": "=='0.0'", "CH4-pressure": ">0.25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum COx when Cation3-mol < {}%, Anion2 = {}, and CH4-pressure > {}."}
{"question": "Determine the average ethane yield (C2H6y) for M1 = Mn, Support_ID = 10, and M3_mol > 0.185.", "refer_dataset": "table17", "column names": ["M1", "Support_ID", "M3_mol", "C2H6y"], "condition_column": {"M1": "=", "Support_ID": "=", "M3_mol": ">"}, "answer_column": {"C2H6y": "avg"}, "condition": {"M1": "=='Mn'", "Support_ID": "=='10'", "M3_mol": ">0.185"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average ethane yield (C2H6y) for M1 = {}, Support_ID = {}, and M3_mol > {}."}
{"question": "Identify the highest bandgap (gap pbe) for materials where magnetic moment (mu_b) is less than 6.11e-05 and bulk modulus exceeds 131.4023301801204.", "refer_dataset": "table56", "column names": ["gap pbe", "mu_b", "bulk modulus"], "condition_column": {"mu_b": "<", "bulk modulus": ">"}, "answer_column": {"gap pbe": "max"}, "condition": {"mu_b": "<6.11e-05", "bulk modulus": ">131.4023301801204"}, "tool": "calculate_data", "answer": 4.115599999999999, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify the highest bandgap (gap pbe) for materials where magnetic moment (mu_b) is less than {} and bulk modulus exceeds {}."}
{"question": "What is the average bandgap for materials with a topology classification of bcu?", "refer_dataset": "table62", "column names": ["topology", "bandgap"], "condition_column": {"topology": "="}, "answer_column": {"bandgap": "avg"}, "condition": {"topology": "=='bcu'"}, "tool": "calculate_data", "answer": 2.8390633333333333, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bandgap for materials with a topology classification of {}?"}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 4.87952996944773?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='4.87952996944773'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -1.27419580696129 and the HOMO-LUMO gap (gap) is less than 2.55032827947553?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-1.27419580696129", "gap": "<2.55032827947553"}, "tool": "calculate_data", "answer": 2.05689453649337, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > 62.0% in under 20.0 minutes of illumination for pH = 7.0?", "refer_dataset": "table8", "column names": ["Catalyst/Pollutant mass ratio", "Degradation rate(%)", "Illumination time(min)", "pH"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "pH": "="}, "answer_column": {"Catalyst/Pollutant mass ratio": ""}, "condition": {"Degradation rate(%)": ">62.0", "Illumination time(min)": "<20.0", "pH": "=='7.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > {}% in under {} minutes of illumination for pH = {}?"}
{"question": "Determine the maximum total flow rate (mL/min) for experiments where CH4/O2 ratio is 6.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Total flow(mL/min)"], "condition_column": {"CH4/O2 (mol/mol)": "="}, "answer_column": {"Total flow(mL/min)": "max"}, "condition": {"CH4/O2 (mol/mol)": "=='6'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum total flow rate (mL/min) for experiments where CH4/O2 ratio is {}."}
{"question": "How many Preparations use both Anion1 0.0 and Support1 13.0, with C2-yield ≥ 6.3283%?", "refer_dataset": "table20", "column names": ["Anion1", "Support1", "C2-yield", "Preparation"], "condition_column": {"Anion1": "=", "Support1": "=", "C2-yield": ">="}, "answer_column": {"Preparation": "count"}, "condition": {"Anion1": "=='0.0'", "Support1": "=='13.0'", "C2-yield": ">=6.3283"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations use both Anion1 {} and Support1 {}, with C2-yield ≥ {}%?"}
{"question": "What is the average degradation rate for experiments using Dopant Ce with a Calcination Temperature above 400°C?", "refer_dataset": "table8", "column names": ["Dopant", "Calcination temperature(°C)", "Degradation rate(%)"], "condition_column": {"Dopant": "=", "Calcination temperature(°C)": ">"}, "answer_column": {"Degradation rate(%)": "avg"}, "condition": {"Dopant": "=='Ce'", "Calcination temperature(°C)": ">400"}, "tool": "calculate_data", "answer": 57.54310344827588, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average degradation rate for experiments using Dopant {} with a Calcination Temperature above {}°C?"}
{"question": "What is the minimum initial concentration (C0) recorded when light intensity (I) is 0.176 mW/cm², nanoparticle dose (D) is 1.875 g/L, and reference (Ref) is 17.0?", "refer_dataset": "table9", "column names": ["I, mW/cm2", "D, g/L", "Ref", "C0, mg/L"], "condition_column": {"I, mW/cm2": "=", "D, g/L": "=", "Ref": "="}, "answer_column": {"C0, mg/L": "min"}, "condition": {"I, mW/cm2": "=='0.176'", "D, g/L": "=='1.875'", "Ref": "=='17.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum initial concentration (C0) recorded when light intensity (I) is {} mW/cm², nanoparticle dose (D) is {} g/L, and reference (Ref) is {}?"}
{"question": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below 1.52?", "refer_dataset": "table3", "column names": ["χpb", "ρb"], "condition_column": {"χpb": "<"}, "answer_column": {"ρb": "avg"}, "condition": {"χpb": "<1.52"}, "tool": "calculate_data", "answer": 8.098571428571429, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below {}?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -1.01286670421756.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-1.01286670421756'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the average Onset potential for alloys where Platinum percentage exceeds 2.2%?", "refer_dataset": "table15", "column names": ["Pt", "Onset"], "condition_column": {"Pt": ">"}, "answer_column": {"Onset": "avg"}, "condition": {"Pt": ">2.2"}, "tool": "calculate_data", "answer": 0.4974048913362712, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Onset potential for alloys where Platinum percentage exceeds {}%?"}
{"question": "How many catalysts use M1 as Zn, M2 as Mo, and achieve CH4 conversion (%) above 37.86041263%?", "refer_dataset": "table21", "column names": ["M1", "M2", "CH4 conversion (%)", "Code"], "condition_column": {"M1": "=", "M2": "=", "CH4 conversion (%)": ">"}, "answer_column": {"Code": "count"}, "condition": {"M1": "=='Zn'", "M2": "=='Mo'", "CH4 conversion (%)": ">37.86041263"}, "tool": "calculate_data", "answer": 6, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many catalysts use M1 as {}, M2 as {}, and achieve CH4 conversion (%) above {}%?"}
{"question": "Calculate the total number of Preparations with Cation2-mol above 0.0%.", "refer_dataset": "table20", "column names": ["Cation2-mol", "Preparation"], "condition_column": {"Cation2-mol": ">"}, "answer_column": {"Preparation": "count"}, "condition": {"Cation2-mol": ">0.0"}, "tool": "calculate_data", "answer": 1409, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total number of Preparations with Cation2-mol above {}%."}
{"question": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding 130.0°C?", "refer_dataset": "table7", "column names": ["Synhesis_Temp", "Reactor_Volume"], "condition_column": {"Synhesis_Temp": ">"}, "answer_column": {"Reactor_Volume": "min"}, "condition": {"Synhesis_Temp": ">130.0"}, "tool": "calculate_data", "answer": 1000.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding {}°C?"}
{"question": "What is the highest light intensity used with the co-catalyst 'Pt(0.6 wt％)'?", "refer_dataset": "table1", "column names": ["Co-catalyst", "Light intensity(W)"], "condition_column": {"Co-catalyst": "="}, "answer_column": {"Light intensity(W)": "max"}, "condition": {"Co-catalyst": "=='Pt(0.6 wt％)'"}, "tool": "calculate_data", "answer": "Xe lamp(500W),simulate natural visible light of the sun", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest light intensity used with the co-catalyst '{}'?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -0.7643322709248 and the HOMO-LUMO gap (gap) is less than 1.86164528491055?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-0.7643322709248", "gap": "<1.86164528491055"}, "tool": "calculate_data", "answer": 1.98432129278939, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "What is the median O2-pressure when Anion1 is 15?", "refer_dataset": "table20", "column names": ["O2-pressure", "Anion1"], "condition_column": {"Anion1": "="}, "answer_column": {"O2-pressure": "median"}, "condition": {"Anion1": "=='15'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median O2-pressure when Anion1 is {}?"}
{"question": "What is the minimum formula_energy recorded for the chemical formula Ho?", "refer_dataset": "table64", "column names": ["formula", "formula_energy"], "condition_column": {"formula": "="}, "answer_column": {"formula_energy": "min"}, "condition": {"formula": "=='Ho'"}, "tool": "calculate_data", "answer": 1.76605087946e-09, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum formula_energy recorded for the chemical formula {}?"}
{"question": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds 0.05.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Pore Volume (cm3/g)"], "condition_column": {"Catalyst dosage (g/L)": ">"}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Catalyst dosage (g/L)": ">0.05"}, "tool": "calculate_data", "answer": 0.3555386740331478, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds {}."}
{"question": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds -0.105?", "refer_dataset": "table51", "column names": ["b3lyp_lumo", "b3lyp_scharber_pce"], "condition_column": {"b3lyp_lumo": ">"}, "answer_column": {"b3lyp_scharber_pce": "sum"}, "condition": {"b3lyp_lumo": ">-0.105"}, "tool": "calculate_data", "answer": 3189.1692973245326, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds {}?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -0.60227748041828.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-0.60227748041828'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Calculate the lowest Illumination Time required to achieve at least 73.0% Degradation Rate with Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": "<", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": "min"}, "condition": {"Degradation rate(%)": "<73.0", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the lowest Illumination Time required to achieve at least {}% Degradation Rate with Dopant/Ti mole ratio {}."}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.0, gap pbe > 0.0, and mu_b > 6.11e-05?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.0", "gap pbe": ">0.0", "mu_b": ">6.11e-05"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than 1.017, Element B's Electronegativity (χpb) is less than 1.54, and the Tolerance Factor (t) is 0.905?", "refer_dataset": "table2", "column names": ["χpa", "χpb", "t", "Eg(eV)"], "condition_column": {"χpa": ">", "χpb": "<", "t": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"χpa": ">1.017", "χpb": "<1.54", "t": "=='0.905'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than {}, Element B's Electronegativity (χpb) is less than {}, and the Tolerance Factor (t) is {}?"}
{"question": "Calculate the average SBET (m²/g) for entries with Bandgap less than 1.68 eV and irradiation time over 2.0 hours.", "refer_dataset": "table10", "column names": ["Eg(eV)", "irradiation time(h)", "SBET (m2 /g)"], "condition_column": {"Eg(eV)": "<", "irradiation time(h)": ">"}, "answer_column": {"SBET (m2 /g)": "avg"}, "condition": {"Eg(eV)": "<1.68", "irradiation time(h)": ">2.0"}, "tool": "calculate_data", "answer": 35.160000000000004, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average SBET (m²/g) for entries with Bandgap less than {} eV and irradiation time over {} hours."}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below 0.407914315802125?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<0.407914315802125"}, "tool": "calculate_data", "answer": 6.713, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "Calculate the maximum formation energy per atom for materials with space group number 164.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "max"}, "condition": {"spacegroup_number": "=='164'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum formation energy per atom for materials with space group number {}."}
{"question": "How many catalysts use M1 as Zn, M2 as Mo, and achieve CH4 conversion (%) above 22.87186386%?", "refer_dataset": "table21", "column names": ["M1", "M2", "CH4 conversion (%)", "Code"], "condition_column": {"M1": "=", "M2": "=", "CH4 conversion (%)": ">"}, "answer_column": {"Code": "count"}, "condition": {"M1": "=='Zn'", "M2": "=='Mo'", "CH4 conversion (%)": ">22.87186386"}, "tool": "calculate_data", "answer": 41, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many catalysts use M1 as {}, M2 as {}, and achieve CH4 conversion (%) above {}%?"}
{"question": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > 0.2, Ni < 0.0, and Fe = 0.1?", "refer_dataset": "table16", "column names": ["Mn", "Ni", "Fe", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">", "Ni": "<", "Fe": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.2", "Ni": "<0.0", "Fe": "=='0.1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > {}, Ni < {}, and Fe = {}?"}
{"question": "List references (Ref) where initial concentration (C0) is greater than 3.8 mg/L.", "refer_dataset": "table9", "column names": ["Ref", "C0, mg/L"], "condition_column": {"C0, mg/L": ">"}, "answer_column": {"Ref": ""}, "condition": {"C0, mg/L": ">3.8"}, "tool": "calculate_data", "answer": [{"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 24}, {"Ref": 24}, {"Ref": 25}, {"Ref": 25}, {"Ref": 25}, {"Ref": 25}, {"Ref": 25}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 30}, {"Ref": 30}, {"Ref": 30}, {"Ref": 30}, {"Ref": 30}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 31}, {"Ref": 32}, {"Ref": 32}, {"Ref": 32}, {"Ref": 32}, {"Ref": 32}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 35}, {"Ref": 35}, {"Ref": 35}, {"Ref": 35}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 36}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 39}, {"Ref": 39}, {"Ref": 39}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 42}, {"Ref": 42}, {"Ref": 42}, {"Ref": 42}, {"Ref": 43}, {"Ref": 43}, {"Ref": 43}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List references (Ref) where initial concentration (C0) is greater than {} mg/L."}
{"question": "Calculate the lowest Illumination Time required to achieve at least 86.0% Degradation Rate with Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": "<", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": "min"}, "condition": {"Degradation rate(%)": "<86.0", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the lowest Illumination Time required to achieve at least {}% Degradation Rate with Dopant/Ti mole ratio {}."}
{"question": "What is the minimum nanoparticle dose (D) used for organic compound 4-Chlorophenol?", "refer_dataset": "table9", "column names": ["D, g/L", "OC"], "condition_column": {"OC": "="}, "answer_column": {"D, g/L": "min"}, "condition": {"OC": "=='4-Chlorophenol'"}, "tool": "calculate_data", "answer": 1.875, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum nanoparticle dose (D) used for organic compound {}?"}
{"question": "Calculate the average SBET (m²/g) for entries with Bandgap less than 2.83 eV and irradiation time over 4.0 hours.", "refer_dataset": "table10", "column names": ["Eg(eV)", "irradiation time(h)", "SBET (m2 /g)"], "condition_column": {"Eg(eV)": "<", "irradiation time(h)": ">"}, "answer_column": {"SBET (m2 /g)": "avg"}, "condition": {"Eg(eV)": "<2.83", "irradiation time(h)": ">4.0"}, "tool": "calculate_data", "answer": 32.519999999999996, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average SBET (m²/g) for entries with Bandgap less than {} eV and irradiation time over {} hours."}
{"question": "What is the average Power(W) for materials where BandGap(eV) is less than 4.13?", "refer_dataset": "table4", "column names": ["BandGap(eV)", "Power(W)"], "condition_column": {"BandGap(eV)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"BandGap(eV)": "<4.13"}, "tool": "calculate_data", "answer": 334.1545253863135, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where BandGap(eV) is less than {}?"}
{"question": "What is the highest density for materials with pretty_formula equal to TiBe?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='TiBe'"}, "tool": "calculate_data", "answer": 3.752193567343008, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.6865.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.6865"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "Determine the average LUMO energy for materials with polarizability (alpha) less than 27.8700008392334?", "refer_dataset": "table60", "column names": ["alpha", "lumo"], "condition_column": {"alpha": "<"}, "answer_column": {"lumo": "avg"}, "condition": {"alpha": "<27.8700008392334"}, "tool": "calculate_data", "answer": 0.44254305801893534, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average LUMO energy for materials with polarizability (alpha) less than {}?"}
{"question": "What is the average reaction energy for elements with atomic number greater than 44?", "refer_dataset": "table18", "column names": ["A_AtimicN", "reaction_energy"], "condition_column": {"A_AtimicN": ">"}, "answer_column": {"reaction_energy": "avg"}, "condition": {"A_AtimicN": ">44"}, "tool": "calculate_data", "answer": 0.2226947881355934, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction energy for elements with atomic number greater than {}?"}
{"question": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is 4.1030064886?", "refer_dataset": "table22", "column names": ["Lattice", "D_AtomN"], "condition_column": {"Lattice": "="}, "answer_column": {"D_AtomN": "median"}, "condition": {"Lattice": "=='4.1030064886'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is {}?"}
{"question": "What is the highest reaction energy recorded for element Ta?", "refer_dataset": "table18", "column names": ["AA", "reaction_energy"], "condition_column": {"AA": "="}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Ta'"}, "tool": "calculate_data", "answer": 0.35, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy recorded for element {}?"}
{"question": "What is the average C2 yield (%) for catalysts where the primary metal component (M1) is V?", "refer_dataset": "table21", "column names": ["M1", "C2 yield (%)"], "condition_column": {"M1": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='V'"}, "tool": "calculate_data", "answer": 10.012633135526539, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average C2 yield (%) for catalysts where the primary metal component (M1) is {}?"}
{"question": "Calculate the average Band_gap_GGA for Space_group_rlx 55, SOC False, and Magnetic_ordering \"FM\".", "refer_dataset": "table63", "column names": ["Space_group_rlx", "SOC", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "=", "SOC": "=", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "avg"}, "condition": {"Space_group_rlx": "=='55'", "SOC": "=='False'", "Magnetic_ordering": "=='FM'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA for Space_group_rlx {}, SOC {}, and Magnetic_ordering \"{}\"."}
{"question": "How many times has research from Beijing Univ Chem Technol institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='Beijing Univ Chem Technol'"}, "tool": "calculate_data", "answer": 1599, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "What is the average Band_gap_HSE for materials with Magnetic_ordering \"FM\"?", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Band_gap_HSE"], "condition_column": {"Magnetic_ordering": "="}, "answer_column": {"Band_gap_HSE": "avg"}, "condition": {"Magnetic_ordering": "=='FM'"}, "tool": "calculate_data", "answer": 2.7536617618296533, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Band_gap_HSE for materials with Magnetic_ordering \"{}\"?"}
{"question": "What is the highest Rhodium percentage observed in alloys with Onset potential below 0.508686V?", "refer_dataset": "table15", "column names": ["Rh", "Onset"], "condition_column": {"Onset": "<"}, "answer_column": {"Rh": "max"}, "condition": {"Onset": "<0.508686"}, "tool": "calculate_data", "answer": 51.9, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Rhodium percentage observed in alloys with Onset potential below {}V?"}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.606839813103449?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.606839813103449"}, "tool": "calculate_data", "answer": 0.0003317409766454352, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 2.0, Indirect Bandgap < 0.0, and Lattice Parameter 4.042847572?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='2.0'", "Indirect_Band": "<0.0", "Lattice": "=='4.042847572'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
{"question": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"NM\", SOC True, and Direct_or_indirect_HSE \"Indirect\"?", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "SOC", "Direct_or_indirect_HSE", "Band_gap_HSE"], "condition_column": {"Magnetic_ordering": "=", "SOC": "=", "Direct_or_indirect_HSE": "="}, "answer_column": {"Band_gap_HSE": "max"}, "condition": {"Magnetic_ordering": "=='NM'", "SOC": "=='True'", "Direct_or_indirect_HSE": "=='Indirect'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"{}\", SOC {}, and Direct_or_indirect_HSE \"{}\"?"}
{"question": "What is the minimum SBET (m²/g) required for Bi type BiOCl, light source UV–VIS, and Yield > 2.5 μmol/g/h?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "light source", "Yield (μmol/g/h)", "SBET (m2 /g)"], "condition_column": {"Bi type in photocatalyst": "=", "light source": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"SBET (m2 /g)": "min"}, "condition": {"Bi type in photocatalyst": "=='BiOCl'", "light source": "=='UV–VIS'", "Yield (μmol/g/h)": ">2.5"}, "tool": "calculate_data", "answer": 97.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum SBET (m²/g) required for Bi type {}, light source {}, and Yield > {} μmol/g/h?"}
{"question": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below 2.1521?", "refer_dataset": "table56", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"gap pbe": "<"}, "answer_column": {"elastic anisotropy": "max"}, "condition": {"gap pbe": "<2.1521"}, "tool": "calculate_data", "answer": 401.4952807290347, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below {}?"}
{"question": "Calculate the average reaction temperature for noble metal none, synthesis time 12.0 hours, and additional components containing Zn2GeO4.", "refer_dataset": "table7", "column names": ["Noble_Metal", "Synthesis_Time", "Additional", "Rxn_Temp"], "condition_column": {"Noble_Metal": "=", "Synthesis_Time": "=", "Additional": "="}, "answer_column": {"Rxn_Temp": "avg"}, "condition": {"Noble_Metal": "=='none'", "Synthesis_Time": "=='12.0'", "Additional": "=='Zn2GeO4'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average reaction temperature for noble metal {}, synthesis time {} hours, and additional components containing {}."}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 3.62 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<3.62"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "What is the average Surface Energy (surf_en) for materials with the chemical formula 'ThSbRh'?", "refer_dataset": "table66", "column names": ["formula", "surf_en"], "condition_column": {"formula": "="}, "answer_column": {"surf_en": "avg"}, "condition": {"formula": "=='ThSbRh'"}, "tool": "calculate_data", "answer": 1.122326739139944, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Energy (surf_en) for materials with the chemical formula '{}'?"}
{"question": "Materials with bandgap of 3.0243, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='3.0243'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 120°C and references in study [28]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">120", "Ref.": "=='[28]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below -6.91985559463501 and heat capacity (Cv) exceeds 10.890000343322754?", "refer_dataset": "table60", "column names": ["homo", "Cv", "zpve"], "condition_column": {"homo": "<", "Cv": ">"}, "answer_column": {"zpve": "avg"}, "condition": {"homo": "<-6.91985559463501", "Cv": ">10.890000343322754"}, "tool": "calculate_data", "answer": 2.9077616872803476, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below {} and heat capacity (Cv) exceeds {}?"}
{"question": "What is the average methane conversion rate when Cation1 is Na?", "refer_dataset": "table19", "column names": ["Cation1", "Temp CH4 conv"], "condition_column": {"Cation1": "="}, "answer_column": {"Temp CH4 conv": "avg"}, "condition": {"Cation1": "=='Na'"}, "tool": "calculate_data", "answer": 750.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average methane conversion rate when Cation1 is {}?"}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.348056689999999?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.348056689999999"}, "tool": "calculate_data", "answer": 0.0028985849056603766, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 80°C and references in study [35]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">80", "Ref.": "=='[35]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "Determine the average LUMO energy for materials with polarizability (alpha) less than 14.18000030517578?", "refer_dataset": "table60", "column names": ["alpha", "lumo"], "condition_column": {"alpha": "<"}, "answer_column": {"lumo": "avg"}, "condition": {"alpha": "<14.18000030517578"}, "tool": "calculate_data", "answer": 1.957859218120575, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average LUMO energy for materials with polarizability (alpha) less than {}?"}
{"question": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is 40?", "refer_dataset": "table6", "column names": ["Illumination time (min)", "Antibiotic dosage (mg/L)"], "condition_column": {"Illumination time (min)": "="}, "answer_column": {"Antibiotic dosage (mg/L)": "min"}, "condition": {"Illumination time (min)": "=='40'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is {}?"}
{"question": "What is the average Light Wavelength used for Calcination Temperatures above 500°C when Pollutant is RhB?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Calcination temperature(°C)", "Pollutant"], "condition_column": {"Calcination temperature(°C)": ">", "Pollutant": "="}, "answer_column": {"Light wavelength(nm)": "avg"}, "condition": {"Calcination temperature(°C)": ">500", "Pollutant": "=='RhB'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Light Wavelength used for Calcination Temperatures above {}°C when Pollutant is {}?"}
{"question": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below -92.4321898395374.", "refer_dataset": "table56", "column names": ["mu_b", "shear modulus"], "condition_column": {"shear modulus": "<"}, "answer_column": {"mu_b": "avg"}, "condition": {"shear modulus": "<-92.4321898395374"}, "tool": "calculate_data", "answer": -0.0011369, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below {}."}
{"question": "Find the total electronic spatial extent (R²) values where HOMO energy is above -6.91985559463501 and internal energy (U) is below -23.656736373901367?", "refer_dataset": "table60", "column names": ["homo", "U", "r2"], "condition_column": {"homo": ">", "U": "<"}, "answer_column": {"r2": "sum"}, "condition": {"homo": ">-6.91985559463501", "U": "<-23.656736373901367"}, "tool": "calculate_data", "answer": 2801942.3321533203, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the total electronic spatial extent (R²) values where HOMO energy is above {} and internal energy (U) is below {}?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 5.4?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">5.4"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is 5?", "refer_dataset": "table6", "column names": ["Illumination time (min)", "Antibiotic dosage (mg/L)"], "condition_column": {"Illumination time (min)": "="}, "answer_column": {"Antibiotic dosage (mg/L)": "min"}, "condition": {"Illumination time (min)": "=='5'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is {}?"}
{"question": "What is the maximum final energy (final_energy) where surface valence band maximum (surf_vbm) is below 0.2863?", "refer_dataset": "table66", "column names": ["surf_vbm", "final_energy"], "condition_column": {"surf_vbm": "<"}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<0.2863"}, "tool": "calculate_data", "answer": 485.35742061, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum final energy (final_energy) where surface valence band maximum (surf_vbm) is below {}?"}
{"question": "Determine the total CO yield (COy) when Support_ID is 3 and M1_atom_number is less than 25.", "refer_dataset": "table17", "column names": ["Support_ID", "M1_atom_number", "COy"], "condition_column": {"Support_ID": "=", "M1_atom_number": "<"}, "answer_column": {"COy": "sum"}, "condition": {"Support_ID": "=='3'", "M1_atom_number": "<25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total CO yield (COy) when Support_ID is {} and M1_atom_number is less than {}."}
{"question": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than 8.6 eV.", "refer_dataset": "table3", "column names": ["EAa", "Ra"], "condition_column": {"EAa": ">"}, "answer_column": {"Ra": "max"}, "condition": {"EAa": ">8.6"}, "tool": "calculate_data", "answer": 139.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than {} eV."}
{"question": "What is the highest reaction energy recorded for element Rh?", "refer_dataset": "table18", "column names": ["AA", "reaction_energy"], "condition_column": {"AA": "="}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Rh'"}, "tool": "calculate_data", "answer": 0.95, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy recorded for element {}?"}
{"question": "Compute the average Catalyst dosage (g/L) for experiments where pH equals 2.2.", "refer_dataset": "table6", "column names": ["pH", "Catalyst dosage (g/L)"], "condition_column": {"pH": "="}, "answer_column": {"Catalyst dosage (g/L)": "avg"}, "condition": {"pH": "=='2.2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Catalyst dosage (g/L) for experiments where pH equals {}."}
{"question": "Determine the maximum reactor volume for MOF Type COMP, synthesized at over 120.0°C, with reaction pressure below 0.8 atm.", "refer_dataset": "table7", "column names": ["MOF_Type", "Synhesis_Temp", "Rxn_Pressure", "Reactor_Volume"], "condition_column": {"MOF_Type": "=", "Synhesis_Temp": ">", "Rxn_Pressure": "<"}, "answer_column": {"Reactor_Volume": "max"}, "condition": {"MOF_Type": "=='COMP'", "Synhesis_Temp": ">120.0", "Rxn_Pressure": "<0.8"}, "tool": "calculate_data", "answer": 1000.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum reactor volume for MOF Type {}, synthesized at over {}°C, with reaction pressure below {} atm."}
{"question": "What is the minimum SBET (m²/g) required for Bi type BiOBr, light source UV–VIS, and Yield > 0.375 μmol/g/h?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "light source", "Yield (μmol/g/h)", "SBET (m2 /g)"], "condition_column": {"Bi type in photocatalyst": "=", "light source": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"SBET (m2 /g)": "min"}, "condition": {"Bi type in photocatalyst": "=='BiOBr'", "light source": "=='UV–VIS'", "Yield (μmol/g/h)": ">0.375"}, "tool": "calculate_data", "answer": 59.75, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum SBET (m²/g) required for Bi type {}, light source {}, and Yield > {} μmol/g/h?"}
{"question": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals 4e-06?", "refer_dataset": "table67", "column names": ["exfoliation_energy_per_atom", "total_magnetization"], "condition_column": {"total_magnetization": "="}, "answer_column": {"exfoliation_energy_per_atom": "max"}, "condition": {"total_magnetization": "=='4e-06'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals {}?"}
{"question": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above 1.821886742.", "refer_dataset": "table51", "column names": ["m06_lumo", "m06_scharber_voc"], "condition_column": {"m06_scharber_voc": ">"}, "answer_column": {"m06_lumo": "min"}, "condition": {"m06_scharber_voc": ">1.821886742"}, "tool": "calculate_data", "answer": 0.024, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above {}."}
{"question": "Materials with bandgap of 0.0, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='0.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "Find the minimum synthesis temperature for experiments with Zn2GeO4 nanorods photocatalyst(s), reaction time under 7.0 hours, and CH3OH as the major product.", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Rxn_Time", "MAJORgas", "Synhesis_Temp"], "condition_column": {"Photocatalyst(s)": "=", "Rxn_Time": "<", "MAJORgas": "="}, "answer_column": {"Synhesis_Temp": "min"}, "condition": {"Photocatalyst(s)": "=='Zn2GeO4 nanorods'", "Rxn_Time": "<7.0", "MAJORgas": "=='CH3OH'"}, "tool": "calculate_data", "answer": 180.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum synthesis temperature for experiments with {} photocatalyst(s), reaction time under {} hours, and {} as the major product."}
{"question": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than 0.951122438?", "refer_dataset": "table51", "column names": ["b3lyp_homo", "b3lyp_scharber_voc"], "condition_column": {"b3lyp_scharber_voc": ">"}, "answer_column": {"b3lyp_homo": "avg"}, "condition": {"b3lyp_scharber_voc": ">0.951122438"}, "tool": "calculate_data", "answer": -0.21879487179487195, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than {}?"}
{"question": "What is the highest reaction energy recorded for element W(?", "refer_dataset": "table18", "column names": ["AA", "reaction_energy"], "condition_column": {"AA": "="}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='W('"}, "tool": "calculate_data", "answer": -0.09, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy recorded for element {}?"}
{"question": "Calculate the highest aging time (AH) for perovskite oxides synthesized at a calcination temperature of 500°C.", "refer_dataset": "table11", "column names": ["CT (℃)", "AH (h)"], "condition_column": {"CT (℃)": "="}, "answer_column": {"AH (h)": "max"}, "condition": {"CT (℃)": "=='500'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the highest aging time (AH) for perovskite oxides synthesized at a calcination temperature of {}°C."}
{"question": "What is the average total yield for experiments with photocatalyst(s) CPB/BWO, Gas phase, and sacrificial agent percentage above 0.0%?", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Phase", "SacrAgentPercent", "total"], "condition_column": {"Photocatalyst(s)": "=", "Phase": "=", "SacrAgentPercent": ">"}, "answer_column": {"total": "avg"}, "condition": {"Photocatalyst(s)": "=='CPB/BWO'", "Phase": "=='Gas'", "SacrAgentPercent": ">0.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average total yield for experiments with photocatalyst(s) {}, {} phase, and sacrificial agent percentage above {}%?"}
{"question": "How many catalysts use M1 as Zn, M2 as Mo, and achieve CH4 conversion (%) above 40.08543192%?", "refer_dataset": "table21", "column names": ["M1", "M2", "CH4 conversion (%)", "Code"], "condition_column": {"M1": "=", "M2": "=", "CH4 conversion (%)": ">"}, "answer_column": {"Code": "count"}, "condition": {"M1": "=='Zn'", "M2": "=='Mo'", "CH4 conversion (%)": ">40.08543192"}, "tool": "calculate_data", "answer": 4, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many catalysts use M1 as {}, M2 as {}, and achieve CH4 conversion (%) above {}%?"}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.0584942214285715, gap pbe > 0.0318, and mu_b > 0.0003058999999999?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.0584942214285715", "gap pbe": ">0.0318", "mu_b": ">0.0003058999999999"}, "tool": "calculate_data", "answer": 307.18353522658464, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "What is the minimum journal impact factor for studies using the Taiyuan Univ Technol method?", "refer_dataset": "table13", "column names": ["Facility", "IF"], "condition_column": {"Facility": "="}, "answer_column": {"IF": "min"}, "condition": {"Facility": "=='Taiyuan Univ Technol'"}, "tool": "calculate_data", "answer": 16.744, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum journal impact factor for studies using the {} method?"}
{"question": "What is the total formula_energy for materials where ID contains the substring 534?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "sum"}, "condition": {"id": "=='534'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total formula_energy for materials where ID contains the substring {}?"}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 2.70289805057916.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<2.70289805057916"}, "tool": "calculate_data", "answer": [{"U": 6.19311549745637}, {"U": 6.46228747900917}, {"U": 5.74085587987803}, {"U": 5.85213296706841}, {"U": 5.33647867089936}, {"U": 4.54692058907546}, {"U": 4.88454826774226}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 4.1619487412596}, {"U": 4.19426139798513}, {"U": 4.76626100362987}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 2.9854853300983}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 3.72489046894116}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 4.28237851192289}, {"U": 3.00182324895532}, {"U": 3.01987778586592}, {"U": 3.78009136638114}, {"U": 2.80742213321591}, {"U": 3.58342232907322}, {"U": 3.34822214041645}, {"U": 3.59604221522057}, {"U": 3.59705598661295}, {"U": 2.92411819429234}, {"U": 3.06909011621485}, {"U": 3.53668171969642}, {"U": 3.36763795283073}, {"U": 3.83280486597178}, {"U": 1.81243163972837}, {"U": 3.48205825390004}, {"U": 3.84218486416411}, {"U": 3.91996307758737}, {"U": 3.59120067297812}, {"U": 4.04224794538619}, {"U": 2.22476225107403}, {"U": 2.56144409148299}, {"U": 3.07303546364394}, {"U": 3.00402846301502}, {"U": 3.34725539965568}, {"U": 2.32843082719585}, {"U": 3.10486997561481}, {"U": 2.77914365955695}, {"U": 3.06939058969455}, {"U": 2.29578111761049}, {"U": 2.73295174088221}, {"U": 2.7462483455621}, {"U": 3.20788012289417}, {"U": 2.81559501186372}, {"U": 3.01722055518023}, {"U": 3.47164880743813}, {"U": 3.53752565825245}, {"U": 1.83656619218035}, {"U": 2.59857477513516}, {"U": 1.82454464017953}, {"U": 1.85095756545149}, {"U": 1.63625750654878}, {"U": 2.40314682393905}, {"U": 2.40901781445108}, {"U": 3.37981888641644}, {"U": 2.87727568521372}, {"U": 3.31659404066207}, {"U": 3.5800413492234}, {"U": 3.40896742676009}, {"U": 3.67920543596261}, {"U": 2.413869807945}, {"U": 2.42779348771295}, {"U": 2.40806936338038}, {"U": 3.20486493684571}, {"U": 1.6442474882959}, {"U": 2.42053248075571}, {"U": 2.18323681617965}, {"U": 2.40683350289431}, {"U": 3.19802459276005}, {"U": 3.10030277872339}, {"U": 3.41227002222391}, {"U": 3.7561109698883}, {"U": 4.11030388213154}, {"U": 3.50620848322923}, {"U": 3.85279288440392}, {"U": 3.79629603178194}, {"U": 4.07281263030373}, {"U": 4.01220582304204}, {"U": 3.343989383572}, {"U": 3.70197087447231}, {"U": 3.48011432112703}, {"U": 2.99771851994134}, {"U": 2.20011297448726}, {"U": 2.87185932414054}, {"U": 2.22623849034385}, {"U": 2.56304313295756}, {"U": 3.10782767978019}, {"U": 3.04636386989815}, {"U": 3.39147725742875}, {"U": 3.00957023910581}, {"U": 3.34854090358622}, {"U": 2.33181180704568}, {"U": 2.76428981840836}, {"U": 3.05134389122255}, {"U": 3.14268260342526}, {"U": 3.11768059710145}, {"U": 1.84194074824766}, {"U": 1.86001096203546}, {"U": 1.84575022940767}, {"U": 2.63518812183968}, {"U": 2.62801072489418}, {"U": 2.81154776473282}, {"U": 3.33365570868323}, {"U": 3.60468278737157}, {"U": 3.15038778856988}, {"U": 3.67911398751226}, {"U": 3.95505054157759}, {"U": 2.90524062132865}, {"U": 3.42470701147057}, {"U": 3.70139344282871}, {"U": 3.40352493755824}, {"U": 1.64672443489377}, {"U": 2.42269066418381}, {"U": 2.17986367476842}, {"U": 2.45079930500642}, {"U": 2.43116924193705}, {"U": 2.9502855151548}, {"U": 3.20419344393891}, {"U": 2.11772837197957}, {"U": 3.34306967344284}, {"U": 2.91047147268827}, {"U": 2.35913921682107}, {"U": 3.13750400832297}, {"U": 2.23811633763699}, {"U": 3.03887032259575}, {"U": 3.01544384243071}, {"U": 3.57964681448049}, {"U": 4.10826066246959}, {"U": 4.04158951654372}, {"U": 4.06600625278533}, {"U": 4.09285029218034}, {"U": 3.92455117698173}, {"U": 4.43969858745459}, {"U": 4.3833846317333}, {"U": 4.3600104078256}, {"U": 4.95561416491033}, {"U": 4.48485583223402}, {"U": 4.99847997280546}, {"U": 5.56271429860964}, {"U": 2.93806538937609}, {"U": 2.5419107024897}, {"U": 1.76650100234032}, {"U": 2.35525135127506}, {"U": 2.88729059693273}, {"U": 3.15656186537448}, {"U": 3.06547137039413}, {"U": 3.35502851793485}, {"U": 3.64805025533714}, {"U": 1.89117659391239}, {"U": 2.1821028553954}, {"U": 2.64545125078105}, {"U": 2.6406645776088}, {"U": 2.39771739880154}, {"U": 2.6839196946211}, {"U": 3.14934788904884}, {"U": 3.12904633307267}, {"U": 2.66695992630175}, {"U": 3.13765032584352}, {"U": 3.10786948478607}, {"U": 1.89657727810837}, {"U": 2.35611619233402}, {"U": 2.19279448564694}, {"U": 2.64948543384761}, {"U": 2.40585108525634}, {"U": 2.85478720486792}, {"U": 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0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -0.69666045604944.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-0.69666045604944'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -5.31642620444236.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-5.31642620444236"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is CH4?", "refer_dataset": "table4", "column names": ["Sac. Agent1", "Surface Area(m2/g)"], "condition_column": {"Sac. Agent1": "="}, "answer_column": {"Surface Area(m2/g)": "max"}, "condition": {"Sac. Agent1": "=='CH4'"}, "tool": "calculate_data", "answer": 1.7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is {}?"}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than 0.87387985863007?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<0.87387985863007"}, "tool": "calculate_data", "answer": 2.04884424920197, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "What is the average C2 yield (%) for catalysts where the primary metal component (M1) is Li?", "refer_dataset": "table21", "column names": ["M1", "C2 yield (%)"], "condition_column": {"M1": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='Li'"}, "tool": "calculate_data", "answer": 10.75654940400148, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average C2 yield (%) for catalysts where the primary metal component (M1) is {}?"}
{"question": "What is the minimum nanoparticle dose (D) used for organic compound Methanol?", "refer_dataset": "table9", "column names": ["D, g/L", "OC"], "condition_column": {"OC": "="}, "answer_column": {"D, g/L": "min"}, "condition": {"OC": "=='Methanol'"}, "tool": "calculate_data", "answer": 1.875, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum nanoparticle dose (D) used for organic compound {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than -0.2767025026190481?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.2767025026190481"}, "tool": "calculate_data", "answer": 125.159136513625, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "For Support1 30, what is the maximum C2-yield?", "refer_dataset": "table20", "column names": ["Support1", "C2-yield"], "condition_column": {"Support1": "="}, "answer_column": {"C2-yield": "max"}, "condition": {"Support1": "=='30'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For Support1 {}, what is the maximum C2-yield?"}
{"question": "What is the minimum M1 atom number required to achieve C2s greater than 19.9?", "refer_dataset": "table17", "column names": ["M1_atom_number", "C2s"], "condition_column": {"C2s": ">"}, "answer_column": {"M1_atom_number": "min"}, "condition": {"C2s": ">19.9"}, "tool": "calculate_data", "answer": 25, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum M1 atom number required to achieve C2s greater than {}?"}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MB under Experimental Temperature 32°C and Light Wavelength 254 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MB'", "Experimental temperature(°C)": "=='32'", "Light wavelength(nm)": "=='254'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "Materials with bandgap of 0.3897000000000004, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='0.3897000000000004'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > 1.911096, synthesized as True, and sourced from CSD?", "refer_dataset": "table62", "column names": ["bandgap", "synthesized", "source", "pld"], "condition_column": {"bandgap": ">", "synthesized": "=", "source": "="}, "answer_column": {"pld": "min"}, "condition": {"bandgap": ">1.911096", "synthesized": "=='True'", "source": "=='CSD'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > {}, synthesized as {}, and sourced from {}?"}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below -0.1744817920972633?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<-0.1744817920972633"}, "tool": "calculate_data", "answer": 5.257, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 81.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">81.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.5, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "What is the maximum ethane selectivity when O2 conv exceeds 28.8%?", "refer_dataset": "table19", "column names": ["O2 conv", "C2H6 sel"], "condition_column": {"O2 conv": ">"}, "answer_column": {"C2H6 sel": "max"}, "condition": {"O2 conv": ">28.8"}, "tool": "calculate_data", "answer": 38.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum ethane selectivity when O2 conv exceeds {}%?"}
{"question": "Calculate the average Surface area (m2/g) when Pore Volume (cm3/g) is below 0.23.", "refer_dataset": "table6", "column names": ["Pore Volume (cm3/g)", "Surface area (m2/g)"], "condition_column": {"Pore Volume (cm3/g)": "<"}, "answer_column": {"Surface area (m2/g)": "avg"}, "condition": {"Pore Volume (cm3/g)": "<0.23"}, "tool": "calculate_data", "answer": 48.0886868686869, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Surface area (m2/g) when Pore Volume (cm3/g) is below {}."}
{"question": "How many entries have SBET greater than 36.62 m²/g and produce CO as the Main product?", "refer_dataset": "table10", "column names": ["SBET (m2 /g)", "Main product"], "condition_column": {"SBET (m2 /g)": ">"}, "answer_column": {"Main product": "count"}, "condition": {"SBET (m2 /g)": ">36.62"}, "tool": "calculate_data", "answer": 44, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have SBET greater than {} m²/g and produce CO as the Main product?"}
{"question": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds 135.0 Å, the electronegativity of element B (χpb) is below 1.55, and the molar mass (M) is less than 233.66 g/mol?", "refer_dataset": "table3", "column names": ["Ra", "χpb", "M", "RH2(µmol h-1 g-1)"], "condition_column": {"Ra": ">", "χpb": "<", "M": "<"}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Ra": ">135.0", "χpb": "<1.55", "M": "<233.66"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds {} Å, the electronegativity of element B (χpb) is below {}, and the molar mass (M) is less than {} g/mol?"}
{"question": "Compute the average Catalyst dosage (g/L) for experiments where pH equals 5.5.", "refer_dataset": "table6", "column names": ["pH", "Catalyst dosage (g/L)"], "condition_column": {"pH": "="}, "answer_column": {"Catalyst dosage (g/L)": "avg"}, "condition": {"pH": "=='5.5'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Catalyst dosage (g/L) for experiments where pH equals {}."}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 4.829184737%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">4.829184737"}, "tool": "calculate_data", "answer": 48.26126007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "List organic compounds (OC) with light intensity (I) greater than 60.0 mW/cm².", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2"], "condition_column": {"I, mW/cm2": ">"}, "answer_column": {"OC": ""}, "condition": {"I, mW/cm2": ">60.0"}, "tool": "calculate_data", "answer": [{"OC": "Atrazine"}, {"OC": "Cyanazine"}, {"OC": "Irgarol"}, {"OC": "Prometryne"}, {"OC": "Propazine"}, {"OC": "Dichlofenthion"}, {"OC": "Bromophos ethyl"}, {"OC": "Bromophos methyl"}, {"OC": "Parathion ethyl"}, {"OC": "Parathion methyl"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List organic compounds (OC) with light intensity (I) greater than {} mW/cm²."}
{"question": "Calculate the total final energy for all materials with formula MgF2 and indirect band gap greater than 5.856.", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "final_energy"], "condition_column": {"formula": "=", "indir_gap": ">"}, "answer_column": {"final_energy": "sum"}, "condition": {"formula": "=='MgF2'", "indir_gap": ">5.856"}, "tool": "calculate_data", "answer": -3783.05918028104, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total final energy for all materials with formula {} and indirect band gap greater than {}."}
{"question": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to 131.4023301801204?", "refer_dataset": "table54", "column names": ["bulk modulus", "gap pbe"], "condition_column": {"bulk modulus": "="}, "answer_column": {"gap pbe": "avg"}, "condition": {"bulk modulus": "=='131.4023301801204'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to {}?"}
{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 1.0, Indirect Bandgap < 0.0, and Lattice Parameter 3.7756181408?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='1.0'", "Indirect_Band": "<0.0", "Lattice": "=='3.7756181408'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below 1.0915099520345546?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<1.0915099520345546"}, "tool": "calculate_data", "answer": 20.232, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -3.70239648343933.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-3.70239648343933"}, "tool": "calculate_data", "answer": -2.616378131151113, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 4.75962657949374?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='4.75962657949374'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is Nd, Support is BaO, and CH4/O2 ratio is 2?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='Nd'", "Support": "=='BaO'", "CH4/O2 (mol/mol)": "=='2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "What is the average Power(W) for materials where X is O, A mole is greater than 0.477, and Wave length(<nm) below 300.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='O'", "A mole": ">0.477", "Wave length(<nm)": "<300.0"}, "tool": "calculate_data", "answer": 284.2352941176471, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than 1.817?", "refer_dataset": "table2", "column names": ["Ra/Rb", "Eg(eV)"], "condition_column": {"Ra/Rb": ">"}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Ra/Rb": ">1.817"}, "tool": "calculate_data", "answer": 2.985499999999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than {}?"}
{"question": "Determine the average temperature (°C) required to achieve C2 yield (%) over 1.960185018% with M2 as Mo and PAr below 0.7 atm.", "refer_dataset": "table21", "column names": ["C2 yield (%)", "M2", "PAr (atm)", "Temp. (°C)"], "condition_column": {"C2 yield (%)": ">", "M2": "=", "PAr (atm)": "<"}, "answer_column": {"Temp. (°C)": "avg"}, "condition": {"C2 yield (%)": ">1.960185018", "M2": "=='Mo'", "PAr (atm)": "<0.7"}, "tool": "calculate_data", "answer": 808.4269662921348, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average temperature (°C) required to achieve C2 yield (%) over {}% with M2 as {} and PAr below {} atm."}
{"question": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds 135.0 Å, the electronegativity of element B (χpb) is below 1.54, and the molar mass (M) is less than 233.18 g/mol?", "refer_dataset": "table3", "column names": ["Ra", "χpb", "M", "RH2(µmol h-1 g-1)"], "condition_column": {"Ra": ">", "χpb": "<", "M": "<"}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Ra": ">135.0", "χpb": "<1.54", "M": "<233.18"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds {} Å, the electronegativity of element B (χpb) is below {}, and the molar mass (M) is less than {} g/mol?"}
{"question": "What is the average degradation rate for experiments using Dopant C with a Calcination Temperature above 800°C?", "refer_dataset": "table8", "column names": ["Dopant", "Calcination temperature(°C)", "Degradation rate(%)"], "condition_column": {"Dopant": "=", "Calcination temperature(°C)": ">"}, "answer_column": {"Degradation rate(%)": "avg"}, "condition": {"Dopant": "=='C'", "Calcination temperature(°C)": ">800"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average degradation rate for experiments using Dopant {} with a Calcination Temperature above {}°C?"}
{"question": "What is the highest SSA observed when CT exceeds 750°C and preparation method is 1?", "refer_dataset": "table11", "column names": ["CT (℃)", "PM", "SSA (m2 g -1 )"], "condition_column": {"CT (℃)": ">", "PM": "="}, "answer_column": {"SSA (m2 g -1 )": "avg"}, "condition": {"CT (℃)": ">750", "PM": "=='1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SSA observed when CT exceeds {}°C and preparation method is {}?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -4.95914993811544.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-4.95914993811544"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above 0.6686287445670533?", "refer_dataset": "table54", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"elastic anisotropy": ">"}, "answer_column": {"gap pbe": "min"}, "condition": {"elastic anisotropy": ">0.6686287445670533"}, "tool": "calculate_data", "answer": 11.803, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above {}?"}
{"question": "What is the average bulk_energy for bulk_formula Ru?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Ru'"}, "tool": "calculate_data", "answer": -215.68428, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "Calculate the average C2 yield (%) for catalysts with primary metal V, secondary metal Fe, and support material BaO–La2O3.", "refer_dataset": "table21", "column names": ["M1", "M2", "Support", "C2 yield (%)"], "condition_column": {"M1": "=", "M2": "=", "Support": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='V'", "M2": "=='Fe'", "Support": "=='BaO–La2O3'"}, "tool": "calculate_data", "answer": 10.377768836394964, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average C2 yield (%) for catalysts with primary metal {}, secondary metal {}, and support material {}."}
{"question": "How many unique surfaces are recorded for the element Ru?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='Ru'"}, "tool": "calculate_data", "answer": 72, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "Calculate the average chem_pot for symbol Cl?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Cl'"}, "tool": "calculate_data", "answer": -0.1317940675, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "What is the average journal impact factor for research institutions located in MA 02139 USA?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='MA 02139 USA'"}, "tool": "calculate_data", "answer": 25.5775, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "Determine the minimum CT needed for molecular formulas containing LaFe0.9Co0.1O3 when aged longer than 10 hours.", "refer_dataset": "table11", "column names": ["Molecular formulas", "AH (h)", "CT (℃)"], "condition_column": {"Molecular formulas": "=", "AH (h)": ">"}, "answer_column": {"CT (℃)": "min"}, "condition": {"Molecular formulas": "=='LaFe0.9Co0.1O3'", "AH (h)": ">10"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum CT needed for molecular formulas containing {} when aged longer than {} hours."}
{"question": "What is the highest methane conversion rate when Cation1 is V, Cation2Amount > 70%, and Support is Al2O3?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='V'", "Cation2Amount": ">70", "Support": "=='Al2O3'"}, "tool": "calculate_data", "answer": 900, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "For Support1 57, what is the maximum C2-yield?", "refer_dataset": "table20", "column names": ["Support1", "C2-yield"], "condition_column": {"Support1": "="}, "answer_column": {"C2-yield": "max"}, "condition": {"Support1": "=='57'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For Support1 {}, what is the maximum C2-yield?"}
{"question": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than 1.46887642178?", "refer_dataset": "table51", "column names": ["pbe0_homo", "pbe0_scharber_pce"], "condition_column": {"pbe0_scharber_pce": "<"}, "answer_column": {"pbe0_homo": "max"}, "condition": {"pbe0_scharber_pce": "<1.46887642178"}, "tool": "calculate_data", "answer": -0.173, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than {}?"}
{"question": "What is the maximum shear modulus recorded for materials with the chemical formula BaN2?", "refer_dataset": "table56", "column names": ["shear modulus", "formula"], "condition_column": {"formula": "="}, "answer_column": {"shear modulus": "max"}, "condition": {"formula": "=='BaN2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus recorded for materials with the chemical formula {}?"}
{"question": "What is the average methane conversion rate when Cation1 is Cr?", "refer_dataset": "table19", "column names": ["Cation1", "Temp CH4 conv"], "condition_column": {"Cation1": "="}, "answer_column": {"Temp CH4 conv": "avg"}, "condition": {"Cation1": "=='Cr'"}, "tool": "calculate_data", "answer": 750.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average methane conversion rate when Cation1 is {}?"}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 4.79 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<4.79"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals 0.221?", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_delta_e"], "condition_column": {"_oqmd_band_gap": "="}, "answer_column": {"_oqmd_delta_e": "max"}, "condition": {"_oqmd_band_gap": "=='0.221'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals {}?"}
{"question": "How many Preparations use both Anion1 16.0 and Support1 0.0, with C2-yield ≥ 0.9%?", "refer_dataset": "table20", "column names": ["Anion1", "Support1", "C2-yield", "Preparation"], "condition_column": {"Anion1": "=", "Support1": "=", "C2-yield": ">="}, "answer_column": {"Preparation": "count"}, "condition": {"Anion1": "=='16.0'", "Support1": "=='0.0'", "C2-yield": ">=0.9"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations use both Anion1 {} and Support1 {}, with C2-yield ≥ {}%?"}
{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 2.0, Indirect Bandgap < 0.0, and Lattice Parameter 4.2401957949?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='2.0'", "Indirect_Band": "<0.0", "Lattice": "=='4.2401957949'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
{"question": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than 7.576, I1b is greater than 7.55, and ρa exceeds 10.5?", "refer_dataset": "table2", "column names": ["I1a", "I1b", "ρa", "EAa"], "condition_column": {"I1a": "<", "I1b": ">", "ρa": ">"}, "answer_column": {"EAa": "avg"}, "condition": {"I1a": "<7.576", "I1b": ">7.55", "ρa": ">10.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than {}, I1b is greater than {}, and ρa exceeds {}?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -1.01286670421756.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-1.01286670421756'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Calculate the average chem_pot for symbol As?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='As'"}, "tool": "calculate_data", "answer": -3.08603175, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "What is the maximum shear modulus recorded for materials with the chemical formula Ca7Ge?", "refer_dataset": "table56", "column names": ["shear modulus", "formula"], "condition_column": {"formula": "="}, "answer_column": {"shear modulus": "max"}, "condition": {"formula": "=='Ca7Ge'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus recorded for materials with the chemical formula {}?"}
{"question": "What is the highest SSA observed when CT exceeds 850°C and preparation method is 3?", "refer_dataset": "table11", "column names": ["CT (℃)", "PM", "SSA (m2 g -1 )"], "condition_column": {"CT (℃)": ">", "PM": "="}, "answer_column": {"SSA (m2 g -1 )": "avg"}, "condition": {"CT (℃)": ">850", "PM": "=='3'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SSA observed when CT exceeds {}°C and preparation method is {}?"}
{"question": "What is the maximum overpotential V for Material Family d-metal, Functionalization 0.0, and Year 2017.0?", "refer_dataset": "table12", "column names": ["Material Family", "Functionalization", "Year", "overpotential V"], "condition_column": {"Material Family": "=", "Functionalization": "=", "Year": "="}, "answer_column": {"overpotential V": "max"}, "condition": {"Material Family": "=='d-metal'", "Functionalization": "=='0.0'", "Year": "=='2017.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum overpotential V for Material Family {}, Functionalization {}, and Year {}?"}
{"question": "How many preparation methods resulted in SSA > 19.7 m²/g and AH < 10.0 hours?", "refer_dataset": "table11", "column names": ["SSA (m2 g -1 )", "AH (h)", "PM"], "condition_column": {"SSA (m2 g -1 )": ">", "AH (h)": "<"}, "answer_column": {"PM": "count"}, "condition": {"SSA (m2 g -1 )": ">19.7", "AH (h)": "<10.0"}, "tool": "calculate_data", "answer": 14, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many preparation methods resulted in SSA > {} m²/g and AH < {} hours?"}
{"question": "What is the average indirect band gap for compounds in the crystal system hexagonal?", "refer_dataset": "table59", "column names": ["crystal_system", "indir_gap"], "condition_column": {"crystal_system": "="}, "answer_column": {"indir_gap": "avg"}, "condition": {"crystal_system": "=='hexagonal'"}, "tool": "calculate_data", "answer": 0.4708305084745763, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average indirect band gap for compounds in the crystal system {}?"}
{"question": "What is the minimum M1 atom number required to achieve C2s greater than 13.49?", "refer_dataset": "table17", "column names": ["M1_atom_number", "C2s"], "condition_column": {"C2s": ">"}, "answer_column": {"M1_atom_number": "min"}, "condition": {"C2s": ">13.49"}, "tool": "calculate_data", "answer": 25, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum M1 atom number required to achieve C2s greater than {}?"}
{"question": "What is the minimum elastic anisotropy for materials with energy above convex hull (e_hull) greater than 0.4086900892739997?", "refer_dataset": "table54", "column names": ["e_hull", "elastic anisotropy"], "condition_column": {"e_hull": ">"}, "answer_column": {"elastic anisotropy": "min"}, "condition": {"e_hull": ">0.4086900892739997"}, "tool": "calculate_data", "answer": 31.36, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum elastic anisotropy for materials with energy above convex hull (e_hull) greater than {}?"}
{"question": "For source_id mp-776922, what is the maximum total magnetization observed?", "refer_dataset": "table67", "column names": ["source_id", "total_magnetization"], "condition_column": {"source_id": "="}, "answer_column": {"total_magnetization": "max"}, "condition": {"source_id": "=='mp-776922'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For source_id {}, what is the maximum total magnetization observed?"}
{"question": "What is the average Degradation efficiency (%) when Surface area (m2/g) > 180.41, Pore Volume (cm3/g) < 0.32, and pH is 6.3?", "refer_dataset": "table6", "column names": ["Surface area (m2/g)", "Pore Volume (cm3/g)", "pH", "Degradation efficiency (%)"], "condition_column": {"Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<", "pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Surface area (m2/g)": ">180.41", "Pore Volume (cm3/g)": "<0.32", "pH": "=='6.3'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when Surface area (m2/g) > {}, Pore Volume (cm3/g) < {}, and pH is {}?"}
{"question": "Calculate the average A_AtomN for materials where Element B is H, Cn exceeds 1, and Formation Energy is below 0.72?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='H'", "Cn": ">1", "Formation_E": "<0.72"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "Find the minimum formation energy per atom for compounds in the space group number 12.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "min"}, "condition": {"spacegroup_number": "=='12'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum formation energy per atom for compounds in the space group number {}."}
{"question": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds 99.35 Å, the electronegativity of element B (χpb) is below 1.54, and the molar mass (M) is less than 140.96 g/mol?", "refer_dataset": "table3", "column names": ["Ra", "χpb", "M", "RH2(µmol h-1 g-1)"], "condition_column": {"Ra": ">", "χpb": "<", "M": "<"}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Ra": ">99.35", "χpb": "<1.54", "M": "<140.96"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds {} Å, the electronegativity of element B (χpb) is below {}, and the molar mass (M) is less than {} g/mol?"}
{"question": "Determine the total CO yield (COy) when Support_ID is 11 and M1_atom_number is less than 22.", "refer_dataset": "table17", "column names": ["Support_ID", "M1_atom_number", "COy"], "condition_column": {"Support_ID": "=", "M1_atom_number": "<"}, "answer_column": {"COy": "sum"}, "condition": {"Support_ID": "=='11'", "M1_atom_number": "<22"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total CO yield (COy) when Support_ID is {} and M1_atom_number is less than {}."}
{"question": "What is the maximum chem_pot where wycoff position is a and bulk_energy is above -78.51527999999999?", "refer_dataset": "table68", "column names": ["wycoff", "bulk_energy", "chem_pot"], "condition_column": {"wycoff": "=", "bulk_energy": ">"}, "answer_column": {"chem_pot": "max"}, "condition": {"wycoff": "=='a'", "bulk_energy": ">-78.51527999999999"}, "tool": "calculate_data", "answer": 2.52891025, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum chem_pot where wycoff position is {} and bulk_energy is above {}?"}
{"question": "What is the minimum Duration of cycles (h) when B site is Ga?", "refer_dataset": "table5", "column names": ["B site", "Duration of cycles (h)"], "condition_column": {"B site": "="}, "answer_column": {"Duration of cycles (h)": "min"}, "condition": {"B site": "=='Ga'"}, "tool": "calculate_data", "answer": 9.6, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Duration of cycles (h) when B site is {}?"}
{"question": "Identify materials where enthalpy (H) is greater than -40.79258728027344, energy gap (gap) is less than 6.3783488273620605, and R² spatial extent is above 292.43670654296875. What is their maximum internal energy (U)?", "refer_dataset": "table60", "column names": ["H", "gap", "r2", "U"], "condition_column": {"H": ">", "gap": "<", "r2": ">"}, "answer_column": {"U": "max"}, "condition": {"H": ">-40.79258728027344", "gap": "<6.3783488273620605", "r2": ">292.43670654296875"}, "tool": "calculate_data", "answer": -28.87805557250977, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where enthalpy (H) is greater than {}, energy gap (gap) is less than {}, and R² spatial extent is above {}. What is their maximum internal energy (U)?"}
{"question": "How many synthesized compounds have a net magnetic moment above 5.0?", "refer_dataset": "table62", "column names": ["synthesized", "net_magmom"], "condition_column": {"net_magmom": ">"}, "answer_column": {"synthesized": "count"}, "condition": {"net_magmom": ">5.0"}, "tool": "calculate_data", "answer": 358, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many synthesized compounds have a net magnetic moment above {}?"}
{"question": "Find the minimum activation energy for adsorbed species CCH* on surfaces with key 5 and elements of atomic number 78.", "refer_dataset": "table18", "column names": ["ab", "surfaces_key", "A_AtimicN", "activation_energy"], "condition_column": {"ab": "=", "surfaces_key": "=", "A_AtimicN": "="}, "answer_column": {"activation_energy": "min"}, "condition": {"ab": "=='CCH*'", "surfaces_key": "=='5'", "A_AtimicN": "=='78'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum activation energy for adsorbed species {} on surfaces with key {} and elements of atomic number {}."}
{"question": "What is the average Power(W) for materials where X is O, A mole is greater than 0.468, and Wave length(<nm) below 420.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='O'", "A mole": ">0.468", "Wave length(<nm)": "<420.0"}, "tool": "calculate_data", "answer": 359.1818181818182, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "What is the median atomic number of elements with activation energy below 0.68?", "refer_dataset": "table18", "column names": ["activation_energy", "A_AtimicN"], "condition_column": {"activation_energy": "<"}, "answer_column": {"A_AtimicN": "median"}, "condition": {"activation_energy": "<0.68"}, "tool": "calculate_data", "answer": [{"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 42}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 30}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 42}, {"A_AtimicN": 28}, {"A_AtimicN": 47}, {"A_AtimicN": 26}, {"A_AtimicN": 26}, {"A_AtimicN": 23}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 42}, {"A_AtimicN": 74}, {"A_AtimicN": 79}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 73}, {"A_AtimicN": 23}, {"A_AtimicN": 29}, {"A_AtimicN": 28}, {"A_AtimicN": 73}, {"A_AtimicN": 74}, {"A_AtimicN": 45}, {"A_AtimicN": 77}, {"A_AtimicN": 27}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 25}, {"A_AtimicN": 26}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 26}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 77}, {"A_AtimicN": 25}, {"A_AtimicN": 44}, {"A_AtimicN": 26}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 77}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 30}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 26}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median atomic number of elements with activation energy below {}?"}
{"question": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds 196.25 kJ/mol.", "refer_dataset": "table3", "column names": ["ΔfusHa", "B_Tm"], "condition_column": {"ΔfusHa": ">"}, "answer_column": {"B_Tm": "min"}, "condition": {"ΔfusHa": ">196.25"}, "tool": "calculate_data", "answer": 1854.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds {} kJ/mol."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -0.54667200640302.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-0.54667200640302'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the highest density for materials with pretty_formula equal to Mg2Sc?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='Mg2Sc'"}, "tool": "calculate_data", "answer": 2.215242605750484, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "What is the maximum Tc for materials with formula containing Sm0.8Pr0.2Ba2Cu3O6.55?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "max"}, "condition": {"formula": "=='Sm0.8Pr0.2Ba2Cu3O6.55'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Tc for materials with formula containing {}?"}
{"question": "Find the minimum formation energy per atom for compounds in the space group number 227.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "min"}, "condition": {"spacegroup_number": "=='227'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum formation energy per atom for compounds in the space group number {}."}
{"question": "Calculate the average chem_pot for symbol Pm?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Pm'"}, "tool": "calculate_data", "answer": -2.112661175, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below 1.122326739139944?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<1.122326739139944"}, "tool": "calculate_data", "answer": 20.232, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals 1.83?", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_delta_e"], "condition_column": {"_oqmd_band_gap": "="}, "answer_column": {"_oqmd_delta_e": "max"}, "condition": {"_oqmd_band_gap": "=='1.83'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals {}?"}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.336758152640558?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.336758152640558"}, "tool": "calculate_data", "answer": 0.0028439669421487595, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding 150.0°C?", "refer_dataset": "table7", "column names": ["Synhesis_Temp", "Reactor_Volume"], "condition_column": {"Synhesis_Temp": ">"}, "answer_column": {"Reactor_Volume": "min"}, "condition": {"Synhesis_Temp": ">150.0"}, "tool": "calculate_data", "answer": 1000.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding {}°C?"}
{"question": "What is the average Temperature when CH4-conversion% exceeds 4.4%?", "refer_dataset": "table20", "column names": ["Temperature", "CH4-conversion%"], "condition_column": {"CH4-conversion%": ">"}, "answer_column": {"Temperature": "avg"}, "condition": {"CH4-conversion%": ">4.4"}, "tool": "calculate_data", "answer": 1029.8994152046785, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Temperature when CH4-conversion% exceeds {}%?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -0.9418740379375 and the HOMO-LUMO gap (gap) is less than 1.48657793094747?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-0.9418740379375", "gap": "<1.48657793094747"}, "tool": "calculate_data", "answer": 1.87332692006567, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than 7.576, I1b is greater than 7.233, and ρa exceeds 10.5?", "refer_dataset": "table2", "column names": ["I1a", "I1b", "ρa", "EAa"], "condition_column": {"I1a": "<", "I1b": ">", "ρa": ">"}, "answer_column": {"EAa": "avg"}, "condition": {"I1a": "<7.576", "I1b": ">7.233", "ρa": ">10.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than {}, I1b is greater than {}, and ρa exceeds {}?"}
{"question": "How many references document samples calcined for over 2.0 hours?", "refer_dataset": "table1", "column names": ["Calcination time(h)", "Ref"], "condition_column": {"Calcination time(h)": ">"}, "answer_column": {"Ref": "count"}, "condition": {"Calcination time(h)": ">2.0"}, "tool": "calculate_data", "answer": 131, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document samples calcined for over {} hours?"}
{"question": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above 2.711958186340195.", "refer_dataset": "table66", "column names": ["avg_max", "surf_cbm"], "condition_column": {"avg_max": ">"}, "answer_column": {"surf_cbm": "min"}, "condition": {"avg_max": ">2.711958186340195"}, "tool": "calculate_data", "answer": 7.2798, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above {}."}
{"question": "Find the lowest e_hull value for materials where bandgap (gap pbe) is greater than 0.0 and shear modulus is less than 0.4398626224592421.", "refer_dataset": "table56", "column names": ["e_hull", "gap pbe", "shear modulus"], "condition_column": {"gap pbe": ">", "shear modulus": "<"}, "answer_column": {"e_hull": "min"}, "condition": {"gap pbe": ">0.0", "shear modulus": "<0.4398626224592421"}, "tool": "calculate_data", "answer": 1.2713673600000002, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest e_hull value for materials where bandgap (gap pbe) is greater than {} and shear modulus is less than {}."}
{"question": "Calculate the average Band_gap_GGA for Space_group_rlx 2, SOC False, and Magnetic_ordering \"NM\".", "refer_dataset": "table63", "column names": ["Space_group_rlx", "SOC", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "=", "SOC": "=", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "avg"}, "condition": {"Space_group_rlx": "=='2'", "SOC": "=='False'", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA for Space_group_rlx {}, SOC {}, and Magnetic_ordering \"{}\"."}
{"question": "Find the average CH4-conversion% for reactions where Cation1 = 12.0, Contact-times > 0.04, and O2-pressure < 0.084.", "refer_dataset": "table20", "column names": ["Cation1", "Contact-times", "O2-pressure", "CH4-conversion%"], "condition_column": {"Cation1": "=", "Contact-times": ">", "O2-pressure": "<"}, "answer_column": {"CH4-conversion%": "avg"}, "condition": {"Cation1": "=='12.0'", "Contact-times": ">0.04", "O2-pressure": "<0.084"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average CH4-conversion% for reactions where Cation1 = {}, Contact-times > {}, and O2-pressure < {}."}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.019272106249998, gap pbe > 0.0064000000000001, and mu_b > 0.0?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.019272106249998", "gap pbe": ">0.0064000000000001", "mu_b": ">0.0"}, "tool": "calculate_data", "answer": 337.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -6.57178733201573.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-6.57178733201573"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.0, gap pbe > 0.0, and mu_b > 5.6e-06?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.0", "gap pbe": ">0.0", "mu_b": ">5.6e-06"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "Determine the average H2 selectivity when Cation1 is V, Cation3Amount > 0%, and O2 conv < 20.8%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='V'", "Cation3Amount": ">0", "O2 conv": "<20.8"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 3.2 eV, light source UV–VIS, and Reaction medium gas-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<3.2", "light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'"}, "tool": "calculate_data", "answer": 4.549177631578947, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "Find the average Degradation efficiency (%) for Material MIL-101 when Catalyst dosage (g/L) > 0.1, Illumination time (min) > 10, and pH < 4.1.", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Illumination time (min)", "pH", "Degradation efficiency (%)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Illumination time (min)": ">", "pH": "<"}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.1", "Illumination time (min)": ">10", "pH": "<4.1"}, "tool": "calculate_data", "answer": 22.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Degradation efficiency (%) for Material {} when Catalyst dosage (g/L) > {}, Illumination time (min) > {}, and pH < {}."}
{"question": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"FM\", Space_group_rlx 1, and Band_gap_HSE > 2.884742.", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Space_group_rlx", "Band_gap_HSE", "Band_gap_GGA_optical"], "condition_column": {"Magnetic_ordering": "=", "Space_group_rlx": "=", "Band_gap_HSE": ">"}, "answer_column": {"Band_gap_GGA_optical": "avg"}, "condition": {"Magnetic_ordering": "=='FM'", "Space_group_rlx": "=='1'", "Band_gap_HSE": ">2.884742"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"{}\", Space_group_rlx {}, and Band_gap_HSE > {}."}
{"question": "What is the average journal impact factor for research institutions located in Israel?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='Israel'"}, "tool": "calculate_data", "answer": 6.7707999999999995, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "Determine the average journal impact factor for articles using 0 method in Peoples R China country with overpotential below 36.0 in neutral conditions.", "refer_dataset": "table13", "column names": ["Judge_Sol_Gel", "Country", "IF", "Neutral_OVP"], "condition_column": {"Judge_Sol_Gel": "=", "Country": "=", "Neutral_OVP": "<"}, "answer_column": {"IF": "avg"}, "condition": {"Judge_Sol_Gel": "=='0'", "Country": "=='Peoples R China'", "Neutral_OVP": "<36.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average journal impact factor for articles using {} method in {} country with overpotential below {} in neutral conditions."}
{"question": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below -10.549854278564451 and heat capacity (Cv) exceeds 6.468999862670898?", "refer_dataset": "table60", "column names": ["homo", "Cv", "zpve"], "condition_column": {"homo": "<", "Cv": ">"}, "answer_column": {"zpve": "avg"}, "condition": {"homo": "<-10.549854278564451", "Cv": ">6.468999862670898"}, "tool": "calculate_data", "answer": 0.4665936231613159, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below {} and heat capacity (Cv) exceeds {}?"}
{"question": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is Acetic acid, temperature (T) is 40°C, and initial concentration (C0) is below 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "C0, mg/L", "-log(k), min-1"], "condition_column": {"OC": "=", "T, oC": "=", "C0, mg/L": "<"}, "answer_column": {"-log(k), min-1": "max"}, "condition": {"OC": "=='Acetic acid'", "T, oC": "=='40'", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is {}, temperature (T) is {}°C, and initial concentration (C0) is below {} mg/L."}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 1.89978772768646.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<1.89978772768646"}, "tool": "calculate_data", "answer": [{"U": 6.19311549745637}, {"U": 5.74085587987803}, {"U": 5.85213296706841}, {"U": 4.54692058907546}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 2.9854853300983}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 4.28237851192289}, {"U": 3.78009136638114}, {"U": 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0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
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{"Band_gap_GGA": 0.957195}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Band_gap_GGA where Band_gap_HSE_optical < {}."}
{"question": "What is the maximum light intensity (I) recorded for organic compound Chlorobenzene with nanoparticle dose (D) ≥ 1.875 g/L and reaction rate (-log(k)) > 0.6302?", "refer_dataset": "table9", "column names": ["OC", "D, g/L", "-log(k), min-1", "I, mW/cm2"], "condition_column": {"OC": "=", "D, g/L": ">=", "-log(k), min-1": ">"}, "answer_column": {"I, mW/cm2": "max"}, "condition": {"OC": "=='Chlorobenzene'", "D, g/L": ">=1.875", "-log(k), min-1": ">0.6302"}, "tool": "calculate_data", "answer": 0.176, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum light intensity (I) recorded for organic compound {} with nanoparticle dose (D) ≥ {} g/L and reaction rate (-log(k)) > {}?"}
{"question": "Identify materials where the ionization energy of element B (I1b) exceeds 6.831 eV, the atomic radius of element B (Rb) is below 67.02 Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than 51.8 kJ/mol. What is their average hydrogen production rate (RH2)?", "refer_dataset": "table3", "column names": ["I1b", "Rb", "ΔfusHa", "RH2(µmol h-1 g-1)"], "condition_column": {"I1b": ">", "Rb": "<", "ΔfusHa": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "avg"}, "condition": {"I1b": ">6.831", "Rb": "<67.02", "ΔfusHa": ">51.8"}, "tool": "calculate_data", "answer": 92.75384615384615, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where the ionization energy of element B (I1b) exceeds {} eV, the atomic radius of element B (Rb) is below {} Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than {} kJ/mol. What is their average hydrogen production rate (RH2)?"}
{"question": "What is the average band_gap for materials with nelements equal to 3?", "refer_dataset": "table55", "column names": ["band_gap", "nelements"], "condition_column": {"nelements": "="}, "answer_column": {"band_gap": "avg"}, "condition": {"nelements": "=='3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average band_gap for materials with nelements equal to {}?"}
{"question": "What is the median Onset potential for alloys with Ru > 70.5%, Rh > 16.4%, and Pd < 2.3%?", "refer_dataset": "table15", "column names": ["Ru", "Rh", "Pd", "Onset"], "condition_column": {"Ru": ">", "Rh": ">", "Pd": "<"}, "answer_column": {"Onset": "median"}, "condition": {"Ru": ">70.5", "Rh": ">16.4", "Pd": "<2.3"}, "tool": "calculate_data", "answer": [{"Onset": 0.483707}, {"Onset": 0.483707}, {"Onset": 0.483699}, {"Onset": 0.483699}, {"Onset": 0.483707}, {"Onset": 0.483699}, {"Onset": 0.485668}, {"Onset": 0.485668}, {"Onset": 0.485668}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Onset potential for alloys with Ru > {}%, Rh > {}%, and Pd < {}%?"}
{"question": "Calculate the total final energy for all materials with formula MgF2 and indirect band gap greater than 5.328.", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "final_energy"], "condition_column": {"formula": "=", "indir_gap": ">"}, "answer_column": {"final_energy": "sum"}, "condition": {"formula": "=='MgF2'", "indir_gap": ">5.328"}, "tool": "calculate_data", "answer": -4339.196109155299, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total final energy for all materials with formula {} and indirect band gap greater than {}."}
{"question": "Retrieve the ID with the highest Tc for materials where formula contains Nb1Re3 and Tc exceeds 5.27.", "refer_dataset": "table65", "column names": ["id", "formula", "Tc"], "condition_column": {"formula": "=", "Tc": ">"}, "answer_column": {"id": "max"}, "condition": {"formula": "=='Nb1Re3'", "Tc": ">5.27"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Retrieve the ID with the highest Tc for materials where formula contains {} and Tc exceeds {}."}
{"question": "What is the average Power(W) for materials where X is S, A mole is greater than 0.189, and Wave length(<nm) below 420.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='S'", "A mole": ">0.189", "Wave length(<nm)": "<420.0"}, "tool": "calculate_data", "answer": 300.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 5.40310812450292?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">5.40310812450292"}, "tool": "calculate_data", "answer": -4.66662696287739, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "Materials with bandgap of 1.1619, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='1.1619'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "Determine the minimum CT needed for molecular formulas containing PrFeO3 when aged longer than 5 hours.", "refer_dataset": "table11", "column names": ["Molecular formulas", "AH (h)", "CT (℃)"], "condition_column": {"Molecular formulas": "=", "AH (h)": ">"}, "answer_column": {"CT (℃)": "min"}, "condition": {"Molecular formulas": "=='PrFeO3'", "AH (h)": ">5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum CT needed for molecular formulas containing {} when aged longer than {} hours."}
{"question": "How many Preparations have Contact-times shorter than 9.64 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<9.64"}, "tool": "calculate_data", "answer": 1818, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "What is the average Temperature when CH4-conversion% exceeds 4.6%?", "refer_dataset": "table20", "column names": ["Temperature", "CH4-conversion%"], "condition_column": {"CH4-conversion%": ">"}, "answer_column": {"Temperature": "avg"}, "condition": {"CH4-conversion%": ">4.6"}, "tool": "calculate_data", "answer": 1029.8650234741783, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Temperature when CH4-conversion% exceeds {}%?"}
{"question": "Find the minimum formation energy per atom for compounds in the space group number 139.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "min"}, "condition": {"spacegroup_number": "=='139'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum formation energy per atom for compounds in the space group number {}."}
{"question": "How many synthesized compounds have a net magnetic moment above 4.0?", "refer_dataset": "table62", "column names": ["synthesized", "net_magmom"], "condition_column": {"net_magmom": ">"}, "answer_column": {"synthesized": "count"}, "condition": {"net_magmom": ">4.0"}, "tool": "calculate_data", "answer": 380, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many synthesized compounds have a net magnetic moment above {}?"}
{"question": "What is the maximum chem_pot where wycoff position is c and bulk_energy is above -166.64562?", "refer_dataset": "table68", "column names": ["wycoff", "bulk_energy", "chem_pot"], "condition_column": {"wycoff": "=", "bulk_energy": ">"}, "answer_column": {"chem_pot": "max"}, "condition": {"wycoff": "=='c'", "bulk_energy": ">-166.64562"}, "tool": "calculate_data", "answer": 2.31789515, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum chem_pot where wycoff position is {} and bulk_energy is above {}?"}
{"question": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals 1e-06?", "refer_dataset": "table67", "column names": ["exfoliation_energy_per_atom", "total_magnetization"], "condition_column": {"total_magnetization": "="}, "answer_column": {"exfoliation_energy_per_atom": "max"}, "condition": {"total_magnetization": "=='1e-06'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals {}?"}
{"question": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > 1.386369?", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": ">"}, "answer_column": {"Band_gap_GGA": "min"}, "condition": {"Band_gap_HSE_optical": ">1.386369"}, "tool": "calculate_data", "answer": 9.123469, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) greater than -1.6240670545312503?", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": ">"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": ">-1.6240670545312503"}, "tool": "calculate_data", "answer": 133.39854437005226, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) greater than {}?"}
{"question": "Calculate the average overpotential in alkaline conditions for articles from Australia country.", "refer_dataset": "table13", "column names": ["Country", "Alkaline_OVP"], "condition_column": {"Country": "="}, "answer_column": {"Alkaline_OVP": "avg"}, "condition": {"Country": "=='Australia'"}, "tool": "calculate_data", "answer": 132.3607142857143, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average overpotential in alkaline conditions for articles from {} country."}
{"question": "How many references document samples calcined for over 72.0 hours?", "refer_dataset": "table1", "column names": ["Calcination time(h)", "Ref"], "condition_column": {"Calcination time(h)": ">"}, "answer_column": {"Ref": "count"}, "condition": {"Calcination time(h)": ">72.0"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document samples calcined for over {} hours?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -0.42290579590035 and the HOMO-LUMO gap (gap) is less than 1.12422472457635?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-0.42290579590035", "gap": "<1.12422472457635"}, "tool": "calculate_data", "answer": 1.87332692006567, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "Find the average Degradation efficiency (%) for Material MIL-101 when Catalyst dosage (g/L) > 0.1, Illumination time (min) > 0, and pH < 4.1.", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Illumination time (min)", "pH", "Degradation efficiency (%)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Illumination time (min)": ">", "pH": "<"}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.1", "Illumination time (min)": ">0", "pH": "<4.1"}, "tool": "calculate_data", "answer": 18.5, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Degradation efficiency (%) for Material {} when Catalyst dosage (g/L) > {}, Illumination time (min) > {}, and pH < {}."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -0.76304115349828.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-0.76304115349828'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the average reaction rate (-log(k)) when pH is 6.2?", "refer_dataset": "table9", "column names": ["pH", "-log(k), min-1"], "condition_column": {"pH": "="}, "answer_column": {"-log(k), min-1": "avg"}, "condition": {"pH": "=='6.2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction rate (-log(k)) when pH is {}?"}
{"question": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > 1.973007, synthesized as True, and sourced from CSD?", "refer_dataset": "table62", "column names": ["bandgap", "synthesized", "source", "pld"], "condition_column": {"bandgap": ">", "synthesized": "=", "source": "="}, "answer_column": {"pld": "min"}, "condition": {"bandgap": ">1.973007", "synthesized": "=='True'", "source": "=='CSD'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > {}, synthesized as {}, and sourced from {}?"}
{"question": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than 7.26?", "refer_dataset": "table2", "column names": ["ρb", "t"], "condition_column": {"ρb": "<"}, "answer_column": {"t": "avg"}, "condition": {"ρb": "<7.26"}, "tool": "calculate_data", "answer": 0.8769615384615387, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than {}?"}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 5.335048271%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">5.335048271"}, "tool": "calculate_data", "answer": 47.88292248, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "What is the median atomic number of elements with activation energy below 2.35?", "refer_dataset": "table18", "column names": ["activation_energy", "A_AtimicN"], "condition_column": {"activation_energy": "<"}, "answer_column": {"A_AtimicN": "median"}, "condition": {"activation_energy": "<2.35"}, "tool": "calculate_data", "answer": [{"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 26}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 79}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 25}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 47}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 27}, {"A_AtimicN": 78}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 42}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 42}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, 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{"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 47}, {"A_AtimicN": 45}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median atomic number of elements with activation energy below {}?"}
{"question": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"NM\", Space_group_rlx 122, and Band_gap_HSE > 2.166236.", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Space_group_rlx", "Band_gap_HSE", "Band_gap_GGA_optical"], "condition_column": {"Magnetic_ordering": "=", "Space_group_rlx": "=", "Band_gap_HSE": ">"}, "answer_column": {"Band_gap_GGA_optical": "avg"}, "condition": {"Magnetic_ordering": "=='NM'", "Space_group_rlx": "=='122'", "Band_gap_HSE": ">2.166236"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"{}\", Space_group_rlx {}, and Band_gap_HSE > {}."}
{"question": "List organic compounds (OC) with light intensity (I) greater than 1.51 mW/cm².", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2"], "condition_column": {"I, mW/cm2": ">"}, "answer_column": {"OC": ""}, "condition": {"I, mW/cm2": ">1.51"}, "tool": "calculate_data", "answer": [{"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Acetaminophen"}, {"OC": "beta-blocker atenolol"}, {"OC": "Sulfanilamide"}, {"OC": "Sulfacetamide natrium salt"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfadiazine natrium salt"}, {"OC": "Sulfathiazole natrium salt"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iopromide"}, {"OC": "Atrazine"}, {"OC": "Cyanazine"}, {"OC": "Irgarol"}, {"OC": "Prometryne"}, {"OC": "Propazine"}, {"OC": "Dichlofenthion"}, {"OC": "Bromophos ethyl"}, {"OC": "Bromophos methyl"}, {"OC": "Parathion ethyl"}, {"OC": "Parathion methyl"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "Phorate"}, {"OC": "Phorate"}, {"OC": "Phorate"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List organic compounds (OC) with light intensity (I) greater than {} mW/cm²."}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -1.01286670421756 and Gibbs free energy (G) under 4.25509807814267.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-1.01286670421756", "G": "<4.25509807814267"}, "tool": "calculate_data", "answer": -2.0138415088612813, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "Find the median Band_gap_GGA where Band_gap_HSE_optical < 0.65611.", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": "<"}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Band_gap_HSE_optical": "<0.65611"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.116559}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.021041}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.135669}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.1012110000000001}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.095012}, {"Band_gap_GGA": 0.0501729999999991}, {"Band_gap_GGA": 0.035107}, {"Band_gap_GGA": 0.035018}, {"Band_gap_GGA": 0.036726}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.335461}, {"Band_gap_GGA": 0.285212}, {"Band_gap_GGA": 0.198114}, {"Band_gap_GGA": 0.0156169999999997}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.131433}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.067083}, {"Band_gap_GGA": 0.162911}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.220214}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.2038489999999999}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.048536}, {"Band_gap_GGA": 0.038092}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.096644}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.208564}, {"Band_gap_GGA": 0.016113}, {"Band_gap_GGA": 0.025665}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.076361}, {"Band_gap_GGA": 0.1761590000000001}, {"Band_gap_GGA": 0.0880399999999999}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.046588}, {"Band_gap_GGA": 0.052264}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.086018}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.23854}, {"Band_gap_GGA": 0.224857}, {"Band_gap_GGA": 0.026395}, {"Band_gap_GGA": 0.177484}, {"Band_gap_GGA": 0.323713}, {"Band_gap_GGA": 0.011479}, {"Band_gap_GGA": 0.191293}, {"Band_gap_GGA": 0.089123}, {"Band_gap_GGA": 0.288479}, {"Band_gap_GGA": 0.207136}, {"Band_gap_GGA": 0.08064}, {"Band_gap_GGA": 0.030189}, {"Band_gap_GGA": 0.035519}, {"Band_gap_GGA": 0.053101}, {"Band_gap_GGA": 0.2885100000000005}, {"Band_gap_GGA": 0.139055}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0537489999999998}, {"Band_gap_GGA": 0.076168}, {"Band_gap_GGA": 0.058314}, {"Band_gap_GGA": 0.053609}, {"Band_gap_GGA": 0.222214}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.118526}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.516672}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.079423}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.023344}, {"Band_gap_GGA": 0.137577}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.066141}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.229184}, {"Band_gap_GGA": 0.062749}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0562809999999998}, {"Band_gap_GGA": 0.088268}, {"Band_gap_GGA": 0.067216}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.139867}, {"Band_gap_GGA": 0.019902}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.010004}, {"Band_gap_GGA": 0.0510400000000004}, {"Band_gap_GGA": 0.077827}, {"Band_gap_GGA": 0.174608}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Band_gap_GGA where Band_gap_HSE_optical < {}."}
{"question": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx 33.", "refer_dataset": "table63", "column names": ["Space_group_rlx", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "="}, "answer_column": {"Band_gap_GGA": "max"}, "condition": {"Space_group_rlx": "=='33'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx {}."}
{"question": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals 1.741?", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_delta_e"], "condition_column": {"_oqmd_band_gap": "="}, "answer_column": {"_oqmd_delta_e": "max"}, "condition": {"_oqmd_band_gap": "=='1.741'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals {}?"}
{"question": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding -2.7000000000000004e-06?", "refer_dataset": "table54", "column names": ["mu_b", "shear modulus"], "condition_column": {"mu_b": ">"}, "answer_column": {"shear modulus": "max"}, "condition": {"mu_b": ">-2.7000000000000004e-06"}, "tool": "calculate_data", "answer": 420.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding {}?"}
{"question": "Determine the minimum pH where Material is PI-UiO-66-NH2, Surface area (m2/g) > 922.75, and Pore Volume (cm3/g) < 0.5.", "refer_dataset": "table6", "column names": ["Material", "Surface area (m2/g)", "Pore Volume (cm3/g)", "pH"], "condition_column": {"Material": "=", "Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<"}, "answer_column": {"pH": "min"}, "condition": {"Material": "=='PI-UiO-66-NH2'", "Surface area (m2/g)": ">922.75", "Pore Volume (cm3/g)": "<0.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum pH where Material is {}, Surface area (m2/g) > {}, and Pore Volume (cm3/g) < {}."}
{"question": "Calculate the maximum formation energy per atom for materials with space group number 12.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "max"}, "condition": {"spacegroup_number": "=='12'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum formation energy per atom for materials with space group number {}."}
{"question": "How many preparation methods resulted in SSA > 20.63 m²/g and AH < 4.0 hours?", "refer_dataset": "table11", "column names": ["SSA (m2 g -1 )", "AH (h)", "PM"], "condition_column": {"SSA (m2 g -1 )": ">", "AH (h)": "<"}, "answer_column": {"PM": "count"}, "condition": {"SSA (m2 g -1 )": ">20.63", "AH (h)": "<4.0"}, "tool": "calculate_data", "answer": 3, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many preparation methods resulted in SSA > {} m²/g and AH < {} hours?"}
{"question": "What is the maximum CH4 conversion (%) recorded when M1 is Zn, temperature exceeds 850°C, and total flow is below 20 mL/min?", "refer_dataset": "table21", "column names": ["M1", "Temp. (°C)", "Total flow(mL/min)", "CH4 conversion (%)"], "condition_column": {"M1": "=", "Temp. (°C)": ">", "Total flow(mL/min)": "<"}, "answer_column": {"CH4 conversion (%)": "max"}, "condition": {"M1": "=='Zn'", "Temp. (°C)": ">850", "Total flow(mL/min)": "<20"}, "tool": "calculate_data", "answer": 42.87787393, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum CH4 conversion (%) recorded when M1 is {}, temperature exceeds {}°C, and total flow is below {} mL/min?"}
{"question": "What is the average pH for catalysts where Year is 1995.0?", "refer_dataset": "table12", "column names": ["Year", "pH"], "condition_column": {"Year": "="}, "answer_column": {"pH": "avg"}, "condition": {"Year": "=='1995.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average pH for catalysts where Year is {}?"}
{"question": "Determine the average LUMO energy for materials with polarizability (alpha) less than 16.280000686645508?", "refer_dataset": "table60", "column names": ["alpha", "lumo"], "condition_column": {"alpha": "<"}, "answer_column": {"lumo": "avg"}, "condition": {"alpha": "<16.280000686645508"}, "tool": "calculate_data", "answer": 1.998676319917043, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average LUMO energy for materials with polarizability (alpha) less than {}?"}
{"question": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than 5.586, I1b is greater than 7.822, and ρa exceeds 5.89?", "refer_dataset": "table2", "column names": ["I1a", "I1b", "ρa", "EAa"], "condition_column": {"I1a": "<", "I1b": ">", "ρa": ">"}, "answer_column": {"EAa": "avg"}, "condition": {"I1a": "<5.586", "I1b": ">7.822", "ρa": ">5.89"}, "tool": "calculate_data", "answer": 34.90909090909091, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than {}, I1b is greater than {}, and ρa exceeds {}?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 8.0?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">8.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "What is the average bulk_energy for bulk_formula As?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='As'"}, "tool": "calculate_data", "answer": -109.73781, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "What is the maximum BandGap(eV) for composites with X1 substitution nan, Sac. Agent1 equal to nan, and Power(W) less than 400.0?", "refer_dataset": "table4", "column names": ["X1", "Sac. Agent1", "Power(W)", "BandGap(eV)"], "condition_column": {"X1": "=", "Sac. Agent1": "=", "Power(W)": "<"}, "answer_column": {"BandGap(eV)": "max"}, "condition": {"X1": "=='nan'", "Sac. Agent1": "=='nan'", "Power(W)": "<400.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum BandGap(eV) for composites with X1 substitution {}, Sac. Agent1 equal to {}, and Power(W) less than {}?"}
{"question": "What is the average formation energy (ef) for bulk_formula Ba and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Ba'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 1.19343, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "What is the total sum of optb88vdw_cbm values where offset equals 0.03823686597440634?", "refer_dataset": "table52", "column names": ["optb88vdw_cbm", "offset"], "condition_column": {"offset": "="}, "answer_column": {"optb88vdw_cbm": "sum"}, "condition": {"offset": "=='0.03823686597440634'"}, "tool": "calculate_data", "answer": 7.6845, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total sum of optb88vdw_cbm values where offset equals {}?"}
{"question": "Determine the average H2 selectivity when Cation1 is Fe, Cation3Amount > 0%, and O2 conv < 4.2%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='Fe'", "Cation3Amount": ">0", "O2 conv": "<4.2"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "Find the highest defective_energy where wycoff position is k and material_type is 2D?", "refer_dataset": "table68", "column names": ["wycoff", "material_type", "defective_energy"], "condition_column": {"wycoff": "=", "material_type": "="}, "answer_column": {"defective_energy": "max"}, "condition": {"wycoff": "=='k'", "material_type": "=='2D'"}, "tool": "calculate_data", "answer": -58.5392212, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest defective_energy where wycoff position is {} and material_type is {}?"}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -6.18353212813309.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-6.18353212813309"}, "tool": "calculate_data", "answer": -3.752960655880675, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "For source_id mp-634859, what is the maximum total magnetization observed?", "refer_dataset": "table67", "column names": ["source_id", "total_magnetization"], "condition_column": {"source_id": "="}, "answer_column": {"total_magnetization": "max"}, "condition": {"source_id": "=='mp-634859'"}, "tool": "calculate_data", "answer": -0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For source_id {}, what is the maximum total magnetization observed?"}
{"question": "What is the minimum M1 atom number required to achieve C2s greater than 26.03?", "refer_dataset": "table17", "column names": ["M1_atom_number", "C2s"], "condition_column": {"C2s": ">"}, "answer_column": {"M1_atom_number": "min"}, "condition": {"C2s": ">26.03"}, "tool": "calculate_data", "answer": 25, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum M1 atom number required to achieve C2s greater than {}?"}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.0091570339285702, gap pbe > 0.5765000000000002, and mu_b > 0.0002352?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.0091570339285702", "gap pbe": ">0.5765000000000002", "mu_b": ">0.0002352"}, "tool": "calculate_data", "answer": 129.039620746174, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "Find the median Band_gap_GGA where Band_gap_HSE_optical < 2.987947.", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": "<"}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Band_gap_HSE_optical": "<2.987947"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.137147}, {"Band_gap_GGA": 1.07639}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.150497}, {"Band_gap_GGA": 0.726702}, {"Band_gap_GGA": 1.119908}, {"Band_gap_GGA": 0.684651}, {"Band_gap_GGA": 1.173072}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.426179}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.846528}, {"Band_gap_GGA": 1.082826}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.29665}, {"Band_gap_GGA": 0.812729}, {"Band_gap_GGA": 1.253241}, {"Band_gap_GGA": 1.521543}, {"Band_gap_GGA": 0.121138}, {"Band_gap_GGA": 1.327256}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.763006}, {"Band_gap_GGA": 1.6843169999999996}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.080963}, {"Band_gap_GGA": 1.472881}, {"Band_gap_GGA": 0.736109}, {"Band_gap_GGA": 1.199719}, {"Band_gap_GGA": 0.476453}, {"Band_gap_GGA": 0.049785}, {"Band_gap_GGA": 0.796627}, {"Band_gap_GGA": 0.517763}, {"Band_gap_GGA": 0.451375}, {"Band_gap_GGA": 0.041666}, {"Band_gap_GGA": 1.3973739999999997}, {"Band_gap_GGA": 1.20222}, {"Band_gap_GGA": 0.116559}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.015877}, {"Band_gap_GGA": 0.522174}, {"Band_gap_GGA": 0.189223}, {"Band_gap_GGA": 1.000199}, {"Band_gap_GGA": 0.58384}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.484641}, {"Band_gap_GGA": 1.00246}, {"Band_gap_GGA": 1.465159}, {"Band_gap_GGA": 1.460508}, {"Band_gap_GGA": 1.461365}, {"Band_gap_GGA": 1.2176}, {"Band_gap_GGA": 0.2031569999999999}, {"Band_gap_GGA": 1.817097}, {"Band_gap_GGA": 1.446497}, {"Band_gap_GGA": 1.58958}, {"Band_gap_GGA": 0.585286}, {"Band_gap_GGA": 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{"Band_gap_GGA": 0.948373}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.107766}, {"Band_gap_GGA": 0.694422}, {"Band_gap_GGA": 0.0562809999999998}, {"Band_gap_GGA": 1.036323}, {"Band_gap_GGA": 0.171988}, {"Band_gap_GGA": 0.27927}, {"Band_gap_GGA": 0.234652}, {"Band_gap_GGA": 0.7615030000000003}, {"Band_gap_GGA": 1.544613}, {"Band_gap_GGA": 1.31607}, {"Band_gap_GGA": 1.316416}, {"Band_gap_GGA": 0.402799}, {"Band_gap_GGA": 0.088268}, {"Band_gap_GGA": 0.067216}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.847272}, {"Band_gap_GGA": 0.150814}, {"Band_gap_GGA": 1.399854}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.4483290000000002}, {"Band_gap_GGA": 0.853373}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.6343740000000002}, {"Band_gap_GGA": 0.139867}, {"Band_gap_GGA": 1.115415}, {"Band_gap_GGA": 0.771148}, {"Band_gap_GGA": 0.976555}, {"Band_gap_GGA": 1.557849}, {"Band_gap_GGA": 1.633676}, {"Band_gap_GGA": 0.920657}, {"Band_gap_GGA": 0.205956}, {"Band_gap_GGA": 1.71997}, {"Band_gap_GGA": 1.51727}, {"Band_gap_GGA": 1.443119}, {"Band_gap_GGA": 0.694658}, {"Band_gap_GGA": 0.019902}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.384628}, {"Band_gap_GGA": 0.314184}, {"Band_gap_GGA": 0.643368}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.486282}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.253425}, {"Band_gap_GGA": 1.330901}, {"Band_gap_GGA": 1.03743}, {"Band_gap_GGA": 0.760511}, {"Band_gap_GGA": 0.584094}, {"Band_gap_GGA": 0.093158}, {"Band_gap_GGA": 1.439265}, {"Band_gap_GGA": 1.421708}, {"Band_gap_GGA": 2.04851}, {"Band_gap_GGA": 0.842622}, {"Band_gap_GGA": 0.949039}, {"Band_gap_GGA": 0.724597}, {"Band_gap_GGA": 0.837015}, {"Band_gap_GGA": 1.455516}, {"Band_gap_GGA": 0.290432}, {"Band_gap_GGA": 0.826254}, {"Band_gap_GGA": 1.64183}, {"Band_gap_GGA": 1.93449}, {"Band_gap_GGA": 1.119125}, {"Band_gap_GGA": 0.6241520000000003}, {"Band_gap_GGA": 1.019836}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.923932}, {"Band_gap_GGA": 0.757078}, {"Band_gap_GGA": 1.7609190000000003}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.6734}, {"Band_gap_GGA": 1.2019609999999998}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.968891}, {"Band_gap_GGA": 0.234348}, {"Band_gap_GGA": 1.750215}, {"Band_gap_GGA": 1.36233}, {"Band_gap_GGA": 0.233836}, {"Band_gap_GGA": 1.469292}, {"Band_gap_GGA": 1.469212}, {"Band_gap_GGA": 1.468394}, {"Band_gap_GGA": 0.407743}, {"Band_gap_GGA": 1.30954}, {"Band_gap_GGA": 1.078913}, {"Band_gap_GGA": 0.943632}, {"Band_gap_GGA": 1.1217720000000002}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.466457}, {"Band_gap_GGA": 0.477402}, {"Band_gap_GGA": 0.515604}, {"Band_gap_GGA": 0.572337}, {"Band_gap_GGA": 0.616294}, {"Band_gap_GGA": 0.115481}, {"Band_gap_GGA": 0.873755}, {"Band_gap_GGA": 0.844649}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.004875}, {"Band_gap_GGA": 1.05979}, {"Band_gap_GGA": 1.056981}, {"Band_gap_GGA": 0.614837}, {"Band_gap_GGA": 0.16959}, {"Band_gap_GGA": 0.665825}, {"Band_gap_GGA": 1.47226}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.525486}, {"Band_gap_GGA": 0.70457}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.256404}, {"Band_gap_GGA": 1.550506}, {"Band_gap_GGA": 1.77982}, {"Band_gap_GGA": 1.379217}, {"Band_gap_GGA": 1.461383}, {"Band_gap_GGA": 0.962026}, {"Band_gap_GGA": 0.498645}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.064657}, {"Band_gap_GGA": 1.76803}, {"Band_gap_GGA": 1.381861}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.321152}, {"Band_gap_GGA": 0.707323}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.417882}, {"Band_gap_GGA": 0.780584}, {"Band_gap_GGA": 0.3010500000000005}, {"Band_gap_GGA": 1.014796}, {"Band_gap_GGA": 1.1879239999999998}, {"Band_gap_GGA": 1.082056}, {"Band_gap_GGA": 0.619668}, {"Band_gap_GGA": 1.669786}, {"Band_gap_GGA": 1.088248}, {"Band_gap_GGA": 0.7087529999999989}, {"Band_gap_GGA": 0.010004}, {"Band_gap_GGA": 0.0510400000000004}, {"Band_gap_GGA": 1.7838190000000005}, {"Band_gap_GGA": 0.4122590000000006}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.122611}, {"Band_gap_GGA": 0.599232}, {"Band_gap_GGA": 0.795217}, {"Band_gap_GGA": 0.441676}, {"Band_gap_GGA": 0.569089}, {"Band_gap_GGA": 0.4406449999999999}, {"Band_gap_GGA": 0.593264}, {"Band_gap_GGA": 0.1285660000000001}, {"Band_gap_GGA": 1.063134}, {"Band_gap_GGA": 0.04091}, {"Band_gap_GGA": 0.114593}, {"Band_gap_GGA": 0.046088}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.9551550000000002}, {"Band_gap_GGA": 0.8245889999999998}, {"Band_gap_GGA": 0.848223}, {"Band_gap_GGA": 0.07145}, {"Band_gap_GGA": 0.776494}, {"Band_gap_GGA": 1.031638}, {"Band_gap_GGA": 0.013837}, {"Band_gap_GGA": 1.069505}, {"Band_gap_GGA": 1.478028}, {"Band_gap_GGA": 1.016602}, {"Band_gap_GGA": 0.813493}, {"Band_gap_GGA": 1.918516}, {"Band_gap_GGA": 0.942312}, {"Band_gap_GGA": 1.052641}, {"Band_gap_GGA": 0.974305}, {"Band_gap_GGA": 1.253559}, {"Band_gap_GGA": 1.702772}, {"Band_gap_GGA": 1.068715}, {"Band_gap_GGA": 0.798378}, {"Band_gap_GGA": 1.400749}, {"Band_gap_GGA": 1.123257}, {"Band_gap_GGA": 1.027479}, {"Band_gap_GGA": 2.000535}, {"Band_gap_GGA": 0.731232}, {"Band_gap_GGA": 1.794819}, {"Band_gap_GGA": 1.794836}, {"Band_gap_GGA": 2.147943}, {"Band_gap_GGA": 1.105534}, {"Band_gap_GGA": 0.140116}, {"Band_gap_GGA": 2.029843}, {"Band_gap_GGA": 1.48767}, {"Band_gap_GGA": 1.613056}, {"Band_gap_GGA": 2.145223}, {"Band_gap_GGA": 1.204301}, {"Band_gap_GGA": 0.868662}, {"Band_gap_GGA": 0.429583}, {"Band_gap_GGA": 2.28785}, {"Band_gap_GGA": 1.009335}, {"Band_gap_GGA": 1.325181}, {"Band_gap_GGA": 0.8734719999999996}, {"Band_gap_GGA": 0.611021}, {"Band_gap_GGA": 2.570189}, {"Band_gap_GGA": 0.430945}, {"Band_gap_GGA": 1.894755}, {"Band_gap_GGA": 0.499722}, {"Band_gap_GGA": 1.13968}, {"Band_gap_GGA": 1.476618}, {"Band_gap_GGA": 1.4191330000000002}, {"Band_gap_GGA": 0.731782}, {"Band_gap_GGA": 0.138691}, {"Band_gap_GGA": 1.911492}, {"Band_gap_GGA": 1.004588}, {"Band_gap_GGA": 1.287787}, {"Band_gap_GGA": 0.8474620000000002}, {"Band_gap_GGA": 1.7024890000000004}, {"Band_gap_GGA": 1.190505}, {"Band_gap_GGA": 0.835267}, {"Band_gap_GGA": 0.822738}, {"Band_gap_GGA": 0.357758}, {"Band_gap_GGA": 2.102841}, {"Band_gap_GGA": 0.686362}, {"Band_gap_GGA": 0.925348}, {"Band_gap_GGA": 0.077827}, {"Band_gap_GGA": 0.208789}, {"Band_gap_GGA": 1.645783}, {"Band_gap_GGA": 1.129361}, {"Band_gap_GGA": 1.654697}, {"Band_gap_GGA": 1.667675}, {"Band_gap_GGA": 1.614546}, {"Band_gap_GGA": 0.927177}, {"Band_gap_GGA": 1.457538}, {"Band_gap_GGA": 0.952176}, {"Band_gap_GGA": 0.876747}, {"Band_gap_GGA": 1.211805}, {"Band_gap_GGA": 1.876854}, {"Band_gap_GGA": 1.490522}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.986507}, {"Band_gap_GGA": 1.330583}, {"Band_gap_GGA": 1.243413}, {"Band_gap_GGA": 1.997233}, {"Band_gap_GGA": 2.029982}, {"Band_gap_GGA": 0.949497}, {"Band_gap_GGA": 2.147805}, {"Band_gap_GGA": 2.14552}, {"Band_gap_GGA": 0.903644}, {"Band_gap_GGA": 1.284232}, {"Band_gap_GGA": 1.125111}, {"Band_gap_GGA": 0.96445}, {"Band_gap_GGA": 0.962134}, {"Band_gap_GGA": 0.4111180000000001}, {"Band_gap_GGA": 1.520556}, {"Band_gap_GGA": 1.032317}, {"Band_gap_GGA": 1.55756}, {"Band_gap_GGA": 0.910215}, {"Band_gap_GGA": 1.382571}, {"Band_gap_GGA": 0.606807}, {"Band_gap_GGA": 1.743149}, {"Band_gap_GGA": 0.823484}, {"Band_gap_GGA": 0.727435}, {"Band_gap_GGA": 0.188778}, {"Band_gap_GGA": 1.12308}, {"Band_gap_GGA": 0.999406}, {"Band_gap_GGA": 1.439385}, {"Band_gap_GGA": 1.03154}, {"Band_gap_GGA": 0.827258}, {"Band_gap_GGA": 0.275451}, {"Band_gap_GGA": 0.689105}, {"Band_gap_GGA": 0.394198}, {"Band_gap_GGA": 1.463383}, {"Band_gap_GGA": 1.185585}, {"Band_gap_GGA": 0.99778}, {"Band_gap_GGA": 0.853574}, {"Band_gap_GGA": 1.034119}, {"Band_gap_GGA": 1.201798}, {"Band_gap_GGA": 0.044612}, {"Band_gap_GGA": 0.174608}, {"Band_gap_GGA": 1.263702}, {"Band_gap_GGA": 1.68655}, {"Band_gap_GGA": 1.8878}, {"Band_gap_GGA": 1.207162}, {"Band_gap_GGA": 0.3737000000000003}, {"Band_gap_GGA": 0.970382}, {"Band_gap_GGA": 0.93313}, {"Band_gap_GGA": 1.666143}, {"Band_gap_GGA": 1.429847}, {"Band_gap_GGA": 0.645766}, {"Band_gap_GGA": 0.423326}, {"Band_gap_GGA": 1.549965}, {"Band_gap_GGA": 1.074611}, {"Band_gap_GGA": 0.855654}, {"Band_gap_GGA": 1.769321}, {"Band_gap_GGA": 1.109291}, {"Band_gap_GGA": 0.129031}, {"Band_gap_GGA": 0.818666}, {"Band_gap_GGA": 1.409758}, {"Band_gap_GGA": 1.573899}, {"Band_gap_GGA": 1.612963}, {"Band_gap_GGA": 1.51003}, {"Band_gap_GGA": 0.90871}, {"Band_gap_GGA": 0.654414}, {"Band_gap_GGA": 0.662021}, {"Band_gap_GGA": 0.444592}, {"Band_gap_GGA": 0.140697}, {"Band_gap_GGA": 0.060698}, {"Band_gap_GGA": 0.924272}, {"Band_gap_GGA": 1.215515}, {"Band_gap_GGA": 0.811707}, {"Band_gap_GGA": 0.600486}, {"Band_gap_GGA": 1.732283}, {"Band_gap_GGA": 1.634283}, {"Band_gap_GGA": 1.634473}, {"Band_gap_GGA": 1.235843}, {"Band_gap_GGA": 0.13966}, {"Band_gap_GGA": 1.315377}, {"Band_gap_GGA": 1.181219}, {"Band_gap_GGA": 1.544537}, {"Band_gap_GGA": 1.562761}, {"Band_gap_GGA": 0.97917}, {"Band_gap_GGA": 0.892895}, {"Band_gap_GGA": 0.456143}, {"Band_gap_GGA": 0.568376}, {"Band_gap_GGA": 1.420798}, {"Band_gap_GGA": 1.175897}, {"Band_gap_GGA": 0.477598}, {"Band_gap_GGA": 1.015622}, {"Band_gap_GGA": 1.70482}, {"Band_gap_GGA": 1.607063}, {"Band_gap_GGA": 0.093388}, {"Band_gap_GGA": 0.16859}, {"Band_gap_GGA": 0.332569}, {"Band_gap_GGA": 1.783169}, {"Band_gap_GGA": 0.1090209999999999}, {"Band_gap_GGA": 1.666039}, {"Band_gap_GGA": 1.381963}, {"Band_gap_GGA": 0.987243}, {"Band_gap_GGA": 0.768662}, {"Band_gap_GGA": 0.887118}, {"Band_gap_GGA": 0.852572}, {"Band_gap_GGA": 0.204799}, {"Band_gap_GGA": 0.5355}, {"Band_gap_GGA": 0.775819}, {"Band_gap_GGA": 1.27965}, {"Band_gap_GGA": 0.380005}, {"Band_gap_GGA": 0.957195}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Band_gap_GGA where Band_gap_HSE_optical < {}."}
{"question": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below 727.0 K, the electron affinity of element A (EAa) exceeds 14.0 eV, and the hydrogen production rate (RH2) is higher than 45.0 µmol h⁻¹ g⁻¹.", "refer_dataset": "table3", "column names": ["A_Tm", "EAa", "RH2(µmol h-1 g-1)", "χpb"], "condition_column": {"A_Tm": "<", "EAa": ">", "RH2(µmol h-1 g-1)": ">"}, "answer_column": {"χpb": "median"}, "condition": {"A_Tm": "<727.0", "EAa": ">14.0", "RH2(µmol h-1 g-1)": ">45.0"}, "tool": "calculate_data", "answer": [{"χpb": 1.54}, {"χpb": 1.66}, {"χpb": 1.6}, {"χpb": 1.6}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.52}, {"χpb": 1.53}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.55}, {"χpb": 1.51}, {"χpb": 1.54}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below {} K, the electron affinity of element A (EAa) exceeds {} eV, and the hydrogen production rate (RH2) is higher than {} µmol h⁻¹ g⁻¹."}
{"question": "How many entries have a wycoff position of j?", "refer_dataset": "table68", "column names": ["wycoff", "jid"], "condition_column": {"wycoff": "="}, "answer_column": {"jid": "count"}, "condition": {"wycoff": "=='j'"}, "tool": "calculate_data", "answer": 4, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have a wycoff position of {}?"}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.8491.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.8491"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > 96.0% in under 20.0 minutes of illumination for pH = 10.0?", "refer_dataset": "table8", "column names": ["Catalyst/Pollutant mass ratio", "Degradation rate(%)", "Illumination time(min)", "pH"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "pH": "="}, "answer_column": {"Catalyst/Pollutant mass ratio": ""}, "condition": {"Degradation rate(%)": ">96.0", "Illumination time(min)": "<20.0", "pH": "=='10.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > {}% in under {} minutes of illumination for pH = {}?"}
{"question": "How many catalysts use M1 as Zn, M2 as Mo, and achieve CH4 conversion (%) above 19.83584735%?", "refer_dataset": "table21", "column names": ["M1", "M2", "CH4 conversion (%)", "Code"], "condition_column": {"M1": "=", "M2": "=", "CH4 conversion (%)": ">"}, "answer_column": {"Code": "count"}, "condition": {"M1": "=='Zn'", "M2": "=='Mo'", "CH4 conversion (%)": ">19.83584735"}, "tool": "calculate_data", "answer": 46, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many catalysts use M1 as {}, M2 as {}, and achieve CH4 conversion (%) above {}%?"}
{"question": "What is the maximum shear modulus recorded for materials with the chemical formula Mo3P?", "refer_dataset": "table56", "column names": ["shear modulus", "formula"], "condition_column": {"formula": "="}, "answer_column": {"shear modulus": "max"}, "condition": {"formula": "=='Mo3P'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus recorded for materials with the chemical formula {}?"}
{"question": "What is the average pH for catalysts where Year is 2015.0?", "refer_dataset": "table12", "column names": ["Year", "pH"], "condition_column": {"Year": "="}, "answer_column": {"pH": "avg"}, "condition": {"Year": "=='2015.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average pH for catalysts where Year is {}?"}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.226107440851378?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.226107440851378"}, "tool": "calculate_data", "answer": 0.008613831258644537, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "What is the minimum M1 atom number required to achieve C2s greater than 36.39?", "refer_dataset": "table17", "column names": ["M1_atom_number", "C2s"], "condition_column": {"C2s": ">"}, "answer_column": {"M1_atom_number": "min"}, "condition": {"C2s": ">36.39"}, "tool": "calculate_data", "answer": 25, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum M1 atom number required to achieve C2s greater than {}?"}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) C1CO1?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='C1CO1'"}, "tool": "calculate_data", "answer": -3.77761754412191, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above 0.8322?", "refer_dataset": "table9", "column names": ["T, oC", "-log(k), min-1"], "condition_column": {"-log(k), min-1": ">"}, "answer_column": {"T, oC": "avg"}, "condition": {"-log(k), min-1": ">0.8322"}, "tool": "calculate_data", "answer": 27.510703363914374, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above {}?"}
{"question": "What is the average pH for catalysts where Year is 2016.0?", "refer_dataset": "table12", "column names": ["Year", "pH"], "condition_column": {"Year": "="}, "answer_column": {"pH": "avg"}, "condition": {"Year": "=='2016.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average pH for catalysts where Year is {}?"}
{"question": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than 5.139, I1b is greater than 7.154, and ρa exceeds 0.97?", "refer_dataset": "table2", "column names": ["I1a", "I1b", "ρa", "EAa"], "condition_column": {"I1a": "<", "I1b": ">", "ρa": ">"}, "answer_column": {"EAa": "avg"}, "condition": {"I1a": "<5.139", "I1b": ">7.154", "ρa": ">0.97"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than {}, I1b is greater than {}, and ρa exceeds {}?"}
{"question": "Calculate the maximum J.uAcm2_0.63_secondCA where Mg concentration is below 0.6?", "refer_dataset": "table16", "column names": ["Mg", "J.uAcm2_0.63_secondCA"], "condition_column": {"Mg": "<"}, "answer_column": {"J.uAcm2_0.63_secondCA": "max"}, "condition": {"Mg": "<0.6"}, "tool": "calculate_data", "answer": 4786.048, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum J.uAcm2_0.63_secondCA where Mg concentration is below {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A154]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A154]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "What is the minimum Fe concentration in samples where Ca concentration is equal to 0.3?", "refer_dataset": "table16", "column names": ["Fe", "Ca"], "condition_column": {"Ca": "="}, "answer_column": {"Fe": "min"}, "condition": {"Ca": "=='0.3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fe concentration in samples where Ca concentration is equal to {}?"}
{"question": "What is the maximum light intensity (I) recorded for organic compound Ethyl acetate with nanoparticle dose (D) ≥ 1.875 g/L and reaction rate (-log(k)) > 0.8491?", "refer_dataset": "table9", "column names": ["OC", "D, g/L", "-log(k), min-1", "I, mW/cm2"], "condition_column": {"OC": "=", "D, g/L": ">=", "-log(k), min-1": ">"}, "answer_column": {"I, mW/cm2": "max"}, "condition": {"OC": "=='Ethyl acetate'", "D, g/L": ">=1.875", "-log(k), min-1": ">0.8491"}, "tool": "calculate_data", "answer": 0.176, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum light intensity (I) recorded for organic compound {} with nanoparticle dose (D) ≥ {} g/L and reaction rate (-log(k)) > {}?"}
{"question": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than 5.212, I1b is greater than 6.836, and ρa exceeds 3.62?", "refer_dataset": "table2", "column names": ["I1a", "I1b", "ρa", "EAa"], "condition_column": {"I1a": "<", "I1b": ">", "ρa": ">"}, "answer_column": {"EAa": "avg"}, "condition": {"I1a": "<5.212", "I1b": ">6.836", "ρa": ">3.62"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than {}, I1b is greater than {}, and ρa exceeds {}?"}
{"question": "What is the minimum pH recorded for Degradation Rate > 50.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">50.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "Calculate the average Surface area (m2/g) when Pore Volume (cm3/g) is below 0.86.", "refer_dataset": "table6", "column names": ["Pore Volume (cm3/g)", "Surface area (m2/g)"], "condition_column": {"Pore Volume (cm3/g)": "<"}, "answer_column": {"Surface area (m2/g)": "avg"}, "condition": {"Pore Volume (cm3/g)": "<0.86"}, "tool": "calculate_data", "answer": 396.5466613924047, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Surface area (m2/g) when Pore Volume (cm3/g) is below {}."}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 10.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">10.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.7, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds 213.1 kJ/mol.", "refer_dataset": "table3", "column names": ["ΔfusHa", "B_Tm"], "condition_column": {"ΔfusHa": ">"}, "answer_column": {"B_Tm": "min"}, "condition": {"ΔfusHa": ">213.1"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds {} kJ/mol."}
{"question": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above 918.0 K.", "refer_dataset": "table3", "column names": ["A_Tm", "RH2(µmol h-1 g-1)"], "condition_column": {"A_Tm": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "min"}, "condition": {"A_Tm": ">918.0"}, "tool": "calculate_data", "answer": 2847.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above {} K."}
{"question": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds 0.3.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Pore Volume (cm3/g)"], "condition_column": {"Catalyst dosage (g/L)": ">"}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Catalyst dosage (g/L)": ">0.3"}, "tool": "calculate_data", "answer": 0.49277777777777765, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds {}."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -1.73819887423718.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-1.73819887423718'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -0.64141873991599 and the HOMO-LUMO gap (gap) is less than 0.68770565725208?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-0.64141873991599", "gap": "<0.68770565725208"}, "tool": "calculate_data", "answer": 1.45069450084841, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "What is the minimum SBET (m²/g) required for Bi type BiOCl, light source UV, and Yield > 5.185 μmol/g/h?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "light source", "Yield (μmol/g/h)", "SBET (m2 /g)"], "condition_column": {"Bi type in photocatalyst": "=", "light source": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"SBET (m2 /g)": "min"}, "condition": {"Bi type in photocatalyst": "=='BiOCl'", "light source": "=='UV'", "Yield (μmol/g/h)": ">5.185"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum SBET (m²/g) required for Bi type {}, light source {}, and Yield > {} μmol/g/h?"}
{"question": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than 30.68 eV.", "refer_dataset": "table3", "column names": ["EAa", "Ra"], "condition_column": {"EAa": ">"}, "answer_column": {"Ra": "max"}, "condition": {"EAa": ">30.68"}, "tool": "calculate_data", "answer": 139.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than {} eV."}
{"question": "Determine the average H2 selectivity when Cation1 is Na, Cation3Amount > 0%, and O2 conv < 1.9%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='Na'", "Cation3Amount": ">0", "O2 conv": "<1.9"}, "tool": "calculate_data", "answer": 9.2, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "Find the average C2 selectivity(%) for catalysts where the tertiary metal component (M3) is none.", "refer_dataset": "table21", "column names": ["M3", "C2 selectivity(%)"], "condition_column": {"M3": "="}, "answer_column": {"C2 selectivity(%)": "avg"}, "condition": {"M3": "=='none'"}, "tool": "calculate_data", "answer": 43.24449851263512, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average C2 selectivity(%) for catalysts where the tertiary metal component (M3) is {}."}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below -31.83063842?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<-31.83063842"}, "tool": "calculate_data", "answer": 27.176800780182003, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > 0.3, Mg < 0.1, and La = 0.1?", "refer_dataset": "table16", "column names": ["Ca", "Mg", "La", "J.uAcm2_0.80_fromCV"], "condition_column": {"Ca": ">", "Mg": "<", "La": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "max"}, "condition": {"Ca": ">0.3", "Mg": "<0.1", "La": "=='0.1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > {}, Mg < {}, and La = {}?"}
{"question": "Calculate the lowest Illumination Time required to achieve at least 48.0% Degradation Rate with Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": "<", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": "min"}, "condition": {"Degradation rate(%)": "<48.0", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the lowest Illumination Time required to achieve at least {}% Degradation Rate with Dopant/Ti mole ratio {}."}
{"question": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"NM\", Space_group_rlx 189, and Band_gap_HSE > 0.161867.", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Space_group_rlx", "Band_gap_HSE", "Band_gap_GGA_optical"], "condition_column": {"Magnetic_ordering": "=", "Space_group_rlx": "=", "Band_gap_HSE": ">"}, "answer_column": {"Band_gap_GGA_optical": "avg"}, "condition": {"Magnetic_ordering": "=='NM'", "Space_group_rlx": "=='189'", "Band_gap_HSE": ">0.161867"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"{}\", Space_group_rlx {}, and Band_gap_HSE > {}."}
{"question": "Identify materials where the ionization energy of element B (I1b) exceeds 6.828 eV, the atomic radius of element B (Rb) is below 67.0 Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than 202.02 kJ/mol. What is their average hydrogen production rate (RH2)?", "refer_dataset": "table3", "column names": ["I1b", "Rb", "ΔfusHa", "RH2(µmol h-1 g-1)"], "condition_column": {"I1b": ">", "Rb": "<", "ΔfusHa": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "avg"}, "condition": {"I1b": ">6.828", "Rb": "<67.0", "ΔfusHa": ">202.02"}, "tool": "calculate_data", "answer": 12.325000000000001, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where the ionization energy of element B (I1b) exceeds {} eV, the atomic radius of element B (Rb) is below {} Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than {} kJ/mol. What is their average hydrogen production rate (RH2)?"}
{"question": "What is the maximum pH observed where Degradation efficiency (%) is greater than 2.0?", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "pH"], "condition_column": {"pH": ">"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"pH": ">2.0"}, "tool": "calculate_data", "answer": 99.6, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH observed where Degradation efficiency (%) is greater than {}?"}
{"question": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than -33.44154357910156?", "refer_dataset": "table60", "column names": ["H", "U0"], "condition_column": {"H": ">"}, "answer_column": {"U0": "max"}, "condition": {"H": ">-33.44154357910156"}, "tool": "calculate_data", "answer": -9.240361213684082, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than {}?"}
{"question": "What is the average number of citations for studies indexed in 2015-12-01 00:00:00?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Cited_Time"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Cited_Time": "avg"}, "condition": {"Indexed_Date": "=='2015-12-01 00:00:00'"}, "tool": "calculate_data", "answer": 76.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of citations for studies indexed in {}?"}
{"question": "Calculate the maximum offset value where optb88vdw_vbm is below 3.4009.", "refer_dataset": "table52", "column names": ["offset", "optb88vdw_vbm"], "condition_column": {"optb88vdw_vbm": "<"}, "answer_column": {"offset": "max"}, "condition": {"optb88vdw_vbm": "<3.4009"}, "tool": "calculate_data", "answer": "{}", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum offset value where optb88vdw_vbm is below {}."}
{"question": "What is the maximum Onset potential for alloys where Platinum > 5.2%, Ruthenium < 70.5%, and Palladium > 0.3%?", "refer_dataset": "table15", "column names": ["Pt", "Ru", "Pd", "Onset"], "condition_column": {"Pt": ">", "Ru": "<", "Pd": ">"}, "answer_column": {"Onset": "max"}, "condition": {"Pt": ">5.2", "Ru": "<70.5", "Pd": ">0.3"}, "tool": "calculate_data", "answer": 0.600639, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Onset potential for alloys where Platinum > {}%, Ruthenium < {}%, and Palladium > {}%?"}
{"question": "Materials with bandgap of 0.8580999999999999, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='0.8580999999999999'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding 0.000656?", "refer_dataset": "table54", "column names": ["mu_b", "shear modulus"], "condition_column": {"mu_b": ">"}, "answer_column": {"shear modulus": "max"}, "condition": {"mu_b": ">0.000656"}, "tool": "calculate_data", "answer": 213.9683850846991, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding {}?"}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 52.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">52.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.7, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "What is the average Ruthenium content in alloys where Onset potential is greater than 0.476753V?", "refer_dataset": "table15", "column names": ["Ru", "Onset"], "condition_column": {"Onset": ">"}, "answer_column": {"Ru": "avg"}, "condition": {"Onset": ">0.476753"}, "tool": "calculate_data", "answer": 34.31214788732394, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Ruthenium content in alloys where Onset potential is greater than {}V?"}
{"question": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"FM\", Space_group_rlx 33, and Band_gap_HSE > 2.390096.", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Space_group_rlx", "Band_gap_HSE", "Band_gap_GGA_optical"], "condition_column": {"Magnetic_ordering": "=", "Space_group_rlx": "=", "Band_gap_HSE": ">"}, "answer_column": {"Band_gap_GGA_optical": "avg"}, "condition": {"Magnetic_ordering": "=='FM'", "Space_group_rlx": "=='33'", "Band_gap_HSE": ">2.390096"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"{}\", Space_group_rlx {}, and Band_gap_HSE > {}."}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -0.83800212145904 and Gibbs free energy (G) under 4.21956907244036.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-0.83800212145904", "G": "<4.21956907244036"}, "tool": "calculate_data", "answer": -2.054542781950207, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "What is the average Power(W) for materials where BandGap(eV) is less than 4.06?", "refer_dataset": "table4", "column names": ["BandGap(eV)", "Power(W)"], "condition_column": {"BandGap(eV)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"BandGap(eV)": "<4.06"}, "tool": "calculate_data", "answer": 339.7679814385151, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where BandGap(eV) is less than {}?"}
{"question": "Find the Illumination Time required to reach 79.0% Degradation Rate with pH = 7.0 and Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "pH", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": ">", "pH": "=", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": ""}, "condition": {"Degradation rate(%)": ">79.0", "pH": "=='7.0'", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the Illumination Time required to reach {}% Degradation Rate with pH = {} and Dopant/Ti mole ratio {}."}
{"question": "What is the average Cation1-mol for Cation1 29?", "refer_dataset": "table20", "column names": ["Cation1", "Cation1-mol"], "condition_column": {"Cation1": "="}, "answer_column": {"Cation1-mol": "avg"}, "condition": {"Cation1": "=='29'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Cation1-mol for Cation1 {}?"}
{"question": "Calculate the average _oqmd_stability for materials with _oqmd_band_gap below 0.221.", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_stability"], "condition_column": {"_oqmd_band_gap": "<"}, "answer_column": {"_oqmd_stability": "avg"}, "condition": {"_oqmd_band_gap": "<0.221"}, "tool": "calculate_data", "answer": 0.6185830259761339, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average _oqmd_stability for materials with _oqmd_band_gap below {}."}
{"question": "Calculate the average Band_gap_GGA for Space_group_rlx 33, SOC False, and Magnetic_ordering \"NM\".", "refer_dataset": "table63", "column names": ["Space_group_rlx", "SOC", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "=", "SOC": "=", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "avg"}, "condition": {"Space_group_rlx": "=='33'", "SOC": "=='False'", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA for Space_group_rlx {}, SOC {}, and Magnetic_ordering \"{}\"."}
{"question": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is 50.0, pH > 8.2, and Catalyst dosage (g/L) is 0.15.", "refer_dataset": "table6", "column names": ["Antibiotic dosage (mg/L)", "pH", "Catalyst dosage (g/L)", "Illumination time (min)"], "condition_column": {"Antibiotic dosage (mg/L)": "=", "pH": ">", "Catalyst dosage (g/L)": "="}, "answer_column": {"Illumination time (min)": "avg"}, "condition": {"Antibiotic dosage (mg/L)": "=='50.0'", "pH": ">8.2", "Catalyst dosage (g/L)": "=='0.15'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is {}, pH > {}, and Catalyst dosage (g/L) is {}."}
{"question": "What is the average total yield for experiments with photocatalyst(s) Bulk CN, Liquid phase, and sacrificial agent percentage above 20.0%?", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Phase", "SacrAgentPercent", "total"], "condition_column": {"Photocatalyst(s)": "=", "Phase": "=", "SacrAgentPercent": ">"}, "answer_column": {"total": "avg"}, "condition": {"Photocatalyst(s)": "=='Bulk CN'", "Phase": "=='Liquid'", "SacrAgentPercent": ">20.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average total yield for experiments with photocatalyst(s) {}, {} phase, and sacrificial agent percentage above {}%?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 40.0?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">40.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "What is the average number of citations for studies indexed in 2022-05-03 00:00:00?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Cited_Time"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Cited_Time": "avg"}, "condition": {"Indexed_Date": "=='2022-05-03 00:00:00'"}, "tool": "calculate_data", "answer": 1.8333333333333333, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of citations for studies indexed in {}?"}
{"question": "Determine the maximum irradiation time (h) for Bi type BiOBr, Main product CO, and loading > 0.142857143 g/l.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Main product", "loading (g/l)", "irradiation time(h)"], "condition_column": {"Bi type in photocatalyst": "=", "Main product": "=", "loading (g/l)": ">"}, "answer_column": {"irradiation time(h)": "max"}, "condition": {"Bi type in photocatalyst": "=='BiOBr'", "Main product": "=='CO'", "loading (g/l)": ">0.142857143"}, "tool": "calculate_data", "answer": 4.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum irradiation time (h) for Bi type {}, Main product {}, and loading > {} g/l."}
{"question": "What is the average Ruthenium content in alloys where Onset potential is greater than 0.467927V?", "refer_dataset": "table15", "column names": ["Ru", "Onset"], "condition_column": {"Onset": ">"}, "answer_column": {"Ru": "avg"}, "condition": {"Onset": ">0.467927"}, "tool": "calculate_data", "answer": 38.77002840909092, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Ruthenium content in alloys where Onset potential is greater than {}V?"}
{"question": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above 0.5073935.", "refer_dataset": "table66", "column names": ["efermi", "final_energy"], "condition_column": {"efermi": ">"}, "answer_column": {"final_energy": "min"}, "condition": {"efermi": ">0.5073935"}, "tool": "calculate_data", "answer": 47.1431938, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above {}."}
{"question": "What is the average sacrificial agent percentage for MOF Type PURE?", "refer_dataset": "table7", "column names": ["MOF_Type", "SacrAgentPercent"], "condition_column": {"MOF_Type": "="}, "answer_column": {"SacrAgentPercent": "avg"}, "condition": {"MOF_Type": "=='PURE'"}, "tool": "calculate_data", "answer": 6.878346689248881, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average sacrificial agent percentage for MOF Type {}?"}
{"question": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than 1.924.", "refer_dataset": "table66", "column names": ["scf_vbm", "efermi"], "condition_column": {"scf_vbm": ">"}, "answer_column": {"efermi": "min"}, "condition": {"scf_vbm": ">1.924"}, "tool": "calculate_data", "answer": 7.27774779, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than {}."}
{"question": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than -15.710439682006836?", "refer_dataset": "table60", "column names": ["H", "U0"], "condition_column": {"H": ">"}, "answer_column": {"U0": "max"}, "condition": {"H": ">-15.710439682006836"}, "tool": "calculate_data", "answer": -9.240361213684082, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than {}?"}
{"question": "Find the highest defective_energy where wycoff position is c and material_type is 3D?", "refer_dataset": "table68", "column names": ["wycoff", "material_type", "defective_energy"], "condition_column": {"wycoff": "=", "material_type": "="}, "answer_column": {"defective_energy": "max"}, "condition": {"wycoff": "=='c'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 67.55173357, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest defective_energy where wycoff position is {} and material_type is {}?"}
{"question": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds -0.098?", "refer_dataset": "table51", "column names": ["b3lyp_lumo", "b3lyp_scharber_pce"], "condition_column": {"b3lyp_lumo": ">"}, "answer_column": {"b3lyp_scharber_pce": "sum"}, "condition": {"b3lyp_lumo": ">-0.098"}, "tool": "calculate_data", "answer": 1406.9785560915411, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds {}?"}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 14.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">14.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.7, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "What is the average journal impact factor for research institutions located in Singapore?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='Singapore'"}, "tool": "calculate_data", "answer": 15.554588235294117, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "What is the minimum reaction solution volume used when the preparation method is 'Flux-growth'?", "refer_dataset": "table1", "column names": ["Preparation method", "Reaction solution"], "condition_column": {"Preparation method": "="}, "answer_column": {"Reaction solution": "min"}, "condition": {"Preparation method": "=='Flux-growth'"}, "tool": "calculate_data", "answer": "10vol％ CH3OH", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reaction solution volume used when the preparation method is '{}'?"}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is none, Support is La2O3, and CH4/O2 ratio is 4?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='none'", "Support": "=='La2O3'", "CH4/O2 (mol/mol)": "=='4'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "What is the minimum pH recorded for Degradation Rate > 52.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">52.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "Calculate the maximum J.uAcm2_0.63_secondCA where Mg concentration is below 0.4?", "refer_dataset": "table16", "column names": ["Mg", "J.uAcm2_0.63_secondCA"], "condition_column": {"Mg": "<"}, "answer_column": {"J.uAcm2_0.63_secondCA": "max"}, "condition": {"Mg": "<0.4"}, "tool": "calculate_data", "answer": 4786.048, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum J.uAcm2_0.63_secondCA where Mg concentration is below {}?"}
{"question": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > 5.0, pH < 4.1, and Antibiotic dosage (mg/L) = 50.0.", "refer_dataset": "table6", "column names": ["Illumination time (min)", "pH", "Antibiotic dosage (mg/L)", "Pore Volume (cm3/g)"], "condition_column": {"Illumination time (min)": ">", "pH": "<", "Antibiotic dosage (mg/L)": "="}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Illumination time (min)": ">5.0", "pH": "<4.1", "Antibiotic dosage (mg/L)": "=='50.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > {}, pH < {}, and Antibiotic dosage (mg/L) = {}."}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MB under Experimental Temperature 25°C and Light Wavelength 463 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MB'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='463'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'ThSbRh'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='ThSbRh'"}, "tool": "calculate_data", "answer": 8.554, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > 0.0, Ni < 0.3, and Fe = 0.4?", "refer_dataset": "table16", "column names": ["Mn", "Ni", "Fe", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">", "Ni": "<", "Fe": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.0", "Ni": "<0.3", "Fe": "=='0.4'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > {}, Ni < {}, and Fe = {}?"}
{"question": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than 5.91, I1b is greater than 6.828, and ρa exceeds 4.21?", "refer_dataset": "table2", "column names": ["I1a", "I1b", "ρa", "EAa"], "condition_column": {"I1a": "<", "I1b": ">", "ρa": ">"}, "answer_column": {"EAa": "avg"}, "condition": {"I1a": "<5.91", "I1b": ">6.828", "ρa": ">4.21"}, "tool": "calculate_data", "answer": 39.338235294117645, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than {}, I1b is greater than {}, and ρa exceeds {}?"}
{"question": "Calculate the minimum CH4-pressure when C2-selectivity is greater than 45.5%?", "refer_dataset": "table20", "column names": ["CH4-pressure", "C2-selectivity"], "condition_column": {"C2-selectivity": ">"}, "answer_column": {"CH4-pressure": "min"}, "condition": {"C2-selectivity": ">45.5"}, "tool": "calculate_data", "answer": 0.97, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum CH4-pressure when C2-selectivity is greater than {}%?"}
{"question": "Find the minimum synthesis temperature for experiments with Zn2GeO4/ZIF-8 nanorods photocatalyst(s), reaction time under 11.0 hours, and CH3OH as the major product.", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Rxn_Time", "MAJORgas", "Synhesis_Temp"], "condition_column": {"Photocatalyst(s)": "=", "Rxn_Time": "<", "MAJORgas": "="}, "answer_column": {"Synhesis_Temp": "min"}, "condition": {"Photocatalyst(s)": "=='Zn2GeO4/ZIF-8 nanorods'", "Rxn_Time": "<11.0", "MAJORgas": "=='CH3OH'"}, "tool": "calculate_data", "answer": 60.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum synthesis temperature for experiments with {} photocatalyst(s), reaction time under {} hours, and {} as the major product."}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 0.68770565725208.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<0.68770565725208"}, "tool": "calculate_data", "answer": [{"U": 5.85213296706841}, {"U": 4.65046636299255}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.49215677563079}, {"U": 4.28237851192289}, {"U": 2.92411819429234}, {"U": 3.06909011621485}, {"U": 3.53668171969642}, {"U": 3.36763795283073}, {"U": 3.83280486597178}, {"U": 3.48205825390004}, {"U": 3.84218486416411}, {"U": 3.91996307758737}, {"U": 3.59120067297812}, {"U": 4.04224794538619}, {"U": 2.32843082719585}, {"U": 3.10486997561481}, {"U": 2.77914365955695}, {"U": 3.06939058969455}, {"U": 2.29578111761049}, {"U": 2.73295174088221}, {"U": 2.7462483455621}, {"U": 3.53752565825245}, {"U": 2.87727568521372}, {"U": 3.40896742676009}, {"U": 3.67920543596261}, {"U": 3.50620848322923}, {"U": 3.85279288440392}, {"U": 3.79629603178194}, {"U": 4.07281263030373}, {"U": 4.01220582304204}, {"U": 3.343989383572}, {"U": 3.70197087447231}, {"U": 3.48011432112703}, {"U": 2.99771851994134}, {"U": 2.87185932414054}, {"U": 3.10782767978019}, {"U": 2.33181180704568}, {"U": 2.76428981840836}, {"U": 3.14268260342526}, {"U": 3.11768059710145}, {"U": 3.33365570868323}, {"U": 3.60468278737157}, {"U": 2.90524062132865}, {"U": 3.42470701147057}, {"U": 3.70139344282871}, {"U": 3.40352493755824}, {"U": 2.11772837197957}, {"U": 3.34306967344284}, {"U": 2.91047147268827}, {"U": 3.57964681448049}, {"U": 4.10826066246959}, {"U": 4.04158951654372}, {"U": 4.06600625278533}, {"U": 4.09285029218034}, {"U": 3.92455117698173}, {"U": 4.43969858745459}, {"U": 4.3833846317333}, {"U": 4.3600104078256}, {"U": 4.95561416491033}, {"U": 4.48485583223402}, {"U": 4.99847997280546}, {"U": 5.56271429860964}, {"U": 2.93806538937609}, {"U": 2.5419107024897}, {"U": 1.76650100234032}, {"U": 2.35525135127506}, {"U": 2.88729059693273}, {"U": 3.15656186537448}, {"U": 3.06547137039413}, {"U": 3.35502851793485}, {"U": 3.64805025533714}, {"U": 1.89117659391239}, {"U": 2.1821028553954}, {"U": 2.64545125078105}, {"U": 2.6406645776088}, {"U": 2.39771739880154}, {"U": 2.6839196946211}, {"U": 3.14934788904884}, {"U": 3.12904633307267}, {"U": 2.66695992630175}, {"U": 3.13765032584352}, {"U": 3.10786948478607}, {"U": 1.89657727810837}, {"U": 2.35611619233402}, {"U": 2.19279448564694}, {"U": 2.64948543384761}, {"U": 2.40585108525634}, {"U": 2.85478720486792}, {"U": 2.70098658826799}, {"U": 3.14826095889619}, {"U": 2.67689384082188}, {"U": 3.11768059710145}, {"U": 3.41623627215593}, {"U": 1.9167795471956}, {"U": 2.38252389198024}, {"U": 1.87960705853756}, {"U": 2.37801678978476}, {"U": 2.8860834773882}, {"U": 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0.08059656400757}, {"U": 0.35932882784053}, {"U": 0.86475657444835}, {"U": 0.85739105497643}, {"U": 0.81792974224694}, {"U": 1.30886160306894}, {"U": 1.29788778902777}, {"U": 1.57906042007846}, {"U": 0.79834932262205}, {"U": 1.30474380999064}, {"U": 1.31076373083608}, {"U": 0.35315475103594}, {"U": 0.64056416640003}, {"U": 0.86142001241726}, {"U": 1.14598668738211}, {"U": 1.13302190993633}, {"U": 0.81599103509967}, {"U": 1.10216720279056}, {"U": 1.5928508463902}, {"U": 1.58243094867682}, {"U": 1.86403469385056}, {"U": 0.79622771857409}, {"U": 1.08060627101252}, {"U": 1.30570271231281}, {"U": 1.58616988388942}, {"U": 1.57929557323649}, {"U": 0.83737690841562}, {"U": 1.12472100345804}, {"U": 1.30045618407598}, {"U": 1.58693282524657}, {"U": 1.57058445513809}, {"U": 1.10532086792096}, {"U": 1.56538495753286}, {"U": 1.57281841013933}, {"U": 0.72422904721251}, {"U": 1.00503327164896}, {"U": 1.01151043474612}, {"U": 1.29604575595657}, {"U": 1.53072338203995}, {"U": 1.54000148053048}, {"U": 1.81943659102465}, {"U": 1.53867417159407}, {"U": 1.81294375105029}, {"U": 1.82806671192417}, {"U": 2.10512938833516}, {"U": 1.51704791949436}, {"U": 1.79529681294693}, {"U": 1.80592573568967}, {"U": 2.08797104623792}, {"U": 0.3400436560696}, {"U": 0.63216919865853}, {"U": 0.79835977387351}, {"U": 1.08664970717376}, {"U": -0.44038003197145}, {"U": 0.01119764144861}, {"U": 0.06577668942625}, {"U": 0.33450710560454}, {"U": 0.76803285492687}, {"U": -0.15131931887545}, {"U": 0.29920277814636}, {"U": 0.34959871272402}, {"U": 0.7867405950542}, {"U": 1.06680278063644}, {"U": 0.08367445756483}, {"U": 0.52587735841829}, {"U": 0.58956205923724}, {"U": 0.85813048101778}, {"U": 1.2816099648667}, {"U": 0.37046724909232}, {"U": 0.81138725882811}, {"U": 0.87010500238699}, {"U": 1.29798446310385}, {"U": 1.57700936197791}, {"U": 0.36226562950298}, {"U": 0.80512434638604}, {"U": 0.8676385070406}, {"U": 1.30082720350309}, {"U": 1.13637937447035}, {"U": 1.56308568220995}, {"U": 0.65170258765182}, {"U": 1.09612376662931}, {"U": 1.15108167247266}, {"U": 1.58341075350193}, {"U": 0.84596783712214}, {"U": 1.13269792114083}, {"U": 1.57455070507011}, {"U": 1.11516594680362}, {"U": 1.55441636911742}, {"U": -0.42337062020763}, {"U": 0.08537017311548}, {"U": 0.35609155269838}, {"U": 0.03447519128023}, {"U": 0.53242768027572}, {"U": 0.79471489992412}, {"U": 1.777190019779}, {"U": 1.84216283734135}, {"U": 2.05515411662908}, {"U": 2.07187611897753}, {"U": 2.16404309285906}, {"U": 2.37747071189557}, {"U": 1.97574812078971}, {"U": 2.28544221709599}, {"U": 2.59587312663074}, {"U": -0.46481505790313}, {"U": 0.02272537181758}, {"U": 0.2923624340607}, {"U": 0.02470065834499}, {"U": 0.49344973792662}, {"U": 0.75029446837317}, {"U": 0.02821227883816}, {"U": 0.51782989478809}, {"U": 0.79154817072939}, {"U": 0.78156199995192}, {"U": 0.51016651464934}, {"U": 0.97053107774094}, {"U": 1.23259620829565}, {"U": 0.51314512131766}, {"U": 0.7839265955965}, {"U": 0.52253034513573}, {"U": 0.99154331881692}, {"U": 1.25255809859912}, {"U": 1.00063068196816}, {"U": 1.27568671809733}, {"U": 0.51222279837563}, {"U": 0.7826306404145}, {"U": 1.24278095285101}, {"U": 1.27492377674018}, {"U": 1.46573227478753}, {"U": 1.72787840254112}, {"U": 1.25718800299935}, {"U": 1.4641384589387}, {"U": 1.72453138925856}, {"U": 1.73750400514295}, {"U": 1.04952424914733}, {"U": 1.51195032159095}, {"U": 1.54291737968999}, {"U": 2.00154964785081}, {"U": 1.99893160935813}, {"U": 0.74577952773909}, {"U": 0.85288133996808}, {"U": 1.05577148471219}, {"U": 1.22325540229632}, {"U": 1.52839797858837}, {"U": 1.2517847059905}, {"U": 1.35575898121776}, {"U": 1.56485978214661}, {"U": 1.22768412010579}, {"U": 1.53960694578757}, {"U": 1.70899037832597}, {"U": 2.01559090419778}, {"U": 1.70760297469362}, {"U": 1.8083974566618}, {"U": 2.02033054673842}, {"U": 1.80642739576012}, {"U": 2.31184730392935}, {"U": 2.09894747309196}, {"U": 2.30945135453036}, {"U": 0.78695484570929}, {"U": 1.26177087676797}, {"U": 1.09546795059971}, {"U": 1.56442605521069}, {"U": 1.27204968258654}, {"U": 1.74523270560338}, {"U": 1.58354661977101}, {"U": 1.82557670126198}, {"U": 2.05182800584945}, {"U": 1.57562457115843}, {"U": 2.0052023602388}, {"U": 1.88527424964596}, {"U": 0.77189981796995}, {"U": 1.26158797986729}, {"U": 1.28404249364582}, {"U": 1.24731418317516}, {"U": 1.7286230542082}, {"U": 1.66401341763435}, {"U": 1.68445345269247}, {"U": 1.68175702981378}, {"U": 1.66775235284695}, {"U": 1.69638355624295}, {"U": 2.15033105093333}, {"U": 1.66656613580536}, {"U": 2.16992976024829}, {"U": 0.89750818373552}, {"U": 1.39497991516349}, {"U": 1.41447149915091}, {"U": 1.41040334951708}, {"U": 1.89166257710565}, {"U": 1.91104442295265}, {"U": 1.91333063421123}, {"U": 1.89792548954772}, {"U": 1.93441342123462}, {"U": 2.3823932513369}, {"U": 1.87871086372419}, {"U": 2.38514454328579}, {"U": 0.05679645160256}, {"U": 0.341940558211}, {"U": 0.32816580877646}, {"U": 0.56508000267395}, {"U": 0.84792744677235}, {"U": 0.82872065938743}, {"U": 0.56060164142}, {"U": 0.83194487046524}, {"U": 0.84336024988093}, {"U": 1.11763766777575}, {"U": 0.82945747261591}, {"U": 1.10670304592758}, {"U": 0.83144582320765}, {"U": 1.10423132495545}, {"U": -0.451758832007}, {"U": 0.05719098634546}, {"U": 0.32545370902057}, {"U": 0.05198626311451}, {"U": 0.83160520479254}, {"U": 0.32289576522383}, {"U": 0.82306914515622}, {"U": 1.10490543067512}, {"U": -0.16529525490075}, {"U": 0.34283675302437}, {"U": 0.61549161412881}, {"U": 0.33741516632545}, {"U": 0.83953247903085}, {"U": 1.12195403463194}, {"U": 1.11910084298124}, {"U": 1.61456854694026}, {"U": 1.60701229212905}, {"U": 1.33528236677951}, {"U": 1.34363552951513}, {"U": 1.61223269223721}, {"U": 1.34519276598383}, {"U": 1.62650648892934}, {"U": 1.62129392725978}, {"U": 1.88609206007332}, {"U": 0.7265936428571}, {"U": 1.23522992366553}, {"U": 1.5090683889987}, {"U": 1.01337598313312}, {"U": 1.52077379064262}, {"U": -0.43341427286817}, {"U": 0.06862465545122}, {"U": 0.33831136113882}, {"U": 0.77490193995407}, {"U": 0.57407591737485}, {"U": 0.84317735298024}, {"U": 1.2810560485389}, {"U": 1.11634693821948}, {"U": 0.79919587399094}, {"U": 1.55600757215339}, {"U": -0.42890717067269}, {"U": 0.07262748476338}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "Calculate the average C2 yield (%) for catalysts with primary metal Mo, secondary metal Cs, and support material BaO–La2O3.", "refer_dataset": "table21", "column names": ["M1", "M2", "Support", "C2 yield (%)"], "condition_column": {"M1": "=", "M2": "=", "Support": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='Mo'", "M2": "=='Cs'", "Support": "=='BaO–La2O3'"}, "tool": "calculate_data", "answer": 11.161484747855855, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average C2 yield (%) for catalysts with primary metal {}, secondary metal {}, and support material {}."}
{"question": "Calculate the average reaction temperature for noble metal none, synthesis time 1.0 hours, and additional components containing none.", "refer_dataset": "table7", "column names": ["Noble_Metal", "Synthesis_Time", "Additional", "Rxn_Temp"], "condition_column": {"Noble_Metal": "=", "Synthesis_Time": "=", "Additional": "="}, "answer_column": {"Rxn_Temp": "avg"}, "condition": {"Noble_Metal": "=='none'", "Synthesis_Time": "=='1.0'", "Additional": "=='none'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average reaction temperature for noble metal {}, synthesis time {} hours, and additional components containing {}."}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -0.69666045604944 and Gibbs free energy (G) under 6.27417471410908.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-0.69666045604944", "G": "<6.27417471410908"}, "tool": "calculate_data", "answer": -2.115664622464834, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than 1.18, Element B's Electronegativity (χpb) is less than 1.54, and the Tolerance Factor (t) is 0.831?", "refer_dataset": "table2", "column names": ["χpa", "χpb", "t", "Eg(eV)"], "condition_column": {"χpa": ">", "χpb": "<", "t": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"χpa": ">1.18", "χpb": "<1.54", "t": "=='0.831'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than {}, Element B's Electronegativity (χpb) is less than {}, and the Tolerance Factor (t) is {}?"}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over 0.64099706538702 and Gibbs free energy (G) under 3.9292001725187.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">0.64099706538702", "G": "<3.9292001725187"}, "tool": "calculate_data", "answer": -2.1473811693826206, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above 1.6314070505.", "refer_dataset": "table51", "column names": ["m06_lumo", "m06_scharber_voc"], "condition_column": {"m06_scharber_voc": ">"}, "answer_column": {"m06_lumo": "min"}, "condition": {"m06_scharber_voc": ">1.6314070505"}, "tool": "calculate_data", "answer": 0.024, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above {}."}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -6.29834488537368.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-6.29834488537368"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "What is the average indirect band gap for compounds in the crystal system cubic?", "refer_dataset": "table59", "column names": ["crystal_system", "indir_gap"], "condition_column": {"crystal_system": "="}, "answer_column": {"indir_gap": "avg"}, "condition": {"crystal_system": "=='cubic'"}, "tool": "calculate_data", "answer": 0.5324175627240141, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average indirect band gap for compounds in the crystal system {}?"}
{"question": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals -6.2e-06?", "refer_dataset": "table67", "column names": ["exfoliation_energy_per_atom", "total_magnetization"], "condition_column": {"total_magnetization": "="}, "answer_column": {"exfoliation_energy_per_atom": "max"}, "condition": {"total_magnetization": "=='-6.2e-06'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals {}?"}
{"question": "Determine the average temperature (°C) required to achieve C2 yield (%) over 4.029703246% with M2 as Mo and PAr below 0.15 atm.", "refer_dataset": "table21", "column names": ["C2 yield (%)", "M2", "PAr (atm)", "Temp. (°C)"], "condition_column": {"C2 yield (%)": ">", "M2": "=", "PAr (atm)": "<"}, "answer_column": {"Temp. (°C)": "avg"}, "condition": {"C2 yield (%)": ">4.029703246", "M2": "=='Mo'", "PAr (atm)": "<0.15"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average temperature (°C) required to achieve C2 yield (%) over {}% with M2 as {} and PAr below {} atm."}
{"question": "Calculate the minimum COx when Cation3-mol < 0.0%, Anion2 = 0.0, and CH4-pressure > 0.77.", "refer_dataset": "table20", "column names": ["Cation3-mol", "Anion2", "CH4-pressure", "COx"], "condition_column": {"Cation3-mol": "<", "Anion2": "=", "CH4-pressure": ">"}, "answer_column": {"COx": "min"}, "condition": {"Cation3-mol": "<0.0", "Anion2": "=='0.0'", "CH4-pressure": ">0.77"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum COx when Cation3-mol < {}%, Anion2 = {}, and CH4-pressure > {}."}
{"question": "What is the highest reaction time recorded for experiments with Liquid phase and noble metal present?", "refer_dataset": "table7", "column names": ["Phase", "Noble_Metal", "Rxn_Time"], "condition_column": {"Phase": "=", "Noble_Metal": "="}, "answer_column": {"Rxn_Time": "max"}, "condition": {"Phase": "=='Liquid'", "Noble_Metal": "=='present'"}, "tool": "calculate_data", "answer": 12.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction time recorded for experiments with {} phase and noble metal {}?"}
{"question": "Calculate the average Band_gap_GGA for Space_group_rlx 148, SOC False, and Magnetic_ordering \"NM\".", "refer_dataset": "table63", "column names": ["Space_group_rlx", "SOC", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "=", "SOC": "=", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "avg"}, "condition": {"Space_group_rlx": "=='148'", "SOC": "=='False'", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA for Space_group_rlx {}, SOC {}, and Magnetic_ordering \"{}\"."}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 5.68508295617329?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='5.68508295617329'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the average reaction energy for elements with atomic number greater than 74?", "refer_dataset": "table18", "column names": ["A_AtimicN", "reaction_energy"], "condition_column": {"A_AtimicN": ">"}, "answer_column": {"reaction_energy": "avg"}, "condition": {"A_AtimicN": ">74"}, "tool": "calculate_data", "answer": -0.030176785714285694, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction energy for elements with atomic number greater than {}?"}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 130°C and references in study [40]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">130", "Ref.": "=='[40]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is 200.0, pH > 3.45, and Catalyst dosage (g/L) is 2.0.", "refer_dataset": "table6", "column names": ["Antibiotic dosage (mg/L)", "pH", "Catalyst dosage (g/L)", "Illumination time (min)"], "condition_column": {"Antibiotic dosage (mg/L)": "=", "pH": ">", "Catalyst dosage (g/L)": "="}, "answer_column": {"Illumination time (min)": "avg"}, "condition": {"Antibiotic dosage (mg/L)": "=='200.0'", "pH": ">3.45", "Catalyst dosage (g/L)": "=='2.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is {}, pH > {}, and Catalyst dosage (g/L) is {}."}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -7.62159225156539.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-7.62159225156539"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the highest density for materials with pretty_formula equal to Mn3CoNi2(PO4)6?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='Mn3CoNi2(PO4)6'"}, "tool": "calculate_data", "answer": 3.501149800046778, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 40 minutes, pH > 7.0, and Dopant C?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<40", "pH": ">7.0", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": 96.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "What is the minimum M1 atom number required to achieve C2s greater than 16.98?", "refer_dataset": "table17", "column names": ["M1_atom_number", "C2s"], "condition_column": {"C2s": ">"}, "answer_column": {"M1_atom_number": "min"}, "condition": {"C2s": ">16.98"}, "tool": "calculate_data", "answer": 25, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum M1 atom number required to achieve C2s greater than {}?"}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below -153.13583421?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<-153.13583421"}, "tool": "calculate_data", "answer": 21.744707196414268, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -0.54667200640302 and Gibbs free energy (G) under 6.53867256157596.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-0.54667200640302", "G": "<6.53867256157596"}, "tool": "calculate_data", "answer": -2.1482283173896763, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -6.26957076426658.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-6.26957076426658"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than 1.8775?", "refer_dataset": "table54", "column names": ["gap pbe", "mu_b"], "condition_column": {"gap pbe": "<"}, "answer_column": {"mu_b": "max"}, "condition": {"gap pbe": "<1.8775"}, "tool": "calculate_data", "answer": 55.98974449999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than {}?"}
{"question": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than 5.139, I1b is greater than 6.759, and ρa exceeds 0.97?", "refer_dataset": "table2", "column names": ["I1a", "I1b", "ρa", "EAa"], "condition_column": {"I1a": "<", "I1b": ">", "ρa": ">"}, "answer_column": {"EAa": "avg"}, "condition": {"I1a": "<5.139", "I1b": ">6.759", "ρa": ">0.97"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than {}, I1b is greater than {}, and ρa exceeds {}?"}
{"question": "For surfaces with Miller indices -100, what is the maximum activation energy?", "refer_dataset": "table18", "column names": ["surfaces", "activation_energy"], "condition_column": {"surfaces": "="}, "answer_column": {"activation_energy": "max"}, "condition": {"surfaces": "=='-100'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For surfaces with Miller indices {}, what is the maximum activation energy?"}
{"question": "What is the average reaction rate (-log(k)) when pH is 3.5?", "refer_dataset": "table9", "column names": ["pH", "-log(k), min-1"], "condition_column": {"pH": "="}, "answer_column": {"-log(k), min-1": "avg"}, "condition": {"pH": "=='3.5'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction rate (-log(k)) when pH is {}?"}
{"question": "What is the total number of articles indexed on 2021-10-29 00:00:00 that used the electrochemical deposition method?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Judge_Electrochemical_Deposition"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Judge_Electrochemical_Deposition": "count"}, "condition": {"Indexed_Date": "=='2021-10-29 00:00:00'"}, "tool": "calculate_data", "answer": 3, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total number of articles indexed on {} that used the electrochemical deposition method?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than -1.71824475676759?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">-1.71824475676759"}, "tool": "calculate_data", "answer": -0.05110147674321974, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "Find the minimum synthesis temperature for experiments with CsPbBr3 photocatalyst(s), reaction time under 10.0 hours, and CO as the major product.", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Rxn_Time", "MAJORgas", "Synhesis_Temp"], "condition_column": {"Photocatalyst(s)": "=", "Rxn_Time": "<", "MAJORgas": "="}, "answer_column": {"Synhesis_Temp": "min"}, "condition": {"Photocatalyst(s)": "=='CsPbBr3'", "Rxn_Time": "<10.0", "MAJORgas": "=='CO'"}, "tool": "calculate_data", "answer": 120.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum synthesis temperature for experiments with {} photocatalyst(s), reaction time under {} hours, and {} as the major product."}
{"question": "How many synthesized compounds have a net magnetic moment above 10.0?", "refer_dataset": "table62", "column names": ["synthesized", "net_magmom"], "condition_column": {"net_magmom": ">"}, "answer_column": {"synthesized": "count"}, "condition": {"net_magmom": ">10.0"}, "tool": "calculate_data", "answer": 180, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many synthesized compounds have a net magnetic moment above {}?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -2.01622934601441 and the HOMO-LUMO gap (gap) is less than 1.7599321041748?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-2.01622934601441", "gap": "<1.7599321041748"}, "tool": "calculate_data", "answer": 1.98432129278939, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below -4.318653419191119.", "refer_dataset": "table56", "column names": ["mu_b", "shear modulus"], "condition_column": {"shear modulus": "<"}, "answer_column": {"mu_b": "avg"}, "condition": {"shear modulus": "<-4.318653419191119"}, "tool": "calculate_data", "answer": 0.5160559947368422, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below {}."}
{"question": "What is the average SSA (m²/g) for samples prepared using the 3 method?", "refer_dataset": "table11", "column names": ["PM", "SSA (m2 g -1 )"], "condition_column": {"PM": "="}, "answer_column": {"SSA (m2 g -1 )": "avg"}, "condition": {"PM": "=='3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average SSA (m²/g) for samples prepared using the {} method?"}
{"question": "Calculate the average chem_pot for symbol Kr when ef is greater than 0.27474?", "refer_dataset": "table68", "column names": ["symbol", "ef", "chem_pot"], "condition_column": {"symbol": "=", "ef": ">"}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Kr'", "ef": ">0.27474"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {} when ef is greater than {}?"}
{"question": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals 3.768?", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_delta_e"], "condition_column": {"_oqmd_band_gap": "="}, "answer_column": {"_oqmd_delta_e": "max"}, "condition": {"_oqmd_band_gap": "=='3.768'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals {}?"}
{"question": "What is the highest indirect band gap among materials with energy per atom below -195.4806 and space group number 69.0?", "refer_dataset": "table59", "column names": ["energy_per_atom", "spacegroup_number", "indir_gap"], "condition_column": {"energy_per_atom": "<", "spacegroup_number": "="}, "answer_column": {"indir_gap": "max"}, "condition": {"energy_per_atom": "<-195.4806", "spacegroup_number": "=='69.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest indirect band gap among materials with energy per atom below {} and space group number {}?"}
{"question": "Calculate the minimum CH4-pressure when C2-selectivity is greater than 38.4%?", "refer_dataset": "table20", "column names": ["CH4-pressure", "C2-selectivity"], "condition_column": {"C2-selectivity": ">"}, "answer_column": {"CH4-pressure": "min"}, "condition": {"C2-selectivity": ">38.4"}, "tool": "calculate_data", "answer": 2.7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum CH4-pressure when C2-selectivity is greater than {}%?"}
{"question": "Determine the average ethane yield (C2H6y) for M1 = Mn, Support_ID = 3, and M3_mol > 0.185.", "refer_dataset": "table17", "column names": ["M1", "Support_ID", "M3_mol", "C2H6y"], "condition_column": {"M1": "=", "Support_ID": "=", "M3_mol": ">"}, "answer_column": {"C2H6y": "avg"}, "condition": {"M1": "=='Mn'", "Support_ID": "=='3'", "M3_mol": ">0.185"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average ethane yield (C2H6y) for M1 = {}, Support_ID = {}, and M3_mol > {}."}
{"question": "Find the average CH4-conversion% for reactions where Cation1 = 4.0, Contact-times > 3.44, and O2-pressure < 0.038.", "refer_dataset": "table20", "column names": ["Cation1", "Contact-times", "O2-pressure", "CH4-conversion%"], "condition_column": {"Cation1": "=", "Contact-times": ">", "O2-pressure": "<"}, "answer_column": {"CH4-conversion%": "avg"}, "condition": {"Cation1": "=='4.0'", "Contact-times": ">3.44", "O2-pressure": "<0.038"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average CH4-conversion% for reactions where Cation1 = {}, Contact-times > {}, and O2-pressure < {}."}
{"question": "What is the highest reaction energy recorded for element Ir?", "refer_dataset": "table18", "column names": ["AA", "reaction_energy"], "condition_column": {"AA": "="}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Ir'"}, "tool": "calculate_data", "answer": 0.98, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy recorded for element {}?"}
{"question": "How many references document perovskite oxides with a calcination temperature (CT) above 850°C?", "refer_dataset": "table11", "column names": ["CT (℃)", "Ref."], "condition_column": {"CT (℃)": ">"}, "answer_column": {"Ref.": "count"}, "condition": {"CT (℃)": ">850"}, "tool": "calculate_data", "answer": 14, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document perovskite oxides with a calcination temperature (CT) above {}°C?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than 1.753?", "refer_dataset": "table2", "column names": ["Ra/Rb", "Eg(eV)"], "condition_column": {"Ra/Rb": ">"}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Ra/Rb": ">1.753"}, "tool": "calculate_data", "answer": 2.967710843373493, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than {}?"}
{"question": "What is the minimum nanoparticle dose (D) used for organic compound n-Propanol?", "refer_dataset": "table9", "column names": ["D, g/L", "OC"], "condition_column": {"OC": "="}, "answer_column": {"D, g/L": "min"}, "condition": {"OC": "=='n-Propanol'"}, "tool": "calculate_data", "answer": 1.875, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum nanoparticle dose (D) used for organic compound {}?"}
{"question": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above 6.828 eV, the density of element B (ρb) exceeds 4.51 g/cm³, and the tolerance factor (t) is less than 0.881.", "refer_dataset": "table3", "column names": ["I1b", "ρb", "t", "A_Tb"], "condition_column": {"I1b": ">", "ρb": ">", "t": "<"}, "answer_column": {"A_Tb": "max"}, "condition": {"I1b": ">6.828", "ρb": ">4.51", "t": "<0.881"}, "tool": "calculate_data", "answer": 3520.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above {} eV, the density of element B (ρb) exceeds {} g/cm³, and the tolerance factor (t) is less than {}."}
{"question": "Find the minimum Degradation efficiency (%) for Material PI-UiO-66-NH2.", "refer_dataset": "table6", "column names": ["Material", "Degradation efficiency (%)"], "condition_column": {"Material": "="}, "answer_column": {"Degradation efficiency (%)": "min"}, "condition": {"Material": "=='PI-UiO-66-NH2'"}, "tool": "calculate_data", "answer": 88.3, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum Degradation efficiency (%) for Material {}."}
{"question": "What is the average bulk_energy for bulk_formula Nd?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Nd'"}, "tool": "calculate_data", "answer": -78.51527999999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "What is the minimum Gold percentage in alloys where Ruthenium exceeds 58.9%?", "refer_dataset": "table15", "column names": ["Ru", "Au"], "condition_column": {"Ru": ">"}, "answer_column": {"Au": "min"}, "condition": {"Ru": ">58.9"}, "tool": "calculate_data", "answer": 30.3, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Gold percentage in alloys where Ruthenium exceeds {}%?"}
{"question": "What is the minimum pH recorded for Degradation Rate > 96.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">96.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "What is the minimum loading (g/l) required when light source is Visible and Reaction medium is gas-solid to achieve Yield > 0.5825 μmol/g/h?", "refer_dataset": "table10", "column names": ["light source", "Reaction medium", "Yield (μmol/g/h)", "loading (g/l)"], "condition_column": {"light source": "=", "Reaction medium": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"loading (g/l)": "min"}, "condition": {"light source": "=='Visible'", "Reaction medium": "=='gas-solid'", "Yield (μmol/g/h)": ">0.5825"}, "tool": "calculate_data", "answer": 1.945250053, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum loading (g/l) required when light source is {} and Reaction medium is {} to achieve Yield > {} μmol/g/h?"}
{"question": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds -0.107?", "refer_dataset": "table51", "column names": ["b3lyp_lumo", "b3lyp_scharber_pce"], "condition_column": {"b3lyp_lumo": ">"}, "answer_column": {"b3lyp_scharber_pce": "sum"}, "condition": {"b3lyp_lumo": ">-0.107"}, "tool": "calculate_data", "answer": 4274.506070692548, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds {}?"}
{"question": "List references (Ref) where initial concentration (C0) is greater than 50.0 mg/L.", "refer_dataset": "table9", "column names": ["Ref", "C0, mg/L"], "condition_column": {"C0, mg/L": ">"}, "answer_column": {"Ref": ""}, "condition": {"C0, mg/L": ">50.0"}, "tool": "calculate_data", "answer": [{"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 28}, {"Ref": 28}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 37}, {"Ref": 37}, {"Ref": 38}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List references (Ref) where initial concentration (C0) is greater than {} mg/L."}
{"question": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above 6.828 eV, the density of element B (ρb) exceeds 4.51 g/cm³, and the tolerance factor (t) is less than 0.819.", "refer_dataset": "table3", "column names": ["I1b", "ρb", "t", "A_Tb"], "condition_column": {"I1b": ">", "ρb": ">", "t": "<"}, "answer_column": {"A_Tb": "max"}, "condition": {"I1b": ">6.828", "ρb": ">4.51", "t": "<0.819"}, "tool": "calculate_data", "answer": 2204.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above {} eV, the density of element B (ρb) exceeds {} g/cm³, and the tolerance factor (t) is less than {}."}
{"question": "Calculate the average A_AtomN for materials where Element B is H, Cn exceeds 1, and Formation Energy is below 2.96?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='H'", "Cn": ">1", "Formation_E": "<2.96"}, "tool": "calculate_data", "answer": 8.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "For materials with B_AtomN 37, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='37'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "Calculate the average atomic number of elements in surface -111.0 where carbon species is 3.0 and reaction energy exceeds 1.714.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-111.0'", "b_key": "=='3.0'", "reaction_energy": ">1.714"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -5.09662163614031.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-5.09662163614031"}, "tool": "calculate_data", "answer": -3.417264036463159, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "For materials with B_AtomN 79, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='79'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "What is the highest Yield (μmol/g/h) for Bi type Bi2S3, Reaction medium liquid-solid, and light source Visible?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Reaction medium", "light source", "Yield (μmol/g/h)"], "condition_column": {"Bi type in photocatalyst": "=", "Reaction medium": "=", "light source": "="}, "answer_column": {"Yield (μmol/g/h)": "max"}, "condition": {"Bi type in photocatalyst": "=='Bi2S3'", "Reaction medium": "=='liquid-solid'", "light source": "=='Visible'"}, "tool": "calculate_data", "answer": 32.02, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Yield (μmol/g/h) for Bi type {}, Reaction medium {}, and light source {}?"}
{"question": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx 189.", "refer_dataset": "table63", "column names": ["Space_group_rlx", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "="}, "answer_column": {"Band_gap_GGA": "max"}, "condition": {"Space_group_rlx": "=='189'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx {}."}
{"question": "How many times has research from Guangdong Univ Technol institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='Guangdong Univ Technol'"}, "tool": "calculate_data", "answer": 304, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than 233.18 g/mol.", "refer_dataset": "table3", "column names": ["M", "χpa"], "condition_column": {"M": ">"}, "answer_column": {"χpa": "max"}, "condition": {"M": ">233.18"}, "tool": "calculate_data", "answer": 1.49, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than {} g/mol."}
{"question": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds 6.372906684875488?", "refer_dataset": "table60", "column names": ["gap", "Cv"], "condition_column": {"gap": ">"}, "answer_column": {"Cv": "min"}, "condition": {"gap": ">6.372906684875488"}, "tool": "calculate_data", "answer": 38.01800155639648, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds {}?"}
{"question": "Determine the average CO selectivity when Cation1Amount is below 20%", "refer_dataset": "table19", "column names": ["Cation1Amount", "CO sel"], "condition_column": {"Cation1Amount": "<"}, "answer_column": {"CO sel": "avg"}, "condition": {"Cation1Amount": "<20"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average CO selectivity when Cation1Amount is below {}%"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -3.76888525113988 and the HOMO-LUMO gap (gap) is less than 3.51448447186651?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-3.76888525113988", "gap": "<3.51448447186651"}, "tool": "calculate_data", "answer": 2.05689453649337, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A153]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A153]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "What is the number of articles from Singapore country that triggered an OER data warning?", "refer_dataset": "table13", "column names": ["Country", "Warning_OER.1"], "condition_column": {"Country": "="}, "answer_column": {"Warning_OER.1": "count"}, "condition": {"Country": "=='Singapore'"}, "tool": "calculate_data", "answer": 17, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the number of articles from {} country that triggered an OER data warning?"}
{"question": "Calculate the minimum COx when Cation3-mol < 0.0%, Anion2 = 0.0, and CH4-pressure > 0.66.", "refer_dataset": "table20", "column names": ["Cation3-mol", "Anion2", "CH4-pressure", "COx"], "condition_column": {"Cation3-mol": "<", "Anion2": "=", "CH4-pressure": ">"}, "answer_column": {"COx": "min"}, "condition": {"Cation3-mol": "<0.0", "Anion2": "=='0.0'", "CH4-pressure": ">0.66"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum COx when Cation3-mol < {}%, Anion2 = {}, and CH4-pressure > {}."}
{"question": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below 1.55?", "refer_dataset": "table3", "column names": ["χpb", "ρb"], "condition_column": {"χpb": "<"}, "answer_column": {"ρb": "avg"}, "condition": {"χpb": "<1.55"}, "tool": "calculate_data", "answer": 7.97054054054054, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below {}?"}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'CdS'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='CdS'"}, "tool": "calculate_data", "answer": 1.878, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "What is the average Power(W) for materials where BandGap(eV) is less than 2.1?", "refer_dataset": "table4", "column names": ["BandGap(eV)", "Power(W)"], "condition_column": {"BandGap(eV)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"BandGap(eV)": "<2.1"}, "tool": "calculate_data", "answer": 343.75, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where BandGap(eV) is less than {}?"}
{"question": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of 0.2, Illumination time (min) > 0.0, and Antibiotic dosage (mg/L) < 50.0.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Illumination time (min)", "Antibiotic dosage (mg/L)", "Degradation efficiency (%)"], "condition_column": {"Catalyst dosage (g/L)": "=", "Illumination time (min)": ">", "Antibiotic dosage (mg/L)": "<"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"Catalyst dosage (g/L)": "=='0.2'", "Illumination time (min)": ">0.0", "Antibiotic dosage (mg/L)": "<50.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of {}, Illumination time (min) > {}, and Antibiotic dosage (mg/L) < {}."}
{"question": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < 1.8401, scf_vbm > 7.095, and formula is 'ErSbPd'.", "refer_dataset": "table66", "column names": ["surf_vbm", "scf_vbm", "formula", "final_energy"], "condition_column": {"surf_vbm": "<", "scf_vbm": ">", "formula": "="}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<1.8401", "scf_vbm": ">7.095", "formula": "=='ErSbPd'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < {}, scf_vbm > {}, and formula is '{}'."}
{"question": "Materials with bandgap of 0.9814000000000004, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='0.9814000000000004'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "What is the highest Lattice Parameter observed when A_AtomN is 22.0, B_AtomN > 33.0, and Volume < 60.3019460895?", "refer_dataset": "table22", "column names": ["A_AtomN", "B_AtomN", "Volume", "Lattice"], "condition_column": {"A_AtomN": "=", "B_AtomN": ">", "Volume": "<"}, "answer_column": {"Lattice": "max"}, "condition": {"A_AtomN": "=='22.0'", "B_AtomN": ">33.0", "Volume": "<60.3019460895"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Lattice Parameter observed when A_AtomN is {}, B_AtomN > {}, and Volume < {}?"}
{"question": "What is the average Power(W) for materials where X is O, A mole is greater than 0.232, and Wave length(<nm) below 420.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='O'", "A mole": ">0.232", "Wave length(<nm)": "<420.0"}, "tool": "calculate_data", "answer": 334.1173184357542, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "What is the minimum total energy for materials with an LCD of 3.27957?", "refer_dataset": "table62", "column names": ["lcd", "energy_total"], "condition_column": {"lcd": "="}, "answer_column": {"energy_total": "min"}, "condition": {"lcd": "=='3.27957'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum total energy for materials with an LCD of {}?"}
{"question": "For surfaces with Miller indices -211, what is the maximum activation energy?", "refer_dataset": "table18", "column names": ["surfaces", "activation_energy"], "condition_column": {"surfaces": "="}, "answer_column": {"activation_energy": "max"}, "condition": {"surfaces": "=='-211'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For surfaces with Miller indices {}, what is the maximum activation energy?"}
{"question": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than 0.397072659353449.", "refer_dataset": "table57", "column names": ["_oqmd_delta_e", "_oqmd_stability"], "condition_column": {"_oqmd_delta_e": ">"}, "answer_column": {"_oqmd_stability": "min"}, "condition": {"_oqmd_delta_e": ">0.397072659353449"}, "tool": "calculate_data", "answer": 4.152984231249998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than {}."}
{"question": "What is the average number of atoms per structure in materials with a crystal system of orthorhombic and space group symbol Fmmm?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='orthorhombic'", "spacegroup_symbol": "=='Fmmm'"}, "tool": "calculate_data", "answer": 3.4545454545454546, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "What is the average journal impact factor for research institutions located in South Korea?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='South Korea'"}, "tool": "calculate_data", "answer": 11.793985294117647, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'AlP'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='AlP'"}, "tool": "calculate_data", "answer": 6.41, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "Calculate the minimum CH4-pressure when C2-selectivity is greater than 2.5%?", "refer_dataset": "table20", "column names": ["CH4-pressure", "C2-selectivity"], "condition_column": {"C2-selectivity": ">"}, "answer_column": {"CH4-pressure": "min"}, "condition": {"C2-selectivity": ">2.5"}, "tool": "calculate_data", "answer": 2.7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum CH4-pressure when C2-selectivity is greater than {}%?"}
{"question": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > 2.993211?", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": ">"}, "answer_column": {"Band_gap_GGA": "min"}, "condition": {"Band_gap_HSE_optical": ">2.993211"}, "tool": "calculate_data", "answer": 9.123469, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > {}?"}
{"question": "Calculate the maximum offset value where optb88vdw_vbm is below 4.3247.", "refer_dataset": "table52", "column names": ["offset", "optb88vdw_vbm"], "condition_column": {"optb88vdw_vbm": "<"}, "answer_column": {"offset": "max"}, "condition": {"optb88vdw_vbm": "<4.3247"}, "tool": "calculate_data", "answer": "{}", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum offset value where optb88vdw_vbm is below {}."}
{"question": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > 3.0939, scf_vbm < 12.674, and formula contains 'BN'?", "refer_dataset": "table66", "column names": ["surf_cbm", "scf_vbm", "formula", "efermi"], "condition_column": {"surf_cbm": ">", "scf_vbm": "<", "formula": "="}, "answer_column": {"efermi": "min"}, "condition": {"surf_cbm": ">3.0939", "scf_vbm": "<12.674", "formula": "=='BN'"}, "tool": "calculate_data", "answer": 0.67245591, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > {}, scf_vbm < {}, and formula contains '{}'?"}
{"question": "Find the average C2 selectivity(%) for catalysts where the tertiary metal component (M3) is Y.", "refer_dataset": "table21", "column names": ["M3", "C2 selectivity(%)"], "condition_column": {"M3": "="}, "answer_column": {"C2 selectivity(%)": "avg"}, "condition": {"M3": "=='Y'"}, "tool": "calculate_data", "answer": 52.723279486279054, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average C2 selectivity(%) for catalysts where the tertiary metal component (M3) is {}."}
{"question": "What is the average pH for catalysts where Year is 1987.0?", "refer_dataset": "table12", "column names": ["Year", "pH"], "condition_column": {"Year": "="}, "answer_column": {"pH": "avg"}, "condition": {"Year": "=='1987.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average pH for catalysts where Year is {}?"}
{"question": "Find the minimum Degradation efficiency (%) for Material MIL-101.", "refer_dataset": "table6", "column names": ["Material", "Degradation efficiency (%)"], "condition_column": {"Material": "="}, "answer_column": {"Degradation efficiency (%)": "min"}, "condition": {"Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 98.7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum Degradation efficiency (%) for Material {}."}
{"question": "What is the average reaction energy for elements with atomic number greater than 73?", "refer_dataset": "table18", "column names": ["A_AtimicN", "reaction_energy"], "condition_column": {"A_AtimicN": ">"}, "answer_column": {"reaction_energy": "avg"}, "condition": {"A_AtimicN": ">73"}, "tool": "calculate_data", "answer": -0.033980530973451384, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction energy for elements with atomic number greater than {}?"}
{"question": "Find the total electronic spatial extent (R²) values where HOMO energy is above -7.219180583953857 and internal energy (U) is below -21.00365257263184?", "refer_dataset": "table60", "column names": ["homo", "U", "r2"], "condition_column": {"homo": ">", "U": "<"}, "answer_column": {"r2": "sum"}, "condition": {"homo": ">-7.219180583953857", "U": "<-21.00365257263184"}, "tool": "calculate_data", "answer": 3374843.3804473877, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the total electronic spatial extent (R²) values where HOMO energy is above {} and internal energy (U) is below {}?"}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 0.55632613213507.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<0.55632613213507"}, "tool": "calculate_data", "answer": [{"U": 5.85213296706841}, {"U": 4.65046636299255}, {"U": 3.45857429185193}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.49215677563079}, {"U": 4.28237851192289}, {"U": 2.92411819429234}, {"U": 3.06909011621485}, {"U": 3.53668171969642}, {"U": 3.36763795283073}, {"U": 3.83280486597178}, {"U": 3.48205825390004}, {"U": 3.84218486416411}, {"U": 3.91996307758737}, {"U": 3.59120067297812}, {"U": 4.04224794538619}, {"U": 2.32843082719585}, {"U": 3.10486997561481}, {"U": 2.77914365955695}, {"U": 3.06939058969455}, {"U": 2.29578111761049}, {"U": 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1.57929557323649}, {"U": 0.83737690841562}, {"U": 1.12472100345804}, {"U": 1.30045618407598}, {"U": 1.58693282524657}, {"U": 1.57058445513809}, {"U": 1.10532086792096}, {"U": 1.56538495753286}, {"U": 1.57281841013933}, {"U": 0.72422904721251}, {"U": 1.00503327164896}, {"U": 1.01151043474612}, {"U": 1.29604575595657}, {"U": 1.53072338203995}, {"U": 1.54000148053048}, {"U": 1.81943659102465}, {"U": 1.53867417159407}, {"U": 1.81294375105029}, {"U": 1.82806671192417}, {"U": 2.10512938833516}, {"U": 1.51704791949436}, {"U": 1.79529681294693}, {"U": 1.80592573568967}, {"U": 2.08797104623792}, {"U": 0.3400436560696}, {"U": 0.63216919865853}, {"U": 0.79835977387351}, {"U": 1.08664970717376}, {"U": -0.44038003197145}, {"U": 0.01119764144861}, {"U": 0.06577668942625}, {"U": 0.33450710560454}, {"U": 0.76803285492687}, {"U": -0.15131931887545}, {"U": 0.29920277814636}, {"U": 0.34959871272402}, {"U": 0.7867405950542}, {"U": 1.06680278063644}, {"U": 0.08367445756483}, {"U": 0.52587735841829}, {"U": 0.58956205923724}, {"U": 0.85813048101778}, {"U": 1.2816099648667}, {"U": 0.37046724909232}, {"U": 0.81138725882811}, {"U": 0.87010500238699}, {"U": 1.29798446310385}, {"U": 1.57700936197791}, {"U": 0.36226562950298}, {"U": 0.80512434638604}, {"U": 0.8676385070406}, {"U": 1.30082720350309}, {"U": 1.13637937447035}, {"U": 1.56308568220995}, {"U": 0.65170258765182}, {"U": 1.09612376662931}, {"U": 1.15108167247266}, {"U": 1.58341075350193}, {"U": 0.84596783712214}, {"U": 1.13269792114083}, {"U": 1.57455070507011}, {"U": 1.11516594680362}, {"U": 1.55441636911742}, {"U": -0.42337062020763}, {"U": 0.08537017311548}, {"U": 0.35609155269838}, {"U": 0.03447519128023}, {"U": 0.53242768027572}, {"U": 0.79471489992412}, {"U": 1.777190019779}, {"U": 1.84216283734135}, {"U": 2.05515411662908}, {"U": 2.07187611897753}, {"U": 2.16404309285906}, {"U": 2.37747071189557}, {"U": 1.97574812078971}, {"U": 2.28544221709599}, {"U": 2.59587312663074}, {"U": -0.46481505790313}, {"U": 0.02272537181758}, {"U": 0.2923624340607}, {"U": 0.02470065834499}, {"U": 0.49344973792662}, {"U": 0.75029446837317}, {"U": 0.02821227883816}, {"U": 0.51782989478809}, {"U": 0.79154817072939}, {"U": 0.78156199995192}, {"U": 0.51016651464934}, {"U": 0.97053107774094}, {"U": 1.23259620829565}, {"U": 0.51314512131766}, {"U": 0.7839265955965}, {"U": 0.52253034513573}, {"U": 0.99154331881692}, {"U": 1.25255809859912}, {"U": 1.00063068196816}, {"U": 1.27568671809733}, {"U": 0.51222279837563}, {"U": 0.7826306404145}, {"U": 1.24278095285101}, {"U": 1.27492377674018}, {"U": 1.46573227478753}, {"U": 1.72787840254112}, {"U": 1.25718800299935}, {"U": 1.4641384589387}, {"U": 1.72453138925856}, {"U": 1.73750400514295}, {"U": 1.04952424914733}, {"U": 1.51195032159095}, {"U": 1.54291737968999}, {"U": 2.00154964785081}, {"U": 1.99893160935813}, {"U": 0.74577952773909}, {"U": 0.85288133996808}, {"U": 1.05577148471219}, {"U": 1.22325540229632}, {"U": 1.52839797858837}, {"U": 1.2517847059905}, {"U": 1.35575898121776}, {"U": 1.56485978214661}, {"U": 1.22768412010579}, {"U": 1.53960694578757}, {"U": 1.70899037832597}, {"U": 2.01559090419778}, {"U": 1.70760297469362}, {"U": 1.8083974566618}, {"U": 2.02033054673842}, {"U": 1.80642739576012}, {"U": 2.31184730392935}, {"U": 2.09894747309196}, {"U": 2.30945135453036}, {"U": 0.78695484570929}, {"U": 1.26177087676797}, {"U": 1.09546795059971}, {"U": 1.56442605521069}, {"U": 1.27204968258654}, {"U": 1.74523270560338}, {"U": 1.58354661977101}, {"U": 1.82557670126198}, {"U": 2.05182800584945}, {"U": 1.57562457115843}, {"U": 2.0052023602388}, {"U": 1.88527424964596}, {"U": 0.77189981796995}, {"U": 1.26158797986729}, {"U": 1.28404249364582}, {"U": 1.24731418317516}, {"U": 1.7286230542082}, {"U": 1.66401341763435}, {"U": 1.68445345269247}, {"U": 1.68175702981378}, {"U": 1.66775235284695}, {"U": 1.69638355624295}, {"U": 2.15033105093333}, {"U": 1.66656613580536}, {"U": 2.16992976024829}, {"U": 0.89750818373552}, {"U": 1.39497991516349}, {"U": 1.41447149915091}, {"U": 1.41040334951708}, {"U": 1.89166257710565}, {"U": 1.91104442295265}, {"U": 1.91333063421123}, {"U": 1.89792548954772}, {"U": 1.93441342123462}, {"U": 2.3823932513369}, {"U": 1.87871086372419}, {"U": 2.38514454328579}, {"U": 0.05679645160256}, {"U": 0.341940558211}, {"U": 0.32816580877646}, {"U": 0.56508000267395}, {"U": 0.84792744677235}, {"U": 0.82872065938743}, {"U": 0.56060164142}, {"U": 0.83194487046524}, {"U": 0.84336024988093}, {"U": 1.11763766777575}, {"U": 0.82945747261591}, {"U": 1.10670304592758}, {"U": 0.83144582320765}, {"U": 1.10423132495545}, {"U": -0.451758832007}, {"U": 0.05719098634546}, {"U": 0.32545370902057}, {"U": 0.05198626311451}, {"U": 0.83160520479254}, {"U": 0.32289576522383}, {"U": 0.82306914515622}, {"U": 1.10490543067512}, {"U": -0.16529525490075}, {"U": 0.34283675302437}, {"U": 0.61549161412881}, {"U": 0.33741516632545}, {"U": 0.83953247903085}, {"U": 1.12195403463194}, {"U": 1.11910084298124}, {"U": 1.61456854694026}, {"U": 1.60701229212905}, {"U": 1.33528236677951}, {"U": 1.34363552951513}, {"U": 1.61223269223721}, {"U": 1.34519276598383}, {"U": 1.62650648892934}, {"U": 1.62129392725978}, {"U": 1.88609206007332}, {"U": 0.7265936428571}, {"U": 1.23522992366553}, {"U": 1.5090683889987}, {"U": 1.01337598313312}, {"U": 1.52077379064262}, {"U": -0.43341427286817}, {"U": 0.06862465545122}, {"U": 0.33831136113882}, {"U": 0.77490193995407}, {"U": 0.57407591737485}, {"U": 0.84317735298024}, {"U": 1.2810560485389}, {"U": 1.11634693821948}, {"U": 0.79919587399094}, {"U": 1.55600757215339}, {"U": -0.42890717067269}, {"U": 0.07262748476338}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than -2.15174326472055?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<-2.15174326472055"}, "tool": "calculate_data", "answer": -3.11214839297741, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "For source_id mp-567624, what is the maximum total magnetization observed?", "refer_dataset": "table67", "column names": ["source_id", "total_magnetization"], "condition_column": {"source_id": "="}, "answer_column": {"total_magnetization": "max"}, "condition": {"source_id": "=='mp-567624'"}, "tool": "calculate_data", "answer": 4.0015537, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For source_id {}, what is the maximum total magnetization observed?"}
{"question": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > 1.360485999999999, synthesized as True, and sourced from CSD?", "refer_dataset": "table62", "column names": ["bandgap", "synthesized", "source", "pld"], "condition_column": {"bandgap": ">", "synthesized": "=", "source": "="}, "answer_column": {"pld": "min"}, "condition": {"bandgap": ">1.360485999999999", "synthesized": "=='True'", "source": "=='CSD'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > {}, synthesized as {}, and sourced from {}?"}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MB under Experimental Temperature 25°C and Light Wavelength 425 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MB'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='425'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "Calculate the average nanoparticle dose (D) for organic compound Umbelliferone under light intensity (I) > 0.176 mW/cm² and initial concentration (C0) < 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2", "C0, mg/L", "D, g/L"], "condition_column": {"OC": "=", "I, mW/cm2": ">", "C0, mg/L": "<"}, "answer_column": {"D, g/L": "avg"}, "condition": {"OC": "=='Umbelliferone'", "I, mW/cm2": ">0.176", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average nanoparticle dose (D) for organic compound {} under light intensity (I) > {} mW/cm² and initial concentration (C0) < {} mg/L."}
{"question": "How many materials have a bandgap less than 1.2989999999999997?", "refer_dataset": "table67", "column names": ["bandgap", "material_id"], "condition_column": {"bandgap": "<"}, "answer_column": {"material_id": "count"}, "condition": {"bandgap": "<1.2989999999999997"}, "tool": "calculate_data", "answer": 3429, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many materials have a bandgap less than {}?"}
{"question": "Identify materials where enthalpy (H) is greater than -29.38081359863281, energy gap (gap) is less than 8.767508506774902, and R² spatial extent is above 177.19630432128906. What is their maximum internal energy (U)?", "refer_dataset": "table60", "column names": ["H", "gap", "r2", "U"], "condition_column": {"H": ">", "gap": "<", "r2": ">"}, "answer_column": {"U": "max"}, "condition": {"H": ">-29.38081359863281", "gap": "<8.767508506774902", "r2": ">177.19630432128906"}, "tool": "calculate_data", "answer": -18.64750099182129, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where enthalpy (H) is greater than {}, energy gap (gap) is less than {}, and R² spatial extent is above {}. What is their maximum internal energy (U)?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than -0.5368441919999996?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.5368441919999996"}, "tool": "calculate_data", "answer": 126.54135133412214, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "Find the total electronic spatial extent (R²) values where HOMO energy is above -7.099450588226318 and internal energy (U) is below -29.22657966613769?", "refer_dataset": "table60", "column names": ["homo", "U", "r2"], "condition_column": {"homo": ">", "U": "<"}, "answer_column": {"r2": "sum"}, "condition": {"homo": ">-7.099450588226318", "U": "<-29.22657966613769"}, "tool": "calculate_data", "answer": 3173188.869796753, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the total electronic spatial extent (R²) values where HOMO energy is above {} and internal energy (U) is below {}?"}
{"question": "Determine the average H2 selectivity when Cation1 is V, Cation3Amount > 0%, and O2 conv < 2.5%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='V'", "Cation3Amount": ">0", "O2 conv": "<2.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.588416180625?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.588416180625"}, "tool": "calculate_data", "answer": 0.0005015368852459011, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "How many Preparations have Contact-times shorter than 10.0 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<10.0"}, "tool": "calculate_data", "answer": 1821, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to 191.0?", "refer_dataset": "table54", "column names": ["bulk modulus", "gap pbe"], "condition_column": {"bulk modulus": "="}, "answer_column": {"gap pbe": "avg"}, "condition": {"bulk modulus": "=='191.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to {}?"}
{"question": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below 0.4398626224592421.", "refer_dataset": "table56", "column names": ["mu_b", "shear modulus"], "condition_column": {"shear modulus": "<"}, "answer_column": {"mu_b": "avg"}, "condition": {"shear modulus": "<0.4398626224592421"}, "tool": "calculate_data", "answer": 0.45431530769230777, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below {}."}
{"question": "Find the lowest e_hull value for materials where bandgap (gap pbe) is greater than 1.5930000000000002 and shear modulus is less than -52.72219089789422.", "refer_dataset": "table56", "column names": ["e_hull", "gap pbe", "shear modulus"], "condition_column": {"gap pbe": ">", "shear modulus": "<"}, "answer_column": {"e_hull": "min"}, "condition": {"gap pbe": ">1.5930000000000002", "shear modulus": "<-52.72219089789422"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest e_hull value for materials where bandgap (gap pbe) is greater than {} and shear modulus is less than {}."}
{"question": "What is the average overpotential in neutral conditions for studies using the nan method published in journals with an impact factor above 4.326?", "refer_dataset": "table13", "column names": ["Judge_Phys_Chem_Deposition", "Neutral_OVP", "IF"], "condition_column": {"Neutral_OVP": "=", "IF": ">"}, "answer_column": {"Judge_Phys_Chem_Deposition": "avg"}, "condition": {"Neutral_OVP": "=='nan'", "IF": ">4.326"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average overpotential in neutral conditions for studies using the {} method published in journals with an impact factor above {}?"}
{"question": "Calculate the average nanoparticle dose (D) for organic compound Acetone under light intensity (I) > 0.176 mW/cm² and initial concentration (C0) < 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2", "C0, mg/L", "D, g/L"], "condition_column": {"OC": "=", "I, mW/cm2": ">", "C0, mg/L": "<"}, "answer_column": {"D, g/L": "avg"}, "condition": {"OC": "=='Acetone'", "I, mW/cm2": ">0.176", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average nanoparticle dose (D) for organic compound {} under light intensity (I) > {} mW/cm² and initial concentration (C0) < {} mg/L."}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than 0.89, Element B's Electronegativity (χpb) is less than 1.54, and the Tolerance Factor (t) is 0.939?", "refer_dataset": "table2", "column names": ["χpa", "χpb", "t", "Eg(eV)"], "condition_column": {"χpa": ">", "χpb": "<", "t": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"χpa": ">0.89", "χpb": "<1.54", "t": "=='0.939'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than {}, Element B's Electronegativity (χpb) is less than {}, and the Tolerance Factor (t) is {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A124]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A124]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "What is the average calcination temperature for experiments using a photocatalyst dose of 1.0 g/L?", "refer_dataset": "table1", "column names": ["Photocatalyst dose(g L-1)", "Calcination temperature(K)"], "condition_column": {"Photocatalyst dose(g L-1)": "="}, "answer_column": {"Calcination temperature(K)": "avg"}, "condition": {"Photocatalyst dose(g L-1)": "=='1.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature for experiments using a photocatalyst dose of {} g/L?"}
{"question": "What is the minimum journal impact factor for studies using the Shenzhen Univ Shenzhen method?", "refer_dataset": "table13", "column names": ["Facility", "IF"], "condition_column": {"Facility": "="}, "answer_column": {"IF": "min"}, "condition": {"Facility": "=='Shenzhen Univ Shenzhen'"}, "tool": "calculate_data", "answer": 14.511, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum journal impact factor for studies using the {} method?"}
{"question": "For Support1 40, what is the maximum C2-yield?", "refer_dataset": "table20", "column names": ["Support1", "C2-yield"], "condition_column": {"Support1": "="}, "answer_column": {"C2-yield": "max"}, "condition": {"Support1": "=='40'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For Support1 {}, what is the maximum C2-yield?"}
{"question": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > -1.9477, scf_vbm < 0.922, and formula contains 'CdSe'?", "refer_dataset": "table66", "column names": ["surf_cbm", "scf_vbm", "formula", "efermi"], "condition_column": {"surf_cbm": ">", "scf_vbm": "<", "formula": "="}, "answer_column": {"efermi": "min"}, "condition": {"surf_cbm": ">-1.9477", "scf_vbm": "<0.922", "formula": "=='CdSe'"}, "tool": "calculate_data", "answer": -2.36068277, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > {}, scf_vbm < {}, and formula contains '{}'?"}
{"question": "What is the highest SSA observed when CT exceeds 800°C and preparation method is 2?", "refer_dataset": "table11", "column names": ["CT (℃)", "PM", "SSA (m2 g -1 )"], "condition_column": {"CT (℃)": ">", "PM": "="}, "answer_column": {"SSA (m2 g -1 )": "avg"}, "condition": {"CT (℃)": ">800", "PM": "=='2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SSA observed when CT exceeds {}°C and preparation method is {}?"}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.0459919669047632, gap pbe > 0.6698, and mu_b > 0.000656?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.0459919669047632", "gap pbe": ">0.6698", "mu_b": ">0.000656"}, "tool": "calculate_data", "answer": 126.52464954914684, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -0.54667200640302 and Gibbs free energy (G) under 6.53867256157596.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-0.54667200640302", "G": "<6.53867256157596"}, "tool": "calculate_data", "answer": -2.1482283173896763, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -4.70522568426234.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-4.70522568426234"}, "tool": "calculate_data", "answer": -3.160839525902964, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 53.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">53.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.7, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "What is the average number of atoms per structure in materials with a crystal system of trigonal and space group symbol P-3m1?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='trigonal'", "spacegroup_symbol": "=='P-3m1'"}, "tool": "calculate_data", "answer": 3.0483870967741935, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "How many unique surfaces are recorded for the element Ni?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='Ni'"}, "tool": "calculate_data", "answer": 52, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -5.01573641744191.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-5.01573641744191"}, "tool": "calculate_data", "answer": -3.2895251669911367, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "Calculate the average atomic number of elements in surface -111.0 where carbon species is 3.0 and reaction energy exceeds 1.858.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-111.0'", "b_key": "=='3.0'", "reaction_energy": ">1.858"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "What is the average formation energy (ef) for bulk_formula Pr and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Pr'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 1.670445, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "What is the maximum initial concentration (C0) recorded for reference number 20?", "refer_dataset": "table9", "column names": ["C0, mg/L", "Ref"], "condition_column": {"Ref": "="}, "answer_column": {"C0, mg/L": "max"}, "condition": {"Ref": "=='20'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum initial concentration (C0) recorded for reference number {}?"}
{"question": "How many Preparations use both Anion1 0.0 and Support1 13.0, with C2-yield ≥ 5.005%?", "refer_dataset": "table20", "column names": ["Anion1", "Support1", "C2-yield", "Preparation"], "condition_column": {"Anion1": "=", "Support1": "=", "C2-yield": ">="}, "answer_column": {"Preparation": "count"}, "condition": {"Anion1": "=='0.0'", "Support1": "=='13.0'", "C2-yield": ">=5.005"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations use both Anion1 {} and Support1 {}, with C2-yield ≥ {}%?"}
{"question": "For entries where dipole moment (mu) is below 1.1502000093460083, what is the average polarizability (alpha)?", "refer_dataset": "table60", "column names": ["mu", "alpha"], "condition_column": {"mu": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": "<1.1502000093460083"}, "tool": "calculate_data", "answer": 63.503137423765224, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For entries where dipole moment (mu) is below {}, what is the average polarizability (alpha)?"}
{"question": "For Element A equal to 0, what is the average Volume?", "refer_dataset": "table22", "column names": ["A", "Volume"], "condition_column": {"A": "="}, "answer_column": {"Volume": "avg"}, "condition": {"A": "=='0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For Element A equal to {}, what is the average Volume?"}
{"question": "For entries where dipole moment (mu) is below 2.893699884414673, what is the average polarizability (alpha)?", "refer_dataset": "table60", "column names": ["mu", "alpha"], "condition_column": {"mu": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": "<2.893699884414673"}, "tool": "calculate_data", "answer": 60.56322400183371, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For entries where dipole moment (mu) is below {}, what is the average polarizability (alpha)?"}
{"question": "What is the average net magnetic moment for materials referenced under DOI https://doi.org/10.1016/j.ica.2016.11.013?", "refer_dataset": "table62", "column names": ["doi", "net_magmom"], "condition_column": {"doi": "="}, "answer_column": {"net_magmom": "avg"}, "condition": {"doi": "=='https://doi.org/10.1016/j.ica.2016.11.013'"}, "tool": "calculate_data", "answer": 1.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average net magnetic moment for materials referenced under DOI {}?"}
{"question": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than 1.57010364655?", "refer_dataset": "table51", "column names": ["pbe0_homo", "pbe0_scharber_pce"], "condition_column": {"pbe0_scharber_pce": "<"}, "answer_column": {"pbe0_homo": "max"}, "condition": {"pbe0_scharber_pce": "<1.57010364655"}, "tool": "calculate_data", "answer": -0.173, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than {}?"}
{"question": "What is the average reaction rate (-log(k)) when pH is 10.6?", "refer_dataset": "table9", "column names": ["pH", "-log(k), min-1"], "condition_column": {"pH": "="}, "answer_column": {"-log(k), min-1": "avg"}, "condition": {"pH": "=='10.6'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction rate (-log(k)) when pH is {}?"}
{"question": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than 0.234548721875.", "refer_dataset": "table56", "column names": ["gap pbe", "e_hull"], "condition_column": {"e_hull": "<"}, "answer_column": {"gap pbe": "max"}, "condition": {"e_hull": "<0.234548721875"}, "tool": "calculate_data", "answer": 7.7947, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than {}."}
{"question": "What is the average formation energy (ef) for bulk_formula Cu and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Cu'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 0.92701, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "What is the minimum formula_energy recorded for the chemical formula CaO4W?", "refer_dataset": "table64", "column names": ["formula", "formula_energy"], "condition_column": {"formula": "="}, "answer_column": {"formula_energy": "min"}, "condition": {"formula": "=='CaO4W'"}, "tool": "calculate_data", "answer": -2.84179646508, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum formula_energy recorded for the chemical formula {}?"}
{"question": "Determine the total CO yield (COy) when Support_ID is 10 and M1_atom_number is less than 25.", "refer_dataset": "table17", "column names": ["Support_ID", "M1_atom_number", "COy"], "condition_column": {"Support_ID": "=", "M1_atom_number": "<"}, "answer_column": {"COy": "sum"}, "condition": {"Support_ID": "=='10'", "M1_atom_number": "<25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total CO yield (COy) when Support_ID is {} and M1_atom_number is less than {}."}
{"question": "Find the total electronic spatial extent (R²) values where HOMO energy is above -8.789278030395508 and internal energy (U) is below -41.38867950439453?", "refer_dataset": "table60", "column names": ["homo", "U", "r2"], "condition_column": {"homo": ">", "U": "<"}, "answer_column": {"r2": "sum"}, "condition": {"homo": ">-8.789278030395508", "U": "<-41.38867950439453"}, "tool": "calculate_data", "answer": 3864333.1791992188, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the total electronic spatial extent (R²) values where HOMO energy is above {} and internal energy (U) is below {}?"}
{"question": "Calculate the average overpotential in alkaline conditions for articles from WA 98195 USA country.", "refer_dataset": "table13", "column names": ["Country", "Alkaline_OVP"], "condition_column": {"Country": "="}, "answer_column": {"Alkaline_OVP": "avg"}, "condition": {"Country": "=='WA 98195 USA'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average overpotential in alkaline conditions for articles from {} country."}
{"question": "Determine the minimum Calcination Temperature required for 65.0% Degradation Rate when pH is 7.0 and Catalyst/Pollutant mass ratio is 50.0.", "refer_dataset": "table8", "column names": ["Calcination temperature(°C)", "Degradation rate(%)", "pH", "Catalyst/Pollutant mass ratio"], "condition_column": {"Degradation rate(%)": "=", "pH": "=", "Catalyst/Pollutant mass ratio": "="}, "answer_column": {"Calcination temperature(°C)": "min"}, "condition": {"Degradation rate(%)": "=='65.0'", "pH": "=='7.0'", "Catalyst/Pollutant mass ratio": "=='50.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Calcination Temperature required for {}% Degradation Rate when pH is {} and Catalyst/Pollutant mass ratio is {}."}
{"question": "What is the minimum Bandgap (Eg) observed at a loading of 1.666666667 g/l?", "refer_dataset": "table10", "column names": ["loading (g/l)", "Eg(eV)"], "condition_column": {"loading (g/l)": "="}, "answer_column": {"Eg(eV)": "min"}, "condition": {"loading (g/l)": "=='1.666666667'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Bandgap (Eg) observed at a loading of {} g/l?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -5.77648057478114.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-5.77648057478114"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the highest C.E. % for Material Pd when Surface Strain is 0.0?", "refer_dataset": "table12", "column names": ["Material", "Surface Strain", "C.E. %"], "condition_column": {"Material": "=", "Surface Strain": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"Material": "=='Pd'", "Surface Strain": "=='0.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C.E. % for Material {} when Surface Strain is {}?"}
{"question": "What is the highest light intensity used with the co-catalyst 'Pt(0.25 wt％)'?", "refer_dataset": "table1", "column names": ["Co-catalyst", "Light intensity(W)"], "condition_column": {"Co-catalyst": "="}, "answer_column": {"Light intensity(W)": "max"}, "condition": {"Co-catalyst": "=='Pt(0.25 wt％)'"}, "tool": "calculate_data", "answer": "Xe lamp (300 W), λ > 420 nm", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest light intensity used with the co-catalyst '{}'?"}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 120 minutes, pH > 7.0, and Dopant Fe?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<120", "pH": ">7.0", "Dopant": "=='Fe'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "What is the maximum C.E. % observed for pH level 4.2?", "refer_dataset": "table12", "column names": ["pH", "C.E. %"], "condition_column": {"pH": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"pH": "=='4.2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum C.E. % observed for pH level {}?"}
{"question": "Find the average Eg(eV) for samples calcined at exactly 433.0 K.", "refer_dataset": "table1", "column names": ["Calcination temperature(K)", "Eg(eV)"], "condition_column": {"Calcination temperature(K)": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Calcination temperature(K)": "=='433.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Eg(eV) for samples calcined at exactly {} K."}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 5.328265494185?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='5.328265494185'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the minimum SBET (m²/g) required for Bi type BiOBr, light source UV–VIS, and Yield > 0.1 μmol/g/h?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "light source", "Yield (μmol/g/h)", "SBET (m2 /g)"], "condition_column": {"Bi type in photocatalyst": "=", "light source": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"SBET (m2 /g)": "min"}, "condition": {"Bi type in photocatalyst": "=='BiOBr'", "light source": "=='UV–VIS'", "Yield (μmol/g/h)": ">0.1"}, "tool": "calculate_data", "answer": 59.75, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum SBET (m²/g) required for Bi type {}, light source {}, and Yield > {} μmol/g/h?"}
{"question": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals 0.423?", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_delta_e"], "condition_column": {"_oqmd_band_gap": "="}, "answer_column": {"_oqmd_delta_e": "max"}, "condition": {"_oqmd_band_gap": "=='0.423'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals {}?"}
{"question": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > 15.0, pH < 2.2, and Antibiotic dosage (mg/L) = 50.0.", "refer_dataset": "table6", "column names": ["Illumination time (min)", "pH", "Antibiotic dosage (mg/L)", "Pore Volume (cm3/g)"], "condition_column": {"Illumination time (min)": ">", "pH": "<", "Antibiotic dosage (mg/L)": "="}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Illumination time (min)": ">15.0", "pH": "<2.2", "Antibiotic dosage (mg/L)": "=='50.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > {}, pH < {}, and Antibiotic dosage (mg/L) = {}."}
{"question": "What is the minimum reaction solution volume used when the preparation method is 'Milling assistant method'?", "refer_dataset": "table1", "column names": ["Preparation method", "Reaction solution"], "condition_column": {"Preparation method": "="}, "answer_column": {"Reaction solution": "min"}, "condition": {"Preparation method": "=='Milling assistant method'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reaction solution volume used when the preparation method is '{}'?"}
{"question": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > -2.3043, scf_vbm < 7.388, and formula contains 'BeAlB'?", "refer_dataset": "table66", "column names": ["surf_cbm", "scf_vbm", "formula", "efermi"], "condition_column": {"surf_cbm": ">", "scf_vbm": "<", "formula": "="}, "answer_column": {"efermi": "min"}, "condition": {"surf_cbm": ">-2.3043", "scf_vbm": "<7.388", "formula": "=='BeAlB'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > {}, scf_vbm < {}, and formula contains '{}'?"}
{"question": "What is the maximum overpotential V for Material Family Molecular catalyst, Functionalization 0.0, and Year 1984.0?", "refer_dataset": "table12", "column names": ["Material Family", "Functionalization", "Year", "overpotential V"], "condition_column": {"Material Family": "=", "Functionalization": "=", "Year": "="}, "answer_column": {"overpotential V": "max"}, "condition": {"Material Family": "=='Molecular catalyst'", "Functionalization": "=='0.0'", "Year": "=='1984.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum overpotential V for Material Family {}, Functionalization {}, and Year {}?"}
{"question": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than 235.24 g/mol.", "refer_dataset": "table3", "column names": ["M", "χpa"], "condition_column": {"M": ">"}, "answer_column": {"χpa": "max"}, "condition": {"M": ">235.24"}, "tool": "calculate_data", "answer": 1.49, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than {} g/mol."}
{"question": "What is the minimum journal impact factor for studies using the Tianjin Univ method?", "refer_dataset": "table13", "column names": ["Facility", "IF"], "condition_column": {"Facility": "="}, "answer_column": {"IF": "min"}, "condition": {"Facility": "=='Tianjin Univ'"}, "tool": "calculate_data", "answer": 32.086, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum journal impact factor for studies using the {} method?"}
{"question": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > 0.1, Mg < 0.0, and La = 0.2?", "refer_dataset": "table16", "column names": ["Ca", "Mg", "La", "J.uAcm2_0.80_fromCV"], "condition_column": {"Ca": ">", "Mg": "<", "La": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "max"}, "condition": {"Ca": ">0.1", "Mg": "<0.0", "La": "=='0.2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > {}, Mg < {}, and La = {}?"}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'BaNaBr'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='BaNaBr'"}, "tool": "calculate_data", "answer": 1.924, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "What is the average J.uAcm2_0.80_fromCV when Mn concentration exceeds 0.0?", "refer_dataset": "table16", "column names": ["Mn", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">"}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.0"}, "tool": "calculate_data", "answer": 343.32907549526556, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average J.uAcm2_0.80_fromCV when Mn concentration exceeds {}?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -5.77648057478114.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-5.77648057478114"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the average calcination temperature (CT) for samples referenced in study [38]?", "refer_dataset": "table11", "column names": ["Ref.", "CT (℃)"], "condition_column": {"Ref.": "="}, "answer_column": {"CT (℃)": "avg"}, "condition": {"Ref.": "=='[38]'"}, "tool": "calculate_data", "answer": 700.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature (CT) for samples referenced in study {}?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -0.55947638591013 and the HOMO-LUMO gap (gap) is less than 1.93793017046236?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-0.55947638591013", "gap": "<1.93793017046236"}, "tool": "calculate_data", "answer": 1.98432129278939, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -1.77757499937717 and Gibbs free energy (G) under 4.02144207781596.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-1.77757499937717", "G": "<4.02144207781596"}, "tool": "calculate_data", "answer": -1.8894027191513425, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than 1.52547374609?", "refer_dataset": "table51", "column names": ["pbe0_homo", "pbe0_scharber_pce"], "condition_column": {"pbe0_scharber_pce": "<"}, "answer_column": {"pbe0_homo": "max"}, "condition": {"pbe0_scharber_pce": "<1.52547374609"}, "tool": "calculate_data", "answer": -0.173, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than {}?"}
{"question": "Calculate the average chem_pot for symbol Pm when ef is greater than 1.72748?", "refer_dataset": "table68", "column names": ["symbol", "ef", "chem_pot"], "condition_column": {"symbol": "=", "ef": ">"}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Pm'", "ef": ">1.72748"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {} when ef is greater than {}?"}
{"question": "Determine the average ethane yield (C2H6y) for M1 = Mn, Support_ID = 8, and M3_mol > 0.185.", "refer_dataset": "table17", "column names": ["M1", "Support_ID", "M3_mol", "C2H6y"], "condition_column": {"M1": "=", "Support_ID": "=", "M3_mol": ">"}, "answer_column": {"C2H6y": "avg"}, "condition": {"M1": "=='Mn'", "Support_ID": "=='8'", "M3_mol": ">0.185"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average ethane yield (C2H6y) for M1 = {}, Support_ID = {}, and M3_mol > {}."}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) CC=O?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='CC=O'"}, "tool": "calculate_data", "answer": -3.64540569242996, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than 0.0333794231034492.", "refer_dataset": "table57", "column names": ["_oqmd_delta_e", "_oqmd_stability"], "condition_column": {"_oqmd_delta_e": ">"}, "answer_column": {"_oqmd_stability": "min"}, "condition": {"_oqmd_delta_e": ">0.0333794231034492"}, "tool": "calculate_data", "answer": 4.152984231249998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than {}."}
{"question": "What is the average bulk_energy for bulk_formula Xe?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Xe'"}, "tool": "calculate_data", "answer": 37.0864, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'BAs'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='BAs'"}, "tool": "calculate_data", "answer": 7.282, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "Calculate the average nanoparticle dose (D) for organic compound Phenol under light intensity (I) > 0.176 mW/cm² and initial concentration (C0) < 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2", "C0, mg/L", "D, g/L"], "condition_column": {"OC": "=", "I, mW/cm2": ">", "C0, mg/L": "<"}, "answer_column": {"D, g/L": "avg"}, "condition": {"OC": "=='Phenol'", "I, mW/cm2": ">0.176", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average nanoparticle dose (D) for organic compound {} under light intensity (I) > {} mW/cm² and initial concentration (C0) < {} mg/L."}
{"question": "What is the average reaction time for Gas phase, UVVIS light irradiation, and noble metal none?", "refer_dataset": "table7", "column names": ["Phase", "Light", "Noble_Metal", "Rxn_Time"], "condition_column": {"Phase": "=", "Light": "=", "Noble_Metal": "="}, "answer_column": {"Rxn_Time": "avg"}, "condition": {"Phase": "=='Gas'", "Light": "=='UVVIS'", "Noble_Metal": "=='none'"}, "tool": "calculate_data", "answer": 5.956140350877193, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction time for {} phase, {} light irradiation, and noble metal {}?"}
{"question": "What is the minimum loading (g/l) required when light source is UV–VIS and Reaction medium is gas-solid to achieve Yield > 15.86 μmol/g/h?", "refer_dataset": "table10", "column names": ["light source", "Reaction medium", "Yield (μmol/g/h)", "loading (g/l)"], "condition_column": {"light source": "=", "Reaction medium": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"loading (g/l)": "min"}, "condition": {"light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'", "Yield (μmol/g/h)": ">15.86"}, "tool": "calculate_data", "answer": 0.194174757, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum loading (g/l) required when light source is {} and Reaction medium is {} to achieve Yield > {} μmol/g/h?"}
{"question": "What is the highest indirect band gap among materials with energy per atom below -195.4832 and space group number 194.0?", "refer_dataset": "table59", "column names": ["energy_per_atom", "spacegroup_number", "indir_gap"], "condition_column": {"energy_per_atom": "<", "spacegroup_number": "="}, "answer_column": {"indir_gap": "max"}, "condition": {"energy_per_atom": "<-195.4832", "spacegroup_number": "=='194.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest indirect band gap among materials with energy per atom below {} and space group number {}?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Indirect\", Band_gap_HSE_optical < 5.968427, and Magnetic_ordering \"NM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Indirect'", "Band_gap_HSE_optical": "<5.968427", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 2.037844}, {"Band_gap_GGA": 1.489848}, {"Band_gap_GGA": 1.862139}, {"Band_gap_GGA": 1.623}, {"Band_gap_GGA": 1.150497}, {"Band_gap_GGA": 1.119908}, {"Band_gap_GGA": 1.173072}, {"Band_gap_GGA": 1.426179}, {"Band_gap_GGA": 0.694418}, {"Band_gap_GGA": 1.959881}, {"Band_gap_GGA": 0.846528}, {"Band_gap_GGA": 0.759537}, {"Band_gap_GGA": 1.082826}, {"Band_gap_GGA": 0.812729}, {"Band_gap_GGA": 1.604719}, {"Band_gap_GGA": 0.121138}, {"Band_gap_GGA": 1.327256}, {"Band_gap_GGA": 1.324094}, {"Band_gap_GGA": 0.763006}, {"Band_gap_GGA": 1.298135}, {"Band_gap_GGA": 1.812356}, {"Band_gap_GGA": 1.472881}, {"Band_gap_GGA": 1.917619}, {"Band_gap_GGA": 0.736109}, {"Band_gap_GGA": 2.514819}, {"Band_gap_GGA": 1.166888}, {"Band_gap_GGA": 1.199719}, {"Band_gap_GGA": 0.476453}, {"Band_gap_GGA": 0.049785}, {"Band_gap_GGA": 0.796627}, {"Band_gap_GGA": 0.517763}, {"Band_gap_GGA": 0.451375}, {"Band_gap_GGA": 2.638943}, {"Band_gap_GGA": 1.241031}, {"Band_gap_GGA": 2.034844}, {"Band_gap_GGA": 1.819333}, {"Band_gap_GGA": 2.646834}, {"Band_gap_GGA": 2.228965}, {"Band_gap_GGA": 2.252553}, {"Band_gap_GGA": 2.372023}, {"Band_gap_GGA": 3.154054}, {"Band_gap_GGA": 1.300029}, {"Band_gap_GGA": 2.619155}, {"Band_gap_GGA": 2.616013}, {"Band_gap_GGA": 2.212373}, {"Band_gap_GGA": 2.957716}, {"Band_gap_GGA": 1.3973739999999997}, {"Band_gap_GGA": 2.576314}, {"Band_gap_GGA": 1.20222}, {"Band_gap_GGA": 2.498679}, {"Band_gap_GGA": 3.357065}, {"Band_gap_GGA": 3.1444340000000004}, {"Band_gap_GGA": 0.116559}, {"Band_gap_GGA": 1.852829}, {"Band_gap_GGA": 2.325548}, {"Band_gap_GGA": 2.330909}, {"Band_gap_GGA": 0.882624}, {"Band_gap_GGA": 1.484641}, {"Band_gap_GGA": 2.609377}, {"Band_gap_GGA": 1.362999}, {"Band_gap_GGA": 1.2176}, {"Band_gap_GGA": 2.218596}, {"Band_gap_GGA": 1.817097}, {"Band_gap_GGA": 1.446497}, {"Band_gap_GGA": 2.58846}, {"Band_gap_GGA": 1.58958}, {"Band_gap_GGA": 2.79909}, {"Band_gap_GGA": 0.636041}, {"Band_gap_GGA": 0.611795}, {"Band_gap_GGA": 0.803879}, {"Band_gap_GGA": 1.403779}, {"Band_gap_GGA": 1.104735}, {"Band_gap_GGA": 1.829391}, {"Band_gap_GGA": 1.512535}, {"Band_gap_GGA": 0.241175}, {"Band_gap_GGA": 1.521364}, {"Band_gap_GGA": 0.210073}, {"Band_gap_GGA": 0.548871}, {"Band_gap_GGA": 1.957509}, {"Band_gap_GGA": 1.704363}, {"Band_gap_GGA": 1.961019}, {"Band_gap_GGA": 1.243615}, {"Band_gap_GGA": 1.658038}, {"Band_gap_GGA": 0.235177}, {"Band_gap_GGA": 1.140222}, {"Band_gap_GGA": 1.198883}, {"Band_gap_GGA": 0.415049}, {"Band_gap_GGA": 2.287747}, {"Band_gap_GGA": 1.76431}, {"Band_gap_GGA": 1.322154}, {"Band_gap_GGA": 0.925883}, {"Band_gap_GGA": 0.659463}, {"Band_gap_GGA": 1.562408}, {"Band_gap_GGA": 2.572374}, {"Band_gap_GGA": 1.2921459999999998}, {"Band_gap_GGA": 2.566776}, {"Band_gap_GGA": 2.302644}, {"Band_gap_GGA": 1.031397}, {"Band_gap_GGA": 0.154163}, {"Band_gap_GGA": 0.792268}, {"Band_gap_GGA": 1.087767}, {"Band_gap_GGA": 0.538007}, {"Band_gap_GGA": 0.026852}, {"Band_gap_GGA": 0.018415}, {"Band_gap_GGA": 0.230802}, {"Band_gap_GGA": 2.396933}, {"Band_gap_GGA": 1.462945}, {"Band_gap_GGA": 1.460684}, {"Band_gap_GGA": 1.466414}, {"Band_gap_GGA": 2.119317}, {"Band_gap_GGA": 1.215124}, {"Band_gap_GGA": 1.069901}, {"Band_gap_GGA": 1.525048}, {"Band_gap_GGA": 1.1726}, {"Band_gap_GGA": 1.189953}, {"Band_gap_GGA": 1.107226}, {"Band_gap_GGA": 1.484807}, {"Band_gap_GGA": 2.000518}, {"Band_gap_GGA": 1.868281}, {"Band_gap_GGA": 1.664837}, {"Band_gap_GGA": 1.707032}, {"Band_gap_GGA": 1.246136}, {"Band_gap_GGA": 2.181213}, {"Band_gap_GGA": 1.085179}, {"Band_gap_GGA": 1.75657}, {"Band_gap_GGA": 2.29428}, {"Band_gap_GGA": 2.41473}, {"Band_gap_GGA": 1.243414}, {"Band_gap_GGA": 2.69656}, {"Band_gap_GGA": 0.607131}, {"Band_gap_GGA": 2.269988}, {"Band_gap_GGA": 1.629274}, {"Band_gap_GGA": 1.627351}, {"Band_gap_GGA": 2.162857}, {"Band_gap_GGA": 1.749904}, {"Band_gap_GGA": 1.515914}, {"Band_gap_GGA": 1.397799}, {"Band_gap_GGA": 1.39569}, {"Band_gap_GGA": 0.086185}, {"Band_gap_GGA": 1.987881}, {"Band_gap_GGA": 0.059718}, {"Band_gap_GGA": 0.062953}, {"Band_gap_GGA": 2.203174}, {"Band_gap_GGA": 1.3517859999999997}, {"Band_gap_GGA": 1.81496}, {"Band_gap_GGA": 1.454109}, {"Band_gap_GGA": 1.906214}, {"Band_gap_GGA": 0.88018}, {"Band_gap_GGA": 2.217346}, {"Band_gap_GGA": 2.085333}, {"Band_gap_GGA": 1.104804}, {"Band_gap_GGA": 2.181523}, {"Band_gap_GGA": 1.253879}, {"Band_gap_GGA": 2.280524}, {"Band_gap_GGA": 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{"Band_gap_GGA": 2.241743}, {"Band_gap_GGA": 1.777917}, {"Band_gap_GGA": 1.4191330000000002}, {"Band_gap_GGA": 0.731782}, {"Band_gap_GGA": 0.138691}, {"Band_gap_GGA": 2.225815}, {"Band_gap_GGA": 2.199665}, {"Band_gap_GGA": 1.911492}, {"Band_gap_GGA": 2.283275}, {"Band_gap_GGA": 1.287787}, {"Band_gap_GGA": 2.687143}, {"Band_gap_GGA": 1.478651}, {"Band_gap_GGA": 2.367392}, {"Band_gap_GGA": 0.8474620000000002}, {"Band_gap_GGA": 1.7024890000000004}, {"Band_gap_GGA": 1.190505}, {"Band_gap_GGA": 0.835267}, {"Band_gap_GGA": 0.822738}, {"Band_gap_GGA": 2.099675}, {"Band_gap_GGA": 2.72954}, {"Band_gap_GGA": 2.329118}, {"Band_gap_GGA": 2.160642}, {"Band_gap_GGA": 2.587978}, {"Band_gap_GGA": 1.749638}, {"Band_gap_GGA": 2.428862}, {"Band_gap_GGA": 2.237705}, {"Band_gap_GGA": 1.659453}, {"Band_gap_GGA": 1.477986}, {"Band_gap_GGA": 0.208789}, {"Band_gap_GGA": 1.941212}, {"Band_gap_GGA": 1.812366}, {"Band_gap_GGA": 1.990662}, {"Band_gap_GGA": 1.871972}, {"Band_gap_GGA": 1.610609}, {"Band_gap_GGA": 0.174592}, {"Band_gap_GGA": 2.351361}, {"Band_gap_GGA": 1.645783}, {"Band_gap_GGA": 1.129361}, {"Band_gap_GGA": 2.104882}, {"Band_gap_GGA": 2.09107}, {"Band_gap_GGA": 1.654697}, {"Band_gap_GGA": 1.65824}, {"Band_gap_GGA": 1.667675}, {"Band_gap_GGA": 1.614546}, {"Band_gap_GGA": 0.927177}, {"Band_gap_GGA": 0.952176}, {"Band_gap_GGA": 2.9602340000000003}, {"Band_gap_GGA": 2.96739}, {"Band_gap_GGA": 0.748636}, {"Band_gap_GGA": 0.975196}, {"Band_gap_GGA": 2.390607}, {"Band_gap_GGA": 1.973509}, {"Band_gap_GGA": 1.267896}, {"Band_gap_GGA": 2.443814}, {"Band_gap_GGA": 2.635571}, {"Band_gap_GGA": 1.596943}, {"Band_gap_GGA": 3.666981}, {"Band_gap_GGA": 3.79334}, {"Band_gap_GGA": 3.790287}, {"Band_gap_GGA": 1.211805}, {"Band_gap_GGA": 1.876854}, {"Band_gap_GGA": 1.490522}, {"Band_gap_GGA": 2.209694}, {"Band_gap_GGA": 1.925467}, {"Band_gap_GGA": 1.986507}, {"Band_gap_GGA": 3.068424}, {"Band_gap_GGA": 3.068607}, {"Band_gap_GGA": 1.330583}, {"Band_gap_GGA": 0.894779}, {"Band_gap_GGA": 2.029982}, {"Band_gap_GGA": 2.500153}, {"Band_gap_GGA": 2.276321}, {"Band_gap_GGA": 1.62318}, {"Band_gap_GGA": 1.733938}, {"Band_gap_GGA": 3.833246}, {"Band_gap_GGA": 2.347727}, {"Band_gap_GGA": 2.617065}, {"Band_gap_GGA": 2.642137}, {"Band_gap_GGA": 2.599148}, {"Band_gap_GGA": 2.535212}, {"Band_gap_GGA": 2.676799}, {"Band_gap_GGA": 1.520556}, {"Band_gap_GGA": 1.032317}, {"Band_gap_GGA": 1.894462}, {"Band_gap_GGA": 2.250861}, {"Band_gap_GGA": 2.102199}, {"Band_gap_GGA": 2.763222}, {"Band_gap_GGA": 2.960813}, {"Band_gap_GGA": 1.55756}, {"Band_gap_GGA": 1.382571}, {"Band_gap_GGA": 0.606807}, {"Band_gap_GGA": 2.0509479999999995}, {"Band_gap_GGA": 2.027044}, {"Band_gap_GGA": 0.823484}, {"Band_gap_GGA": 2.209528}, {"Band_gap_GGA": 2.565877}, {"Band_gap_GGA": 2.316807}, {"Band_gap_GGA": 2.677563}, {"Band_gap_GGA": 0.727435}, {"Band_gap_GGA": 2.7272220000000003}, {"Band_gap_GGA": 1.842911}, {"Band_gap_GGA": 3.906569}, {"Band_gap_GGA": 1.439385}, {"Band_gap_GGA": 1.03154}, {"Band_gap_GGA": 2.762808}, {"Band_gap_GGA": 3.651526}, {"Band_gap_GGA": 3.799864}, {"Band_gap_GGA": 0.827258}, {"Band_gap_GGA": 0.689105}, {"Band_gap_GGA": 0.394198}, {"Band_gap_GGA": 1.463383}, {"Band_gap_GGA": 1.185585}, {"Band_gap_GGA": 0.853574}, {"Band_gap_GGA": 0.979447}, {"Band_gap_GGA": 2.070407}, {"Band_gap_GGA": 2.493529}, {"Band_gap_GGA": 2.486355}, {"Band_gap_GGA": 1.370191}, {"Band_gap_GGA": 2.064247}, {"Band_gap_GGA": 1.466453}, {"Band_gap_GGA": 3.654543}, {"Band_gap_GGA": 3.91308}, {"Band_gap_GGA": 2.744065}, {"Band_gap_GGA": 1.201798}, {"Band_gap_GGA": 4.101592}, {"Band_gap_GGA": 2.144045}, {"Band_gap_GGA": 1.436723}, {"Band_gap_GGA": 0.044612}, {"Band_gap_GGA": 2.212292}, {"Band_gap_GGA": 1.263702}, {"Band_gap_GGA": 1.024733}, {"Band_gap_GGA": 1.68655}, {"Band_gap_GGA": 1.855932}, {"Band_gap_GGA": 1.8878}, {"Band_gap_GGA": 1.207162}, {"Band_gap_GGA": 0.3737000000000003}, {"Band_gap_GGA": 1.859685}, {"Band_gap_GGA": 1.429847}, {"Band_gap_GGA": 0.645766}, {"Band_gap_GGA": 1.103556}, {"Band_gap_GGA": 1.074611}, {"Band_gap_GGA": 2.42974}, {"Band_gap_GGA": 2.40879}, {"Band_gap_GGA": 2.237308}, {"Band_gap_GGA": 1.875662}, {"Band_gap_GGA": 3.422204}, {"Band_gap_GGA": 3.144173}, {"Band_gap_GGA": 1.754102}, {"Band_gap_GGA": 3.66689}, {"Band_gap_GGA": 1.409758}, {"Band_gap_GGA": 2.974661}, {"Band_gap_GGA": 1.621974}, {"Band_gap_GGA": 1.618741}, {"Band_gap_GGA": 0.444592}, {"Band_gap_GGA": 2.010366}, {"Band_gap_GGA": 0.924272}, {"Band_gap_GGA": 2.990818}, {"Band_gap_GGA": 1.215515}, {"Band_gap_GGA": 2.125477}, {"Band_gap_GGA": 2.269805}, {"Band_gap_GGA": 0.811707}, {"Band_gap_GGA": 1.744571}, {"Band_gap_GGA": 2.090222}, {"Band_gap_GGA": 2.189527}, {"Band_gap_GGA": 1.235843}, {"Band_gap_GGA": 1.220787}, {"Band_gap_GGA": 2.701244}, {"Band_gap_GGA": 2.727472}, {"Band_gap_GGA": 2.151341}, {"Band_gap_GGA": 1.562761}, {"Band_gap_GGA": 1.992365}, {"Band_gap_GGA": 1.825093}, {"Band_gap_GGA": 1.87319}, {"Band_gap_GGA": 2.544654}, {"Band_gap_GGA": 1.2418799999999997}, {"Band_gap_GGA": 0.892895}, {"Band_gap_GGA": 2.578329}, {"Band_gap_GGA": 2.570836}, {"Band_gap_GGA": 1.865955}, {"Band_gap_GGA": 1.67306}, {"Band_gap_GGA": 1.20408}, {"Band_gap_GGA": 1.859734}, {"Band_gap_GGA": 2.507368}, {"Band_gap_GGA": 2.004025}, {"Band_gap_GGA": 1.784577}, {"Band_gap_GGA": 2.016476}, {"Band_gap_GGA": 2.521763}, {"Band_gap_GGA": 2.461123}, {"Band_gap_GGA": 2.564278}, {"Band_gap_GGA": 2.196636}, {"Band_gap_GGA": 1.436867}, {"Band_gap_GGA": 1.305043}, {"Band_gap_GGA": 1.601978}, {"Band_gap_GGA": 1.66379}, {"Band_gap_GGA": 1.824328}, {"Band_gap_GGA": 1.68645}, {"Band_gap_GGA": 2.577125}, {"Band_gap_GGA": 2.628116}, {"Band_gap_GGA": 2.063832}, {"Band_gap_GGA": 0.477598}, {"Band_gap_GGA": 2.395911}, {"Band_gap_GGA": 2.542545}, {"Band_gap_GGA": 1.70482}, {"Band_gap_GGA": 1.666039}, {"Band_gap_GGA": 1.381963}, {"Band_gap_GGA": 1.27965}, {"Band_gap_GGA": 0.380005}, {"Band_gap_GGA": 0.957195}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "Calculate the average reaction temperature for noble metal none, synthesis time 12.0 hours, and additional components containing none.", "refer_dataset": "table7", "column names": ["Noble_Metal", "Synthesis_Time", "Additional", "Rxn_Temp"], "condition_column": {"Noble_Metal": "=", "Synthesis_Time": "=", "Additional": "="}, "answer_column": {"Rxn_Temp": "avg"}, "condition": {"Noble_Metal": "=='none'", "Synthesis_Time": "=='12.0'", "Additional": "=='none'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average reaction temperature for noble metal {}, synthesis time {} hours, and additional components containing {}."}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 2.42 eV, light source Visible, and Reaction medium gas-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<2.42", "light source": "=='Visible'", "Reaction medium": "=='gas-solid'"}, "tool": "calculate_data", "answer": 6.14, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "How many times has research from Jilin Univ institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='Jilin Univ'"}, "tool": "calculate_data", "answer": 1262, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "Calculate the average atomic number of elements in surface -211.0 where carbon species is 3.0 and reaction energy exceeds 1.41.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-211.0'", "b_key": "=='3.0'", "reaction_energy": ">1.41"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "Calculate the average SBET (m²/g) for entries with Bandgap less than 1.93 eV and irradiation time over 4.0 hours.", "refer_dataset": "table10", "column names": ["Eg(eV)", "irradiation time(h)", "SBET (m2 /g)"], "condition_column": {"Eg(eV)": "<", "irradiation time(h)": ">"}, "answer_column": {"SBET (m2 /g)": "avg"}, "condition": {"Eg(eV)": "<1.93", "irradiation time(h)": ">4.0"}, "tool": "calculate_data", "answer": 73.17333333333333, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average SBET (m²/g) for entries with Bandgap less than {} eV and irradiation time over {} hours."}
{"question": "Calculate the average A_AtomN for materials where Element B is H, Cn exceeds 1, and Formation Energy is below 2.6?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='H'", "Cn": ">1", "Formation_E": "<2.6"}, "tool": "calculate_data", "answer": 8.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "What is the minimum pH recorded for Degradation Rate > 78.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">78.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 4.40592946546656?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">4.40592946546656"}, "tool": "calculate_data", "answer": -3.11776107290804, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "What is the total formula_energy for materials where ID contains the substring 1197?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "sum"}, "condition": {"id": "=='1197'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total formula_energy for materials where ID contains the substring {}?"}
{"question": "What is the average Onset potential for alloys where Platinum percentage exceeds 18.9%?", "refer_dataset": "table15", "column names": ["Pt", "Onset"], "condition_column": {"Pt": ">"}, "answer_column": {"Onset": "avg"}, "condition": {"Pt": ">18.9"}, "tool": "calculate_data", "answer": 0.5090747420634915, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Onset potential for alloys where Platinum percentage exceeds {}%?"}
{"question": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > 0.5201560000000001?", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": ">"}, "answer_column": {"Band_gap_GGA": "min"}, "condition": {"Band_gap_HSE_optical": ">0.5201560000000001"}, "tool": "calculate_data", "answer": 9.123469, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > {}?"}
{"question": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below -7.298093795776367 and heat capacity (Cv) exceeds 9.175999641418455?", "refer_dataset": "table60", "column names": ["homo", "Cv", "zpve"], "condition_column": {"homo": "<", "Cv": ">"}, "answer_column": {"zpve": "avg"}, "condition": {"homo": "<-7.298093795776367", "Cv": ">9.175999641418455"}, "tool": "calculate_data", "answer": 2.6180758856370776, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below {} and heat capacity (Cv) exceeds {}?"}
{"question": "Determine the minimum Calcination Temperature required for 43.0% Degradation Rate when pH is 7.0 and Catalyst/Pollutant mass ratio is 100.0.", "refer_dataset": "table8", "column names": ["Calcination temperature(°C)", "Degradation rate(%)", "pH", "Catalyst/Pollutant mass ratio"], "condition_column": {"Degradation rate(%)": "=", "pH": "=", "Catalyst/Pollutant mass ratio": "="}, "answer_column": {"Calcination temperature(°C)": "min"}, "condition": {"Degradation rate(%)": "=='43.0'", "pH": "=='7.0'", "Catalyst/Pollutant mass ratio": "=='100.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Calcination Temperature required for {}% Degradation Rate when pH is {} and Catalyst/Pollutant mass ratio is {}."}
{"question": "What is the average Temperature when CH4-conversion% exceeds 10.0%?", "refer_dataset": "table20", "column names": ["Temperature", "CH4-conversion%"], "condition_column": {"CH4-conversion%": ">"}, "answer_column": {"Temperature": "avg"}, "condition": {"CH4-conversion%": ">10.0"}, "tool": "calculate_data", "answer": 1031.7932519741564, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Temperature when CH4-conversion% exceeds {}%?"}
{"question": "Calculate the average Alcohol% when Light Type is Xe?", "refer_dataset": "table4", "column names": ["Light Type", "Alcohol%"], "condition_column": {"Light Type": "="}, "answer_column": {"Alcohol%": "avg"}, "condition": {"Light Type": "=='Xe'"}, "tool": "calculate_data", "answer": 11.803398058252426, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Alcohol% when Light Type is {}?"}
{"question": "What is the average pH for catalysts where Year is 2017.0?", "refer_dataset": "table12", "column names": ["Year", "pH"], "condition_column": {"Year": "="}, "answer_column": {"pH": "avg"}, "condition": {"Year": "=='2017.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average pH for catalysts where Year is {}?"}
{"question": "What is the minimum e_hull value for materials with bulk modulus exceeding 187.8441005752244?", "refer_dataset": "table56", "column names": ["e_hull", "bulk modulus"], "condition_column": {"bulk modulus": ">"}, "answer_column": {"e_hull": "min"}, "condition": {"bulk modulus": ">187.8441005752244"}, "tool": "calculate_data", "answer": 1.2981273874999992, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum e_hull value for materials with bulk modulus exceeding {}?"}
{"question": "What is the minimum SBET (m²/g) required for Bi type BiOCl, light source Visible, and Yield > 0.5825 μmol/g/h?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "light source", "Yield (μmol/g/h)", "SBET (m2 /g)"], "condition_column": {"Bi type in photocatalyst": "=", "light source": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"SBET (m2 /g)": "min"}, "condition": {"Bi type in photocatalyst": "=='BiOCl'", "light source": "=='Visible'", "Yield (μmol/g/h)": ">0.5825"}, "tool": "calculate_data", "answer": 97.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum SBET (m²/g) required for Bi type {}, light source {}, and Yield > {} μmol/g/h?"}
{"question": "Find the minimum synthesis temperature for experiments with Zn2GeO4 nanorods photocatalyst(s), reaction time under 9.0 hours, and CH3OH as the major product.", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Rxn_Time", "MAJORgas", "Synhesis_Temp"], "condition_column": {"Photocatalyst(s)": "=", "Rxn_Time": "<", "MAJORgas": "="}, "answer_column": {"Synhesis_Temp": "min"}, "condition": {"Photocatalyst(s)": "=='Zn2GeO4 nanorods'", "Rxn_Time": "<9.0", "MAJORgas": "=='CH3OH'"}, "tool": "calculate_data", "answer": 180.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum synthesis temperature for experiments with {} photocatalyst(s), reaction time under {} hours, and {} as the major product."}
{"question": "For materials in space group symbol R-3m, what is the minimum stress tensor value observed?", "refer_dataset": "table59", "column names": ["spacegroup_symbol", "stress"], "condition_column": {"spacegroup_symbol": "="}, "answer_column": {"stress": "min"}, "condition": {"spacegroup_symbol": "=='R-3m'"}, "tool": "calculate_data", "answer": "[[7.745588181263362e-05, 7.0108573697882e-16, 8.092992223329641e-11], [7.0108573697882e-16, 7.745588181544161e-05, 4.672502259376219e-11], [8.092992223572676e-11, 4.6725022598622866e-11, -0.002417202375411695]]", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials in space group symbol {}, what is the minimum stress tensor value observed?"}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 19.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">19.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.7, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "Calculate the maximum formation energy per atom for materials with space group number 64.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "max"}, "condition": {"spacegroup_number": "=='64'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum formation energy per atom for materials with space group number {}."}
{"question": "Determine the average temperature (°C) required to achieve C2 yield (%) over 2.297724502% with M2 as Mo and PAr below 0.4 atm.", "refer_dataset": "table21", "column names": ["C2 yield (%)", "M2", "PAr (atm)", "Temp. (°C)"], "condition_column": {"C2 yield (%)": ">", "M2": "=", "PAr (atm)": "<"}, "answer_column": {"Temp. (°C)": "avg"}, "condition": {"C2 yield (%)": ">2.297724502", "M2": "=='Mo'", "PAr (atm)": "<0.4"}, "tool": "calculate_data", "answer": 805.921052631579, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average temperature (°C) required to achieve C2 yield (%) over {}% with M2 as {} and PAr below {} atm."}
{"question": "What is the average Power(W) for materials where BandGap(eV) is less than 2.45?", "refer_dataset": "table4", "column names": ["BandGap(eV)", "Power(W)"], "condition_column": {"BandGap(eV)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"BandGap(eV)": "<2.45"}, "tool": "calculate_data", "answer": 319.6333333333333, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where BandGap(eV) is less than {}?"}
{"question": "Determine the average ethane yield (C2H6y) for M1 = Mn, Support_ID = 11, and M3_mol > 0.185.", "refer_dataset": "table17", "column names": ["M1", "Support_ID", "M3_mol", "C2H6y"], "condition_column": {"M1": "=", "Support_ID": "=", "M3_mol": ">"}, "answer_column": {"C2H6y": "avg"}, "condition": {"M1": "=='Mn'", "Support_ID": "=='11'", "M3_mol": ">0.185"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average ethane yield (C2H6y) for M1 = {}, Support_ID = {}, and M3_mol > {}."}
{"question": "How many organic compounds (OC) have pH values equal to 9.0?", "refer_dataset": "table9", "column names": ["OC", "pH"], "condition_column": {"pH": "="}, "answer_column": {"OC": "count"}, "condition": {"pH": "=='9.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many organic compounds (OC) have pH values equal to {}?"}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) CC(=O)N?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='CC(=O)N'"}, "tool": "calculate_data", "answer": -3.28657561465647, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the average Temperature for Preprations using Support2 14?", "refer_dataset": "table20", "column names": ["Temperature", "Support2"], "condition_column": {"Support2": "="}, "answer_column": {"Temperature": "avg"}, "condition": {"Support2": "=='14'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Temperature for Preprations using Support2 {}?"}
{"question": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds 10.0 hours.", "refer_dataset": "table10", "column names": ["irradiation time(h)", "CB edge(V)"], "condition_column": {"irradiation time(h)": ">"}, "answer_column": {"CB edge(V)": "min"}, "condition": {"irradiation time(h)": ">10.0"}, "tool": "calculate_data", "answer": "− 0.56", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds {} hours."}
{"question": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals -3e-07?", "refer_dataset": "table67", "column names": ["exfoliation_energy_per_atom", "total_magnetization"], "condition_column": {"total_magnetization": "="}, "answer_column": {"exfoliation_energy_per_atom": "max"}, "condition": {"total_magnetization": "=='-3e-07'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals {}?"}
{"question": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above 5.872203069733896.", "refer_dataset": "table66", "column names": ["avg_max", "surf_cbm"], "condition_column": {"avg_max": ">"}, "answer_column": {"surf_cbm": "min"}, "condition": {"avg_max": ">5.872203069733896"}, "tool": "calculate_data", "answer": 4.9916, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above {}."}
{"question": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > 0.0, Mg < 0.0, and La = 0.1?", "refer_dataset": "table16", "column names": ["Ca", "Mg", "La", "J.uAcm2_0.80_fromCV"], "condition_column": {"Ca": ">", "Mg": "<", "La": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "max"}, "condition": {"Ca": ">0.0", "Mg": "<0.0", "La": "=='0.1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > {}, Mg < {}, and La = {}?"}
{"question": "List organic compounds (OC) with light intensity (I) greater than 1.74 mW/cm².", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2"], "condition_column": {"I, mW/cm2": ">"}, "answer_column": {"OC": ""}, "condition": {"I, mW/cm2": ">1.74"}, "tool": "calculate_data", "answer": [{"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Acetaminophen"}, {"OC": "beta-blocker atenolol"}, {"OC": "Sulfanilamide"}, {"OC": "Sulfacetamide natrium salt"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfadiazine natrium salt"}, {"OC": "Sulfathiazole natrium salt"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iopromide"}, {"OC": "Atrazine"}, {"OC": "Cyanazine"}, {"OC": "Irgarol"}, {"OC": "Prometryne"}, {"OC": "Propazine"}, {"OC": "Dichlofenthion"}, {"OC": "Bromophos ethyl"}, {"OC": "Bromophos methyl"}, {"OC": "Parathion ethyl"}, {"OC": "Parathion methyl"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List organic compounds (OC) with light intensity (I) greater than {} mW/cm²."}
{"question": "What is the average Degradation efficiency (%) when Surface area (m2/g) > 15.95, Pore Volume (cm3/g) < 0.11, and pH is 5.0?", "refer_dataset": "table6", "column names": ["Surface area (m2/g)", "Pore Volume (cm3/g)", "pH", "Degradation efficiency (%)"], "condition_column": {"Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<", "pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Surface area (m2/g)": ">15.95", "Pore Volume (cm3/g)": "<0.11", "pH": "=='5.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when Surface area (m2/g) > {}, Pore Volume (cm3/g) < {}, and pH is {}?"}
{"question": "How many Preparations have Contact-times shorter than 18.2 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<18.2"}, "tool": "calculate_data", "answer": 1833, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "How many Preparations have Contact-times shorter than 3.9 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<3.9"}, "tool": "calculate_data", "answer": 1703, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "Materials with bandgap of 0.3806000000000002, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='0.3806000000000002'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "Find the average Degradation efficiency (%) for Material MIL-101 when Catalyst dosage (g/L) > 0.05, Illumination time (min) > 0, and pH < 4.1.", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Illumination time (min)", "pH", "Degradation efficiency (%)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Illumination time (min)": ">", "pH": "<"}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.05", "Illumination time (min)": ">0", "pH": "<4.1"}, "tool": "calculate_data", "answer": 18.5, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Degradation efficiency (%) for Material {} when Catalyst dosage (g/L) > {}, Illumination time (min) > {}, and pH < {}."}
{"question": "What is the median Onset potential for alloys with Ru > 45.7%, Rh > 9.4%, and Pd < 15.2%?", "refer_dataset": "table15", "column names": ["Ru", "Rh", "Pd", "Onset"], "condition_column": {"Ru": ">", "Rh": ">", "Pd": "<"}, "answer_column": {"Onset": "median"}, "condition": {"Ru": ">45.7", "Rh": ">9.4", "Pd": "<15.2"}, "tool": "calculate_data", "answer": [{"Onset": 0.467687}, {"Onset": 0.467687}, {"Onset": 0.467687}, {"Onset": 0.462739}, {"Onset": 0.462739}, {"Onset": 0.462739}, {"Onset": 0.478968}, {"Onset": 0.478968}, {"Onset": 0.478968}, {"Onset": 0.455995}, {"Onset": 0.483696}, {"Onset": 0.475009}, {"Onset": 0.476989}, {"Onset": 0.476989}, {"Onset": 0.468678}, {"Onset": 0.485668}, {"Onset": 0.483707}, {"Onset": 0.483707}, {"Onset": 0.470989}, {"Onset": 0.470989}, {"Onset": 0.463977}, {"Onset": 0.477743}, {"Onset": 0.477743}, {"Onset": 0.477743}, {"Onset": 0.467683}, {"Onset": 0.469674}, {"Onset": 0.482975}, {"Onset": 0.482975}, {"Onset": 0.482975}, {"Onset": 0.469674}, {"Onset": 0.469674}, {"Onset": 0.463995}, {"Onset": 0.457991}, {"Onset": 0.463995}, {"Onset": 0.476732}, {"Onset": 0.476732}, {"Onset": 0.476732}, {"Onset": 0.47872}, {"Onset": 0.47872}, {"Onset": 0.47872}, {"Onset": 0.461025}, {"Onset": 0.483699}, {"Onset": 0.483699}, {"Onset": 0.483699}, {"Onset": 0.458051}, {"Onset": 0.463995}, {"Onset": 0.463995}, {"Onset": 0.481733}, {"Onset": 0.481733}, {"Onset": 0.469696}, {"Onset": 0.469696}, {"Onset": 0.469696}, {"Onset": 0.457991}, {"Onset": 0.457991}, {"Onset": 0.457991}, {"Onset": 0.479745}, {"Onset": 0.476687}, {"Onset": 0.479745}, {"Onset": 0.475009}, {"Onset": 0.475009}, {"Onset": 0.475009}, {"Onset": 0.490682}, {"Onset": 0.47975}, {"Onset": 0.471977}, {"Onset": 0.470989}, {"Onset": 0.470989}, {"Onset": 0.471977}, {"Onset": 0.471977}, {"Onset": 0.471977}, {"Onset": 0.482951}, {"Onset": 0.482951}, {"Onset": 0.482951}, {"Onset": 0.47099}, {"Onset": 0.47099}, {"Onset": 0.47099}, {"Onset": 0.477731}, {"Onset": 0.479745}, {"Onset": 0.469937}, {"Onset": 0.469937}, {"Onset": 0.469937}, {"Onset": 0.471714}, {"Onset": 0.466662}, {"Onset": 0.466662}, {"Onset": 0.472722}, {"Onset": 0.472722}, {"Onset": 0.472722}, {"Onset": 0.475961}, {"Onset": 0.469937}, {"Onset": 0.475961}, {"Onset": 0.472722}, {"Onset": 0.472739}, {"Onset": 0.472739}, {"Onset": 0.482975}, {"Onset": 0.476989}, {"Onset": 0.476989}, {"Onset": 0.483707}, {"Onset": 0.483707}, {"Onset": 0.483699}, {"Onset": 0.471992}, {"Onset": 0.478968}, {"Onset": 0.471992}, {"Onset": 0.482951}, {"Onset": 0.471992}, {"Onset": 0.471992}, {"Onset": 0.467687}, {"Onset": 0.466686}, {"Onset": 0.466686}, {"Onset": 0.46475}, {"Onset": 0.46475}, {"Onset": 0.46475}, {"Onset": 0.466686}, {"Onset": 0.466686}, {"Onset": 0.46475}, {"Onset": 0.47099}, {"Onset": 0.475961}, {"Onset": 0.475961}, {"Onset": 0.47872}, {"Onset": 0.477724}, {"Onset": 0.477724}, {"Onset": 0.472723}, {"Onset": 0.472723}, {"Onset": 0.472723}, {"Onset": 0.467683}, {"Onset": 0.467683}, {"Onset": 0.469696}, {"Onset": 0.466662}, {"Onset": 0.466662}, {"Onset": 0.477724}, {"Onset": 0.477743}, {"Onset": 0.477724}, {"Onset": 0.485668}, {"Onset": 0.485668}, {"Onset": 0.485668}, {"Onset": 0.476687}, {"Onset": 0.476687}, {"Onset": 0.472739}, {"Onset": 0.472723}, {"Onset": 0.472739}, {"Onset": 0.471714}, {"Onset": 0.471714}, {"Onset": 0.471714}, {"Onset": 0.485664}, {"Onset": 0.460036}, {"Onset": 0.463977}, {"Onset": 0.463977}, {"Onset": 0.463977}, {"Onset": 0.481733}, {"Onset": 0.482747}, {"Onset": 0.482747}, {"Onset": 0.482747}, {"Onset": 0.458051}, {"Onset": 0.458051}, {"Onset": 0.458051}, {"Onset": 0.480766}, {"Onset": 0.477731}, {"Onset": 0.477731}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Onset potential for alloys with Ru > {}%, Rh > {}%, and Pd < {}%?"}
{"question": "What is the median Formation Energy when An (count of A) equals 2 and Element B is He?", "refer_dataset": "table22", "column names": ["An", "B", "Formation_E"], "condition_column": {"An": "=", "B": "="}, "answer_column": {"Formation_E": "median"}, "condition": {"An": "=='2'", "B": "=='He'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Formation Energy when An (count of A) equals {} and Element B is {}?"}
{"question": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below 1879.0 K.", "refer_dataset": "table3", "column names": ["A_Tb", "Rb"], "condition_column": {"A_Tb": "<"}, "answer_column": {"Rb": "median"}, "condition": {"A_Tb": "<1879.0"}, "tool": "calculate_data", "answer": [{"Rb": 67.0}, {"Rb": 65.8}, {"Rb": 64.6}, {"Rb": 63.4}, {"Rb": 62.2}, {"Rb": 61.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 66.74}, {"Rb": 66.61}, {"Rb": 66.48}, {"Rb": 66.45}, {"Rb": 72.0}, {"Rb": 72.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 66.86}, {"Rb": 66.45}, {"Rb": 74.17}, {"Rb": 74.17}, {"Rb": 74.48}, {"Rb": 73.24}, {"Rb": 73.86}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 75.1}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 72.0}, {"Rb": 66.87}, {"Rb": 72.62}, {"Rb": 66.73}, {"Rb": 74.17}, {"Rb": 67.0}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below {} K."}
{"question": "Calculate the average chem_pot for symbol Rb?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Rb'"}, "tool": "calculate_data", "answer": 1.243, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -1.27419580696129 and the HOMO-LUMO gap (gap) is less than 2.55032827947553?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-1.27419580696129", "gap": "<2.55032827947553"}, "tool": "calculate_data", "answer": 2.05689453649337, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "Find the maximum Surface area (m2/g) for Material PI-UiO-66-NH2.", "refer_dataset": "table6", "column names": ["Material", "Surface area (m2/g)"], "condition_column": {"Material": "="}, "answer_column": {"Surface area (m2/g)": "max"}, "condition": {"Material": "=='PI-UiO-66-NH2'"}, "tool": "calculate_data", "answer": 922.75, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Surface area (m2/g) for Material {}."}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 300 minutes, pH > 7.0, and Dopant Fe?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<300", "pH": ">7.0", "Dopant": "=='Fe'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "What is the average energy per atom for compounds in the formula MgF2 with an indirect gap below 5.868?", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "energy_per_atom"], "condition_column": {"formula": "=", "indir_gap": "<"}, "answer_column": {"energy_per_atom": "avg"}, "condition": {"formula": "=='MgF2'", "indir_gap": "<5.868"}, "tool": "calculate_data", "answer": -1007.3223230769235, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average energy per atom for compounds in the formula {} with an indirect gap below {}?"}
{"question": "What is the average band_gap for materials with nelements equal to 7?", "refer_dataset": "table55", "column names": ["band_gap", "nelements"], "condition_column": {"nelements": "="}, "answer_column": {"band_gap": "avg"}, "condition": {"nelements": "=='7'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average band_gap for materials with nelements equal to {}?"}
{"question": "Identify materials where the ionization energy of element B (I1b) exceeds 7.862 eV, the atomic radius of element B (Rb) is below 55.45 Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than 49.12 kJ/mol. What is their average hydrogen production rate (RH2)?", "refer_dataset": "table3", "column names": ["I1b", "Rb", "ΔfusHa", "RH2(µmol h-1 g-1)"], "condition_column": {"I1b": ">", "Rb": "<", "ΔfusHa": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "avg"}, "condition": {"I1b": ">7.862", "Rb": "<55.45", "ΔfusHa": ">49.12"}, "tool": "calculate_data", "answer": 9.55, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where the ionization energy of element B (I1b) exceeds {} eV, the atomic radius of element B (Rb) is below {} Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than {} kJ/mol. What is their average hydrogen production rate (RH2)?"}
{"question": "What is the average Power(W) for materials where BandGap(eV) is less than 4.27?", "refer_dataset": "table4", "column names": ["BandGap(eV)", "Power(W)"], "condition_column": {"BandGap(eV)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"BandGap(eV)": "<4.27"}, "tool": "calculate_data", "answer": 334.93023255813955, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where BandGap(eV) is less than {}?"}
{"question": "What is the average journal impact factor for research institutions located in Peoples R China?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='Peoples R China'"}, "tool": "calculate_data", "answer": 10.379960775861925, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "Calculate the average A_AtomN for materials where Element B is H, Cn exceeds 1, and Formation Energy is below 0.52?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='H'", "Cn": ">1", "Formation_E": "<0.52"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "What is the average argon partial pressure (atm) when reaction temperature is above 900°C?", "refer_dataset": "table21", "column names": ["Temp. (°C)", "PAr (atm)"], "condition_column": {"Temp. (°C)": ">"}, "answer_column": {"PAr (atm)": "avg"}, "condition": {"Temp. (°C)": ">900"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average argon partial pressure (atm) when reaction temperature is above {}°C?"}
{"question": "How many unique surfaces are recorded for the element Mo?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='Mo'"}, "tool": "calculate_data", "answer": 14, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MO under Experimental Temperature 25°C and Light Wavelength 580 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MO'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='580'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "What is the average Light Wavelength used for Calcination Temperatures above 750°C when Pollutant is MO?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Calcination temperature(°C)", "Pollutant"], "condition_column": {"Calcination temperature(°C)": ">", "Pollutant": "="}, "answer_column": {"Light wavelength(nm)": "avg"}, "condition": {"Calcination temperature(°C)": ">750", "Pollutant": "=='MO'"}, "tool": "calculate_data", "answer": 475.55555555555554, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Light Wavelength used for Calcination Temperatures above {}°C when Pollutant is {}?"}
{"question": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below 1382.0 K.", "refer_dataset": "table3", "column names": ["A_Tb", "Rb"], "condition_column": {"A_Tb": "<"}, "answer_column": {"Rb": "median"}, "condition": {"A_Tb": "<1382.0"}, "tool": "calculate_data", "answer": [{"Rb": 67.0}, {"Rb": 72.0}, {"Rb": 72.0}, {"Rb": 74.17}, {"Rb": 74.17}, {"Rb": 74.48}, {"Rb": 73.24}, {"Rb": 73.86}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 75.1}, {"Rb": 72.62}, {"Rb": 74.17}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below {} K."}
{"question": "What is the average methane conversion rate when Cation1 is Sr?", "refer_dataset": "table19", "column names": ["Cation1", "Temp CH4 conv"], "condition_column": {"Cation1": "="}, "answer_column": {"Temp CH4 conv": "avg"}, "condition": {"Cation1": "=='Sr'"}, "tool": "calculate_data", "answer": 750.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average methane conversion rate when Cation1 is {}?"}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) N?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='N'"}, "tool": "calculate_data", "answer": -4.1474743680007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "Find the minimum activation energy for adsorbed species CH* on surfaces with key 5 and elements of atomic number 79.", "refer_dataset": "table18", "column names": ["ab", "surfaces_key", "A_AtimicN", "activation_energy"], "condition_column": {"ab": "=", "surfaces_key": "=", "A_AtimicN": "="}, "answer_column": {"activation_energy": "min"}, "condition": {"ab": "=='CH*'", "surfaces_key": "=='5'", "A_AtimicN": "=='79'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum activation energy for adsorbed species {} on surfaces with key {} and elements of atomic number {}."}
{"question": "What is the maximum pH observed where Degradation efficiency (%) is greater than 8.0?", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "pH"], "condition_column": {"pH": ">"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"pH": ">8.0"}, "tool": "calculate_data", "answer": 99.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH observed where Degradation efficiency (%) is greater than {}?"}
{"question": "Materials with bandgap of 0.8628000000000002, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='0.8628000000000002'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "Calculate the average formula_energy for all materials with ID starting with 1917?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "avg"}, "condition": {"id": "=='1917'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average formula_energy for all materials with ID starting with {}?"}
{"question": "What is the maximum pH recorded for Pollutant Phenol under Light Wavelength 525 nm?", "refer_dataset": "table8", "column names": ["Pollutant", "Light wavelength(nm)", "pH"], "condition_column": {"Pollutant": "=", "Light wavelength(nm)": "<"}, "answer_column": {"pH": "max"}, "condition": {"Pollutant": "=='Phenol'", "Light wavelength(nm)": "<525"}, "tool": "calculate_data", "answer": 8.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH recorded for Pollutant {} under Light Wavelength {} nm?"}
{"question": "What is the highest light intensity used with the co-catalyst 'Pt(1 wt％)'?", "refer_dataset": "table1", "column names": ["Co-catalyst", "Light intensity(W)"], "condition_column": {"Co-catalyst": "="}, "answer_column": {"Light intensity(W)": "max"}, "condition": {"Co-catalyst": "=='Pt(1 wt％)'"}, "tool": "calculate_data", "answer": "Xe lamp(300W),320 nm <λ<780 nm", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest light intensity used with the co-catalyst '{}'?"}
{"question": "What is the highest C.E. % for Material Sn when Surface Strain is 0.0?", "refer_dataset": "table12", "column names": ["Material", "Surface Strain", "C.E. %"], "condition_column": {"Material": "=", "Surface Strain": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"Material": "=='Sn'", "Surface Strain": "=='0.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C.E. % for Material {} when Surface Strain is {}?"}
{"question": "What is the average Ruthenium content in alloys where Onset potential is greater than 0.484928V?", "refer_dataset": "table15", "column names": ["Ru", "Onset"], "condition_column": {"Onset": ">"}, "answer_column": {"Ru": "avg"}, "condition": {"Onset": ">0.484928"}, "tool": "calculate_data", "answer": 27.473557692307665, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Ruthenium content in alloys where Onset potential is greater than {}V?"}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.0824087898624003?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.0824087898624003"}, "tool": "calculate_data", "answer": 0.015068869886757569, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx 156.", "refer_dataset": "table63", "column names": ["Space_group_rlx", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "="}, "answer_column": {"Band_gap_GGA": "max"}, "condition": {"Space_group_rlx": "=='156'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx {}."}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 4.68878917065024?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">4.68878917065024"}, "tool": "calculate_data", "answer": -3.6893663418253, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "How many organic compounds (OC) have pH values equal to 3.5?", "refer_dataset": "table9", "column names": ["OC", "pH"], "condition_column": {"pH": "="}, "answer_column": {"OC": "count"}, "condition": {"pH": "=='3.5'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many organic compounds (OC) have pH values equal to {}?"}
{"question": "For materials in space group symbol P4/nmm, what is the minimum stress tensor value observed?", "refer_dataset": "table59", "column names": ["spacegroup_symbol", "stress"], "condition_column": {"spacegroup_symbol": "="}, "answer_column": {"stress": "min"}, "condition": {"spacegroup_symbol": "=='P4/nmm'"}, "tool": "calculate_data", "answer": "[[9.888367390683759e-06, 0.0, 0.0], [0.0, 9.888367390683759e-06, 0.0], [0.0, 0.0, -0.0015325774539158088]]", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials in space group symbol {}, what is the minimum stress tensor value observed?"}
{"question": "What is the average formation energy (ef) for bulk_formula Nd and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Nd'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 1.707545, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "Identify compounds where crystal system is cubic and formation energy per atom is less than 0.1393. What is their average final energy?", "refer_dataset": "table59", "column names": ["crystal_system", "f_enp", "final_energy"], "condition_column": {"crystal_system": "=", "f_enp": "<"}, "answer_column": {"final_energy": "avg"}, "condition": {"crystal_system": "=='cubic'", "f_enp": "<0.1393"}, "tool": "calculate_data", "answer": -119.02142350361228, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify compounds where crystal system is {} and formation energy per atom is less than {}. What is their average final energy?"}
{"question": "What is the maximum CH4 conversion (%) recorded when M1 is Li, temperature exceeds 900°C, and total flow is below 20 mL/min?", "refer_dataset": "table21", "column names": ["M1", "Temp. (°C)", "Total flow(mL/min)", "CH4 conversion (%)"], "condition_column": {"M1": "=", "Temp. (°C)": ">", "Total flow(mL/min)": "<"}, "answer_column": {"CH4 conversion (%)": "max"}, "condition": {"M1": "=='Li'", "Temp. (°C)": ">900", "Total flow(mL/min)": "<20"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum CH4 conversion (%) recorded when M1 is {}, temperature exceeds {}°C, and total flow is below {} mL/min?"}
{"question": "What is the total formula_energy for materials where ID contains the substring 1223?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "sum"}, "condition": {"id": "=='1223'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total formula_energy for materials where ID contains the substring {}?"}
{"question": "How many Preparations have Contact-times shorter than 26.0 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<26.0"}, "tool": "calculate_data", "answer": 1842, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "How many atoms do structures with a final energy greater than -28.7351146292525 typically have?", "refer_dataset": "table59", "column names": ["final_energy", "natoms"], "condition_column": {"final_energy": ">"}, "answer_column": {"natoms": "count"}, "condition": {"final_energy": ">-28.7351146292525"}, "tool": "calculate_data", "answer": 1055, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many atoms do structures with a final energy greater than {} typically have?"}
{"question": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > 0.360797999999999, synthesized as True, and sourced from CSD?", "refer_dataset": "table62", "column names": ["bandgap", "synthesized", "source", "pld"], "condition_column": {"bandgap": ">", "synthesized": "=", "source": "="}, "answer_column": {"pld": "min"}, "condition": {"bandgap": ">0.360797999999999", "synthesized": "=='True'", "source": "=='CSD'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > {}, synthesized as {}, and sourced from {}?"}
{"question": "Calculate the average A_AtomN for materials where Element B is H, Cn exceeds 1, and Formation Energy is below 1.18?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='H'", "Cn": ">1", "Formation_E": "<1.18"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "What is the average reaction energy for elements with atomic number greater than 79?", "refer_dataset": "table18", "column names": ["A_AtimicN", "reaction_energy"], "condition_column": {"A_AtimicN": ">"}, "answer_column": {"reaction_energy": "avg"}, "condition": {"A_AtimicN": ">79"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction energy for elements with atomic number greater than {}?"}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below -154.37363967?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<-154.37363967"}, "tool": "calculate_data", "answer": 21.744707196414268, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "Find the average CH4-conversion% for reactions where Cation1 = 82.0, Contact-times > 8.7, and O2-pressure < 0.041.", "refer_dataset": "table20", "column names": ["Cation1", "Contact-times", "O2-pressure", "CH4-conversion%"], "condition_column": {"Cation1": "=", "Contact-times": ">", "O2-pressure": "<"}, "answer_column": {"CH4-conversion%": "avg"}, "condition": {"Cation1": "=='82.0'", "Contact-times": ">8.7", "O2-pressure": "<0.041"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average CH4-conversion% for reactions where Cation1 = {}, Contact-times > {}, and O2-pressure < {}."}
{"question": "Identify materials where the ionization energy of element B (I1b) exceeds 6.828 eV, the atomic radius of element B (Rb) is below 67.0 Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than 204.79 kJ/mol. What is their average hydrogen production rate (RH2)?", "refer_dataset": "table3", "column names": ["I1b", "Rb", "ΔfusHa", "RH2(µmol h-1 g-1)"], "condition_column": {"I1b": ">", "Rb": "<", "ΔfusHa": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "avg"}, "condition": {"I1b": ">6.828", "Rb": "<67.0", "ΔfusHa": ">204.79"}, "tool": "calculate_data", "answer": 12.325000000000001, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where the ionization energy of element B (I1b) exceeds {} eV, the atomic radius of element B (Rb) is below {} Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than {} kJ/mol. What is their average hydrogen production rate (RH2)?"}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -5.5180114989034.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-5.5180114989034"}, "tool": "calculate_data", "answer": -3.5434530013290457, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "Find the total electronic spatial extent (R²) values where HOMO energy is above -10.549854278564451 and internal energy (U) is below -17.286821365356445?", "refer_dataset": "table60", "column names": ["homo", "U", "r2"], "condition_column": {"homo": ">", "U": "<"}, "answer_column": {"r2": "sum"}, "condition": {"homo": ">-10.549854278564451", "U": "<-17.286821365356445"}, "tool": "calculate_data", "answer": 3951306.78981781, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the total electronic spatial extent (R²) values where HOMO energy is above {} and internal energy (U) is below {}?"}
{"question": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds 135.0 Å, the electronegativity of element B (χpb) is below 1.54, and the molar mass (M) is less than 233.24 g/mol?", "refer_dataset": "table3", "column names": ["Ra", "χpb", "M", "RH2(µmol h-1 g-1)"], "condition_column": {"Ra": ">", "χpb": "<", "M": "<"}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Ra": ">135.0", "χpb": "<1.54", "M": "<233.24"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds {} Å, the electronegativity of element B (χpb) is below {}, and the molar mass (M) is less than {} g/mol?"}
{"question": "Calculate the average C2 yield (%) for catalysts with primary metal Zn, secondary metal Hf, and support material La2O3.", "refer_dataset": "table21", "column names": ["M1", "M2", "Support", "C2 yield (%)"], "condition_column": {"M1": "=", "M2": "=", "Support": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='Zn'", "M2": "=='Hf'", "Support": "=='La2O3'"}, "tool": "calculate_data", "answer": 3.8538497461419365, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average C2 yield (%) for catalysts with primary metal {}, secondary metal {}, and support material {}."}
{"question": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below 25.81504477587679.", "refer_dataset": "table56", "column names": ["mu_b", "shear modulus"], "condition_column": {"shear modulus": "<"}, "answer_column": {"mu_b": "avg"}, "condition": {"shear modulus": "<25.81504477587679"}, "tool": "calculate_data", "answer": 0.4936592184873947, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below {}."}
{"question": "Determine the total CO yield (COy) when Support_ID is 8 and M1_atom_number is less than 25.", "refer_dataset": "table17", "column names": ["Support_ID", "M1_atom_number", "COy"], "condition_column": {"Support_ID": "=", "M1_atom_number": "<"}, "answer_column": {"COy": "sum"}, "condition": {"Support_ID": "=='8'", "M1_atom_number": "<25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total CO yield (COy) when Support_ID is {} and M1_atom_number is less than {}."}
{"question": "What is the median Anion2-mol when CH4-pressure is 0.47?", "refer_dataset": "table20", "column names": ["Anion2-mol", "CH4-pressure"], "condition_column": {"CH4-pressure": "="}, "answer_column": {"Anion2-mol": "median"}, "condition": {"CH4-pressure": "=='0.47'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Anion2-mol when CH4-pressure is {}?"}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 4.53222860833902?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='4.53222860833902'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "Calculate the maximum formation energy per atom for materials with space group number 10.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "max"}, "condition": {"spacegroup_number": "=='10'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum formation energy per atom for materials with space group number {}."}
{"question": "What is the maximum shear modulus recorded for materials with the chemical formula K(CoSe)2?", "refer_dataset": "table56", "column names": ["shear modulus", "formula"], "condition_column": {"formula": "="}, "answer_column": {"shear modulus": "max"}, "condition": {"formula": "=='K(CoSe)2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus recorded for materials with the chemical formula {}?"}
{"question": "Find the median Band_gap_GGA where Band_gap_HSE_optical < 5.558663.", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": "<"}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Band_gap_HSE_optical": "<5.558663"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 2.037844}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.539445}, {"Band_gap_GGA": 1.891728}, {"Band_gap_GGA": 1.137147}, {"Band_gap_GGA": 1.07639}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.489848}, {"Band_gap_GGA": 1.862139}, {"Band_gap_GGA": 1.623}, {"Band_gap_GGA": 1.150497}, {"Band_gap_GGA": 0.726702}, {"Band_gap_GGA": 1.119908}, {"Band_gap_GGA": 0.684651}, {"Band_gap_GGA": 1.173072}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.426179}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.915572}, {"Band_gap_GGA": 0.694418}, {"Band_gap_GGA": 1.959881}, {"Band_gap_GGA": 0.846528}, {"Band_gap_GGA": 0.759537}, {"Band_gap_GGA": 1.082826}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.29665}, {"Band_gap_GGA": 0.812729}, {"Band_gap_GGA": 1.253241}, {"Band_gap_GGA": 1.521543}, {"Band_gap_GGA": 1.604719}, {"Band_gap_GGA": 0.121138}, {"Band_gap_GGA": 1.327256}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.324094}, {"Band_gap_GGA": 0.763006}, {"Band_gap_GGA": 1.6843169999999996}, {"Band_gap_GGA": 1.298135}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.080963}, {"Band_gap_GGA": 1.812356}, {"Band_gap_GGA": 1.472881}, {"Band_gap_GGA": 1.917619}, {"Band_gap_GGA": 0.736109}, {"Band_gap_GGA": 2.514819}, {"Band_gap_GGA": 1.166888}, {"Band_gap_GGA": 1.199719}, {"Band_gap_GGA": 0.476453}, {"Band_gap_GGA": 0.049785}, {"Band_gap_GGA": 0.796627}, {"Band_gap_GGA": 0.517763}, {"Band_gap_GGA": 0.218723}, {"Band_gap_GGA": 0.451375}, {"Band_gap_GGA": 2.025862}, {"Band_gap_GGA": 1.241031}, {"Band_gap_GGA": 0.041666}, {"Band_gap_GGA": 1.819333}, {"Band_gap_GGA": 2.75736}, {"Band_gap_GGA": 2.646834}, {"Band_gap_GGA": 1.958661}, {"Band_gap_GGA": 2.228965}, {"Band_gap_GGA": 2.252553}, {"Band_gap_GGA": 3.154054}, {"Band_gap_GGA": 1.300029}, {"Band_gap_GGA": 2.619155}, {"Band_gap_GGA": 2.616013}, {"Band_gap_GGA": 2.212373}, {"Band_gap_GGA": 2.957716}, {"Band_gap_GGA": 2.516797}, {"Band_gap_GGA": 1.3973739999999997}, {"Band_gap_GGA": 2.576314}, {"Band_gap_GGA": 1.20222}, {"Band_gap_GGA": 2.498679}, {"Band_gap_GGA": 3.357065}, {"Band_gap_GGA": 3.1444340000000004}, {"Band_gap_GGA": 0.116559}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.852829}, {"Band_gap_GGA": 1.015877}, {"Band_gap_GGA": 0.522174}, {"Band_gap_GGA": 0.616087}, {"Band_gap_GGA": 2.330909}, {"Band_gap_GGA": 2.882815}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 2.927575}, {"Band_gap_GGA": 0.189223}, {"Band_gap_GGA": 1.810657}, {"Band_gap_GGA": 1.632221}, {"Band_gap_GGA": 1.000199}, {"Band_gap_GGA": 0.58384}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.484641}, {"Band_gap_GGA": 1.00246}, {"Band_gap_GGA": 1.465159}, {"Band_gap_GGA": 2.609377}, {"Band_gap_GGA": 1.460508}, {"Band_gap_GGA": 1.461365}, {"Band_gap_GGA": 1.362999}, {"Band_gap_GGA": 1.2176}, {"Band_gap_GGA": 0.2031569999999999}, {"Band_gap_GGA": 0.62853}, {"Band_gap_GGA": 2.65807}, {"Band_gap_GGA": 2.218596}, {"Band_gap_GGA": 1.817097}, {"Band_gap_GGA": 1.446497}, {"Band_gap_GGA": 2.58846}, {"Band_gap_GGA": 1.58958}, {"Band_gap_GGA": 2.79909}, {"Band_gap_GGA": 1.312536}, {"Band_gap_GGA": 0.585286}, {"Band_gap_GGA": 0.937776}, {"Band_gap_GGA": 0.636041}, {"Band_gap_GGA": 0.611795}, {"Band_gap_GGA": 0.803879}, {"Band_gap_GGA": 1.403779}, {"Band_gap_GGA": 1.104735}, {"Band_gap_GGA": 0.551833}, {"Band_gap_GGA": 1.254096}, {"Band_gap_GGA": 1.0671210000000002}, {"Band_gap_GGA": 1.321603}, {"Band_gap_GGA": 1.829391}, {"Band_gap_GGA": 0.420153}, {"Band_gap_GGA": 1.512535}, {"Band_gap_GGA": 0.65297}, {"Band_gap_GGA": 0.241175}, {"Band_gap_GGA": 1.655065}, {"Band_gap_GGA": 0.251584}, {"Band_gap_GGA": 0.172653}, {"Band_gap_GGA": 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{"Band_gap_GGA": 1.107226}, {"Band_gap_GGA": 1.378346}, {"Band_gap_GGA": 1.484807}, {"Band_gap_GGA": 2.000518}, {"Band_gap_GGA": 0.178726}, {"Band_gap_GGA": 1.868281}, {"Band_gap_GGA": 1.664837}, {"Band_gap_GGA": 1.707032}, {"Band_gap_GGA": 1.246136}, {"Band_gap_GGA": 1.2108659999999998}, {"Band_gap_GGA": 2.181213}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.735677}, {"Band_gap_GGA": 1.9745}, {"Band_gap_GGA": 1.085179}, {"Band_gap_GGA": 1.820196}, {"Band_gap_GGA": 1.791422}, {"Band_gap_GGA": 1.75657}, {"Band_gap_GGA": 2.29428}, {"Band_gap_GGA": 2.41473}, {"Band_gap_GGA": 1.547412}, {"Band_gap_GGA": 1.557226}, {"Band_gap_GGA": 1.274934}, {"Band_gap_GGA": 1.243414}, {"Band_gap_GGA": 2.69656}, {"Band_gap_GGA": 0.607131}, {"Band_gap_GGA": 1.206962}, {"Band_gap_GGA": 2.269988}, {"Band_gap_GGA": 1.629274}, {"Band_gap_GGA": 1.627351}, {"Band_gap_GGA": 0.825042}, {"Band_gap_GGA": 1.370589}, {"Band_gap_GGA": 2.162857}, {"Band_gap_GGA": 1.749904}, {"Band_gap_GGA": 1.515914}, {"Band_gap_GGA": 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0.798446}, {"Band_gap_GGA": 2.138669}, {"Band_gap_GGA": 2.178183}, {"Band_gap_GGA": 2.690566}, {"Band_gap_GGA": 2.536634}, {"Band_gap_GGA": 2.6941680000000003}, {"Band_gap_GGA": 1.4420350000000002}, {"Band_gap_GGA": 1.899609}, {"Band_gap_GGA": 0.508781}, {"Band_gap_GGA": 0.73837}, {"Band_gap_GGA": 1.797742}, {"Band_gap_GGA": 1.682294}, {"Band_gap_GGA": 1.087724}, {"Band_gap_GGA": 1.218978}, {"Band_gap_GGA": 1.298976}, {"Band_gap_GGA": 2.260207}, {"Band_gap_GGA": 1.525452}, {"Band_gap_GGA": 1.423772}, {"Band_gap_GGA": 0.966014}, {"Band_gap_GGA": 1.055572}, {"Band_gap_GGA": 0.438332}, {"Band_gap_GGA": 1.343308}, {"Band_gap_GGA": 1.104789}, {"Band_gap_GGA": 1.728862}, {"Band_gap_GGA": 1.761256}, {"Band_gap_GGA": 1.655191}, {"Band_gap_GGA": 0.867832}, {"Band_gap_GGA": 0.371746}, {"Band_gap_GGA": 1.616284}, {"Band_gap_GGA": 1.033186}, {"Band_gap_GGA": 0.234174}, {"Band_gap_GGA": 0.346926}, {"Band_gap_GGA": 1.362426}, {"Band_gap_GGA": 1.880788}, {"Band_gap_GGA": 0.385788}, {"Band_gap_GGA": 1.303072}, {"Band_gap_GGA": 0.662986}, {"Band_gap_GGA": 1.7887749999999998}, {"Band_gap_GGA": 1.133092}, {"Band_gap_GGA": 1.175465}, {"Band_gap_GGA": 1.176696}, {"Band_gap_GGA": 1.049262}, {"Band_gap_GGA": 0.436652}, {"Band_gap_GGA": 0.412994}, {"Band_gap_GGA": 0.021041}, {"Band_gap_GGA": 0.207128}, {"Band_gap_GGA": 0.654831}, {"Band_gap_GGA": 2.11865}, {"Band_gap_GGA": 2.241355}, {"Band_gap_GGA": 0.927172}, {"Band_gap_GGA": 0.436412}, {"Band_gap_GGA": 1.378359}, {"Band_gap_GGA": 1.186324}, {"Band_gap_GGA": 1.695903}, {"Band_gap_GGA": 0.569667}, {"Band_gap_GGA": 1.667049}, {"Band_gap_GGA": 0.796822}, {"Band_gap_GGA": 1.713287}, {"Band_gap_GGA": 1.899865}, {"Band_gap_GGA": 1.827431}, {"Band_gap_GGA": 1.91048}, {"Band_gap_GGA": 1.482791}, {"Band_gap_GGA": 1.772596}, {"Band_gap_GGA": 2.081401}, {"Band_gap_GGA": 2.035186}, {"Band_gap_GGA": 2.315914}, {"Band_gap_GGA": 2.314892}, {"Band_gap_GGA": 2.367201}, {"Band_gap_GGA": 0.860057}, {"Band_gap_GGA": 0.947955}, {"Band_gap_GGA": 1.961104}, 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{"Band_gap_GGA": 0.935334}, {"Band_gap_GGA": 1.876854}, {"Band_gap_GGA": 1.490522}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 2.209694}, {"Band_gap_GGA": 1.925467}, {"Band_gap_GGA": 1.986507}, {"Band_gap_GGA": 3.068424}, {"Band_gap_GGA": 3.068607}, {"Band_gap_GGA": 1.330583}, {"Band_gap_GGA": 3.12463}, {"Band_gap_GGA": 0.894779}, {"Band_gap_GGA": 1.870701}, {"Band_gap_GGA": 1.243413}, {"Band_gap_GGA": 1.889977}, {"Band_gap_GGA": 2.149314}, {"Band_gap_GGA": 2.143126}, {"Band_gap_GGA": 2.252694}, {"Band_gap_GGA": 2.304683}, {"Band_gap_GGA": 2.372338}, {"Band_gap_GGA": 2.552375}, {"Band_gap_GGA": 1.997233}, {"Band_gap_GGA": 2.029982}, {"Band_gap_GGA": 0.949497}, {"Band_gap_GGA": 3.760028}, {"Band_gap_GGA": 3.761058}, {"Band_gap_GGA": 3.416749}, {"Band_gap_GGA": 2.147805}, {"Band_gap_GGA": 2.14552}, {"Band_gap_GGA": 1.503369}, {"Band_gap_GGA": 2.500153}, {"Band_gap_GGA": 0.903644}, {"Band_gap_GGA": 2.276321}, {"Band_gap_GGA": 1.284232}, {"Band_gap_GGA": 2.799626}, {"Band_gap_GGA": 1.125111}, {"Band_gap_GGA": 0.96445}, {"Band_gap_GGA": 0.962134}, {"Band_gap_GGA": 2.725722}, {"Band_gap_GGA": 0.4111180000000001}, {"Band_gap_GGA": 1.62318}, {"Band_gap_GGA": 1.733938}, {"Band_gap_GGA": 1.860885}, {"Band_gap_GGA": 2.105103}, {"Band_gap_GGA": 2.347727}, {"Band_gap_GGA": 2.617065}, {"Band_gap_GGA": 2.642137}, {"Band_gap_GGA": 2.599148}, {"Band_gap_GGA": 2.535212}, {"Band_gap_GGA": 2.676799}, {"Band_gap_GGA": 1.520556}, {"Band_gap_GGA": 1.032317}, {"Band_gap_GGA": 1.859588}, {"Band_gap_GGA": 1.975251}, {"Band_gap_GGA": 2.978894}, {"Band_gap_GGA": 4.037895}, {"Band_gap_GGA": 3.39159}, {"Band_gap_GGA": 1.894462}, {"Band_gap_GGA": 2.250861}, {"Band_gap_GGA": 2.102199}, {"Band_gap_GGA": 2.763222}, {"Band_gap_GGA": 2.960813}, {"Band_gap_GGA": 4.126522}, {"Band_gap_GGA": 2.64173}, {"Band_gap_GGA": 3.052035}, {"Band_gap_GGA": 3.0323300000000004}, {"Band_gap_GGA": 1.55756}, {"Band_gap_GGA": 0.910215}, {"Band_gap_GGA": 1.382571}, {"Band_gap_GGA": 1.079099}, {"Band_gap_GGA": 1.176261}, {"Band_gap_GGA": 0.606807}, {"Band_gap_GGA": 1.743149}, {"Band_gap_GGA": 2.0509479999999995}, {"Band_gap_GGA": 2.027044}, {"Band_gap_GGA": 0.823484}, {"Band_gap_GGA": 2.209528}, {"Band_gap_GGA": 2.565877}, {"Band_gap_GGA": 2.316807}, {"Band_gap_GGA": 2.677563}, {"Band_gap_GGA": 0.727435}, {"Band_gap_GGA": 3.33881}, {"Band_gap_GGA": 2.7272220000000003}, {"Band_gap_GGA": 0.188778}, {"Band_gap_GGA": 1.842911}, {"Band_gap_GGA": 3.906569}, {"Band_gap_GGA": 1.12308}, {"Band_gap_GGA": 0.999406}, {"Band_gap_GGA": 1.439385}, {"Band_gap_GGA": 1.03154}, {"Band_gap_GGA": 1.560101}, {"Band_gap_GGA": 2.762808}, {"Band_gap_GGA": 3.651526}, {"Band_gap_GGA": 0.827258}, {"Band_gap_GGA": 0.275451}, {"Band_gap_GGA": 0.689105}, {"Band_gap_GGA": 0.394198}, {"Band_gap_GGA": 2.879078}, {"Band_gap_GGA": 2.430466}, {"Band_gap_GGA": 2.780673}, {"Band_gap_GGA": 2.840373}, {"Band_gap_GGA": 2.840069}, {"Band_gap_GGA": 0.259208}, {"Band_gap_GGA": 2.135185}, {"Band_gap_GGA": 2.259905}, {"Band_gap_GGA": 2.243513}, {"Band_gap_GGA": 0.166703}, {"Band_gap_GGA": 2.402334}, {"Band_gap_GGA": 1.463383}, {"Band_gap_GGA": 1.185585}, {"Band_gap_GGA": 0.99778}, {"Band_gap_GGA": 0.853574}, {"Band_gap_GGA": 0.979447}, {"Band_gap_GGA": 1.747998}, {"Band_gap_GGA": 1.748646}, {"Band_gap_GGA": 2.070407}, {"Band_gap_GGA": 2.108262}, {"Band_gap_GGA": 2.493529}, {"Band_gap_GGA": 1.546077}, {"Band_gap_GGA": 1.551212}, {"Band_gap_GGA": 1.034119}, {"Band_gap_GGA": 2.486355}, {"Band_gap_GGA": 1.370191}, {"Band_gap_GGA": 2.064247}, {"Band_gap_GGA": 2.377135}, {"Band_gap_GGA": 2.296233}, {"Band_gap_GGA": 2.371874}, {"Band_gap_GGA": 1.466453}, {"Band_gap_GGA": 3.654543}, {"Band_gap_GGA": 2.744065}, {"Band_gap_GGA": 1.201798}, {"Band_gap_GGA": 1.940683}, {"Band_gap_GGA": 4.101592}, {"Band_gap_GGA": 2.240876}, {"Band_gap_GGA": 2.144045}, {"Band_gap_GGA": 1.436723}, {"Band_gap_GGA": 0.044612}, {"Band_gap_GGA": 2.212292}, {"Band_gap_GGA": 1.98328}, {"Band_gap_GGA": 1.614124}, {"Band_gap_GGA": 3.391764}, {"Band_gap_GGA": 0.174608}, {"Band_gap_GGA": 1.263702}, {"Band_gap_GGA": 1.024733}, {"Band_gap_GGA": 1.68655}, {"Band_gap_GGA": 1.855932}, {"Band_gap_GGA": 1.8878}, {"Band_gap_GGA": 1.207162}, {"Band_gap_GGA": 0.3737000000000003}, {"Band_gap_GGA": 0.970382}, {"Band_gap_GGA": 0.93313}, {"Band_gap_GGA": 1.666143}, {"Band_gap_GGA": 1.859685}, {"Band_gap_GGA": 1.429847}, {"Band_gap_GGA": 0.645766}, {"Band_gap_GGA": 0.423326}, {"Band_gap_GGA": 1.549965}, {"Band_gap_GGA": 1.103556}, {"Band_gap_GGA": 1.074611}, {"Band_gap_GGA": 2.42974}, {"Band_gap_GGA": 2.40879}, {"Band_gap_GGA": 2.237308}, {"Band_gap_GGA": 0.855654}, {"Band_gap_GGA": 1.769321}, {"Band_gap_GGA": 1.875662}, {"Band_gap_GGA": 3.422204}, {"Band_gap_GGA": 1.109291}, {"Band_gap_GGA": 3.144173}, {"Band_gap_GGA": 1.754102}, {"Band_gap_GGA": 0.129031}, {"Band_gap_GGA": 3.66689}, {"Band_gap_GGA": 2.908057}, {"Band_gap_GGA": 2.191562}, {"Band_gap_GGA": 2.408317}, {"Band_gap_GGA": 0.818666}, {"Band_gap_GGA": 1.409758}, {"Band_gap_GGA": 2.163089}, {"Band_gap_GGA": 1.573899}, {"Band_gap_GGA": 2.974661}, {"Band_gap_GGA": 4.2026}, {"Band_gap_GGA": 2.564413}, {"Band_gap_GGA": 1.612963}, {"Band_gap_GGA": 2.34671}, {"Band_gap_GGA": 1.51003}, {"Band_gap_GGA": 0.90871}, {"Band_gap_GGA": 1.81848}, {"Band_gap_GGA": 1.820439}, {"Band_gap_GGA": 1.621974}, {"Band_gap_GGA": 1.618741}, {"Band_gap_GGA": 0.654414}, {"Band_gap_GGA": 0.662021}, {"Band_gap_GGA": 0.444592}, {"Band_gap_GGA": 2.010366}, {"Band_gap_GGA": 0.140697}, {"Band_gap_GGA": 0.060698}, {"Band_gap_GGA": 0.924272}, {"Band_gap_GGA": 2.990818}, {"Band_gap_GGA": 1.215515}, {"Band_gap_GGA": 2.125477}, {"Band_gap_GGA": 2.269805}, {"Band_gap_GGA": 0.811707}, {"Band_gap_GGA": 0.600486}, {"Band_gap_GGA": 1.805433}, {"Band_gap_GGA": 1.744571}, {"Band_gap_GGA": 1.732283}, {"Band_gap_GGA": 2.090222}, {"Band_gap_GGA": 2.189527}, {"Band_gap_GGA": 2.276193}, {"Band_gap_GGA": 1.634283}, {"Band_gap_GGA": 1.634473}, {"Band_gap_GGA": 1.235843}, {"Band_gap_GGA": 0.13966}, {"Band_gap_GGA": 2.623988}, {"Band_gap_GGA": 1.951332}, {"Band_gap_GGA": 2.138443}, {"Band_gap_GGA": 1.220787}, {"Band_gap_GGA": 1.315377}, {"Band_gap_GGA": 2.064804}, {"Band_gap_GGA": 1.227117}, {"Band_gap_GGA": 2.701244}, {"Band_gap_GGA": 2.626919}, {"Band_gap_GGA": 2.727472}, {"Band_gap_GGA": 2.151341}, {"Band_gap_GGA": 2.245308}, {"Band_gap_GGA": 1.181219}, {"Band_gap_GGA": 3.057132}, {"Band_gap_GGA": 3.099748}, {"Band_gap_GGA": 0.146883}, {"Band_gap_GGA": 1.544537}, {"Band_gap_GGA": 2.632534}, {"Band_gap_GGA": 1.562761}, {"Band_gap_GGA": 1.992365}, {"Band_gap_GGA": 1.825093}, {"Band_gap_GGA": 1.910117}, {"Band_gap_GGA": 1.87319}, {"Band_gap_GGA": 1.717215}, {"Band_gap_GGA": 0.97917}, {"Band_gap_GGA": 2.260433}, {"Band_gap_GGA": 2.544654}, {"Band_gap_GGA": 1.2418799999999997}, {"Band_gap_GGA": 0.892895}, {"Band_gap_GGA": 2.578329}, {"Band_gap_GGA": 2.570836}, {"Band_gap_GGA": 1.865955}, {"Band_gap_GGA": 1.67306}, {"Band_gap_GGA": 2.0048980000000003}, {"Band_gap_GGA": 0.456143}, {"Band_gap_GGA": 1.20408}, {"Band_gap_GGA": 1.859734}, {"Band_gap_GGA": 1.062661}, {"Band_gap_GGA": 2.414025}, {"Band_gap_GGA": 2.617933}, {"Band_gap_GGA": 2.779177}, {"Band_gap_GGA": 1.160631}, {"Band_gap_GGA": 2.507368}, {"Band_gap_GGA": 2.004025}, {"Band_gap_GGA": 1.7935569999999998}, {"Band_gap_GGA": 0.568376}, {"Band_gap_GGA": 1.671224}, {"Band_gap_GGA": 1.784577}, {"Band_gap_GGA": 1.4646}, {"Band_gap_GGA": 1.420798}, {"Band_gap_GGA": 2.22515}, {"Band_gap_GGA": 2.016476}, {"Band_gap_GGA": 2.869485}, {"Band_gap_GGA": 2.521763}, {"Band_gap_GGA": 2.461123}, {"Band_gap_GGA": 2.564278}, {"Band_gap_GGA": 2.196636}, {"Band_gap_GGA": 1.175897}, {"Band_gap_GGA": 1.436867}, {"Band_gap_GGA": 1.305043}, {"Band_gap_GGA": 1.601978}, {"Band_gap_GGA": 1.66379}, {"Band_gap_GGA": 1.94988}, {"Band_gap_GGA": 1.824328}, {"Band_gap_GGA": 1.68645}, {"Band_gap_GGA": 2.577125}, {"Band_gap_GGA": 2.50703}, {"Band_gap_GGA": 2.628116}, {"Band_gap_GGA": 2.063832}, {"Band_gap_GGA": 2.059388}, {"Band_gap_GGA": 0.477598}, {"Band_gap_GGA": 2.395911}, {"Band_gap_GGA": 1.015622}, {"Band_gap_GGA": 2.542545}, {"Band_gap_GGA": 1.70482}, {"Band_gap_GGA": 1.607063}, {"Band_gap_GGA": 0.093388}, {"Band_gap_GGA": 0.16859}, {"Band_gap_GGA": 2.300021}, {"Band_gap_GGA": 0.332569}, {"Band_gap_GGA": 1.783169}, {"Band_gap_GGA": 0.1090209999999999}, {"Band_gap_GGA": 3.722443}, {"Band_gap_GGA": 1.666039}, {"Band_gap_GGA": 1.381963}, {"Band_gap_GGA": 0.987243}, {"Band_gap_GGA": 2.306227}, {"Band_gap_GGA": 3.066712}, {"Band_gap_GGA": 3.0295}, {"Band_gap_GGA": 0.768662}, {"Band_gap_GGA": 0.887118}, {"Band_gap_GGA": 0.852572}, {"Band_gap_GGA": 0.204799}, {"Band_gap_GGA": 0.5355}, {"Band_gap_GGA": 0.775819}, {"Band_gap_GGA": 1.27965}, {"Band_gap_GGA": 0.380005}, {"Band_gap_GGA": 2.319014}, {"Band_gap_GGA": 0.957195}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Band_gap_GGA where Band_gap_HSE_optical < {}."}
{"question": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to 95.0?", "refer_dataset": "table54", "column names": ["bulk modulus", "gap pbe"], "condition_column": {"bulk modulus": "="}, "answer_column": {"gap pbe": "avg"}, "condition": {"bulk modulus": "=='95.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to {}?"}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 35.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">35.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.7, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -1.77757499937717.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-1.77757499937717'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Calculate the average chem_pot for symbol As when ef is greater than 1.41749?", "refer_dataset": "table68", "column names": ["symbol", "ef", "chem_pot"], "condition_column": {"symbol": "=", "ef": ">"}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='As'", "ef": ">1.41749"}, "tool": "calculate_data", "answer": -3.08603175, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {} when ef is greater than {}?"}
{"question": "What is the highest C2 selectivity (C2s) for M1 = Mn, M2_mol < 0.37, and Support = CeO2?", "refer_dataset": "table17", "column names": ["M1", "M2_mol", "Support", "C2s"], "condition_column": {"M1": "=", "M2_mol": "<", "Support": "="}, "answer_column": {"C2s": "max"}, "condition": {"M1": "=='Mn'", "M2_mol": "<0.37", "Support": "=='CeO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C2 selectivity (C2s) for M1 = {}, M2_mol < {}, and Support = {}?"}
{"question": "What is the highest reaction energy for elements Au with adsorbed species CH* and activation energy greater than 2.58?", "refer_dataset": "table18", "column names": ["AA", "ab", "activation_energy", "reaction_energy"], "condition_column": {"AA": "=", "ab": "=", "activation_energy": ">"}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Au'", "ab": "=='CH*'", "activation_energy": ">2.58"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy for elements {} with adsorbed species {} and activation energy greater than {}?"}
{"question": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than 5.176.", "refer_dataset": "table66", "column names": ["scf_vbm", "efermi"], "condition_column": {"scf_vbm": ">"}, "answer_column": {"efermi": "min"}, "condition": {"scf_vbm": ">5.176"}, "tool": "calculate_data", "answer": 7.27774779, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than {}."}
{"question": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < -1.1452, scf_vbm > 5.176, and formula is 'AlAs'.", "refer_dataset": "table66", "column names": ["surf_vbm", "scf_vbm", "formula", "final_energy"], "condition_column": {"surf_vbm": "<", "scf_vbm": ">", "formula": "="}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<-1.1452", "scf_vbm": ">5.176", "formula": "=='AlAs'"}, "tool": "calculate_data", "answer": -47.13521155, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < {}, scf_vbm > {}, and formula is '{}'."}
{"question": "How many entries have a wycoff position of h?", "refer_dataset": "table68", "column names": ["wycoff", "jid"], "condition_column": {"wycoff": "="}, "answer_column": {"jid": "count"}, "condition": {"wycoff": "=='h'"}, "tool": "calculate_data", "answer": 20, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have a wycoff position of {}?"}
{"question": "Determine the maximum reactor volume for MOF Type PURE, synthesized at over 110.0°C, with reaction pressure below 1.0 atm.", "refer_dataset": "table7", "column names": ["MOF_Type", "Synhesis_Temp", "Rxn_Pressure", "Reactor_Volume"], "condition_column": {"MOF_Type": "=", "Synhesis_Temp": ">", "Rxn_Pressure": "<"}, "answer_column": {"Reactor_Volume": "max"}, "condition": {"MOF_Type": "=='PURE'", "Synhesis_Temp": ">110.0", "Rxn_Pressure": "<1.0"}, "tool": "calculate_data", "answer": 46.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum reactor volume for MOF Type {}, synthesized at over {}°C, with reaction pressure below {} atm."}
{"question": "Calculate the average _oqmd_stability for materials with _oqmd_band_gap below 3.768.", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_stability"], "condition_column": {"_oqmd_band_gap": "<"}, "answer_column": {"_oqmd_stability": "avg"}, "condition": {"_oqmd_band_gap": "<3.768"}, "tool": "calculate_data", "answer": 0.5963156803711009, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average _oqmd_stability for materials with _oqmd_band_gap below {}."}
{"question": "What is the total number of articles indexed on 2020-11-04 00:00:00 that used the electrochemical deposition method?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Judge_Electrochemical_Deposition"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Judge_Electrochemical_Deposition": "count"}, "condition": {"Indexed_Date": "=='2020-11-04 00:00:00'"}, "tool": "calculate_data", "answer": 2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total number of articles indexed on {} that used the electrochemical deposition method?"}
{"question": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds -6.789240837097168, internal energy at 0K (U0) is below -31.056245803833008, and Gibbs free energy (G) equals -28.99027633666992?", "refer_dataset": "table60", "column names": ["homo", "U0", "G", "Cv"], "condition_column": {"homo": ">", "U0": "<", "G": "="}, "answer_column": {"Cv": "min"}, "condition": {"homo": ">-6.789240837097168", "U0": "<-31.056245803833008", "G": "=='-28.99027633666992'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds {}, internal energy at 0K (U0) is below {}, and Gibbs free energy (G) equals {}?"}
{"question": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than 3.89967646556?", "refer_dataset": "table51", "column names": ["pbe0_homo", "pbe0_scharber_pce"], "condition_column": {"pbe0_scharber_pce": "<"}, "answer_column": {"pbe0_homo": "max"}, "condition": {"pbe0_scharber_pce": "<3.89967646556"}, "tool": "calculate_data", "answer": -0.173, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than {}?"}
{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 1.0, Indirect Bandgap < 0.0, and Lattice Parameter 4.1030064886?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='1.0'", "Indirect_Band": "<0.0", "Lattice": "=='4.1030064886'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
{"question": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below 726.44 K, the electron affinity of element A (EAa) exceeds 13.36 eV, and the hydrogen production rate (RH2) is higher than 47.0 µmol h⁻¹ g⁻¹.", "refer_dataset": "table3", "column names": ["A_Tm", "EAa", "RH2(µmol h-1 g-1)", "χpb"], "condition_column": {"A_Tm": "<", "EAa": ">", "RH2(µmol h-1 g-1)": ">"}, "answer_column": {"χpb": "median"}, "condition": {"A_Tm": "<726.44", "EAa": ">13.36", "RH2(µmol h-1 g-1)": ">47.0"}, "tool": "calculate_data", "answer": [{"χpb": 1.54}, {"χpb": 1.66}, {"χpb": 1.6}, {"χpb": 1.6}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.52}, {"χpb": 1.53}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.51}, {"χpb": 1.54}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below {} K, the electron affinity of element A (EAa) exceeds {} eV, and the hydrogen production rate (RH2) is higher than {} µmol h⁻¹ g⁻¹."}
{"question": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is 0?", "refer_dataset": "table6", "column names": ["Illumination time (min)", "Antibiotic dosage (mg/L)"], "condition_column": {"Illumination time (min)": "="}, "answer_column": {"Antibiotic dosage (mg/L)": "min"}, "condition": {"Illumination time (min)": "=='0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is {}?"}
{"question": "What is the maximum C.E. % observed for pH level 6.3?", "refer_dataset": "table12", "column names": ["pH", "C.E. %"], "condition_column": {"pH": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"pH": "=='6.3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum C.E. % observed for pH level {}?"}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 6.18375206695995?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='6.18375206695995'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above 4, support material La2O3, and argon pressure 0.4 atm.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Support", "PAr (atm)", "C2 selectivity(%)"], "condition_column": {"CH4/O2 (mol/mol)": ">", "Support": "=", "PAr (atm)": "="}, "answer_column": {"C2 selectivity(%)": "min"}, "condition": {"CH4/O2 (mol/mol)": ">4", "Support": "=='La2O3'", "PAr (atm)": "=='0.4'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above {}, support material {}, and argon pressure {} atm."}
{"question": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below 1.7768000000000002?", "refer_dataset": "table56", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"gap pbe": "<"}, "answer_column": {"elastic anisotropy": "max"}, "condition": {"gap pbe": "<1.7768000000000002"}, "tool": "calculate_data", "answer": 401.4952807290347, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below {}?"}
{"question": "Calculate the total final energy for all materials with formula MgF2 and indirect band gap greater than 5.714.", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "final_energy"], "condition_column": {"formula": "=", "indir_gap": ">"}, "answer_column": {"final_energy": "sum"}, "condition": {"formula": "=='MgF2'", "indir_gap": ">5.714"}, "tool": "calculate_data", "answer": -4005.5057261171064, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total final energy for all materials with formula {} and indirect band gap greater than {}."}
{"question": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"NM\", SOC False, and Direct_or_indirect_HSE \"Indirect\"?", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "SOC", "Direct_or_indirect_HSE", "Band_gap_HSE"], "condition_column": {"Magnetic_ordering": "=", "SOC": "=", "Direct_or_indirect_HSE": "="}, "answer_column": {"Band_gap_HSE": "max"}, "condition": {"Magnetic_ordering": "=='NM'", "SOC": "=='False'", "Direct_or_indirect_HSE": "=='Indirect'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"{}\", SOC {}, and Direct_or_indirect_HSE \"{}\"?"}
{"question": "How many organic compounds (OC) have pH values equal to 6.4?", "refer_dataset": "table9", "column names": ["OC", "pH"], "condition_column": {"pH": "="}, "answer_column": {"OC": "count"}, "condition": {"pH": "=='6.4'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many organic compounds (OC) have pH values equal to {}?"}
{"question": "Find the average Degradation efficiency (%) for Material MIL-101 when Catalyst dosage (g/L) > 0.05, Illumination time (min) > 20, and pH < 4.1.", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Illumination time (min)", "pH", "Degradation efficiency (%)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Illumination time (min)": ">", "pH": "<"}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.05", "Illumination time (min)": ">20", "pH": "<4.1"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Degradation efficiency (%) for Material {} when Catalyst dosage (g/L) > {}, Illumination time (min) > {}, and pH < {}."}
{"question": "What is the average journal impact factor for research institutions located in nan?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='nan'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above 6.044565807739908.", "refer_dataset": "table66", "column names": ["avg_max", "surf_cbm"], "condition_column": {"avg_max": ">"}, "answer_column": {"surf_cbm": "min"}, "condition": {"avg_max": ">6.044565807739908"}, "tool": "calculate_data", "answer": 4.9916, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above {}."}
{"question": "Find the Illumination Time required to reach 30.0% Degradation Rate with pH = 7.0 and Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "pH", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": ">", "pH": "=", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": ""}, "condition": {"Degradation rate(%)": ">30.0", "pH": "=='7.0'", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the Illumination Time required to reach {}% Degradation Rate with pH = {} and Dopant/Ti mole ratio {}."}
{"question": "Determine the average ethane yield (C2H6y) for M1 = Mn, Support_ID = 5, and M3_mol > 0.185.", "refer_dataset": "table17", "column names": ["M1", "Support_ID", "M3_mol", "C2H6y"], "condition_column": {"M1": "=", "Support_ID": "=", "M3_mol": ">"}, "answer_column": {"C2H6y": "avg"}, "condition": {"M1": "=='Mn'", "Support_ID": "=='5'", "M3_mol": ">0.185"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average ethane yield (C2H6y) for M1 = {}, Support_ID = {}, and M3_mol > {}."}
{"question": "What is the average J.uAcm2_0.80_fromCV when Mn concentration exceeds 0.9?", "refer_dataset": "table16", "column names": ["Mn", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">"}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.9"}, "tool": "calculate_data", "answer": 830.3485, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average J.uAcm2_0.80_fromCV when Mn concentration exceeds {}?"}
{"question": "What is the minimum formula_energy recorded for the chemical formula AlF3?", "refer_dataset": "table64", "column names": ["formula", "formula_energy"], "condition_column": {"formula": "="}, "answer_column": {"formula_energy": "min"}, "condition": {"formula": "=='AlF3'"}, "tool": "calculate_data", "answer": -3.913548352, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum formula_energy recorded for the chemical formula {}?"}
{"question": "What is the maximum PLD observed in compounds with a topology of dmd and synthesized status True?", "refer_dataset": "table62", "column names": ["topology", "synthesized", "pld"], "condition_column": {"topology": "=", "synthesized": "="}, "answer_column": {"pld": "max"}, "condition": {"topology": "=='dmd'", "synthesized": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD observed in compounds with a topology of {} and synthesized status {}?"}
{"question": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below 1510.58 K.", "refer_dataset": "table3", "column names": ["A_Tb", "Rb"], "condition_column": {"A_Tb": "<"}, "answer_column": {"Rb": "median"}, "condition": {"A_Tb": "<1510.58"}, "tool": "calculate_data", "answer": [{"Rb": 67.0}, {"Rb": 65.8}, {"Rb": 64.6}, {"Rb": 63.4}, {"Rb": 62.2}, {"Rb": 61.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 66.74}, {"Rb": 66.61}, {"Rb": 66.48}, {"Rb": 72.0}, {"Rb": 72.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 66.86}, {"Rb": 74.17}, {"Rb": 74.17}, {"Rb": 74.48}, {"Rb": 73.24}, {"Rb": 73.86}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 75.1}, {"Rb": 67.0}, {"Rb": 72.0}, {"Rb": 66.87}, {"Rb": 72.62}, {"Rb": 74.17}, {"Rb": 67.0}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below {} K."}
{"question": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of 0.1, Illumination time (min) > 10.0, and Antibiotic dosage (mg/L) < 50.0.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Illumination time (min)", "Antibiotic dosage (mg/L)", "Degradation efficiency (%)"], "condition_column": {"Catalyst dosage (g/L)": "=", "Illumination time (min)": ">", "Antibiotic dosage (mg/L)": "<"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"Catalyst dosage (g/L)": "=='0.1'", "Illumination time (min)": ">10.0", "Antibiotic dosage (mg/L)": "<50.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of {}, Illumination time (min) > {}, and Antibiotic dosage (mg/L) < {}."}
{"question": "Identify compounds where crystal system is hexagonal and formation energy per atom is less than -3.1014. What is their average final energy?", "refer_dataset": "table59", "column names": ["crystal_system", "f_enp", "final_energy"], "condition_column": {"crystal_system": "=", "f_enp": "<"}, "answer_column": {"final_energy": "avg"}, "condition": {"crystal_system": "=='hexagonal'", "f_enp": "<-3.1014"}, "tool": "calculate_data", "answer": -90.67962994974012, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify compounds where crystal system is {} and formation energy per atom is less than {}. What is their average final energy?"}
{"question": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is 200.0, pH > 3.45, and Catalyst dosage (g/L) is 0.25.", "refer_dataset": "table6", "column names": ["Antibiotic dosage (mg/L)", "pH", "Catalyst dosage (g/L)", "Illumination time (min)"], "condition_column": {"Antibiotic dosage (mg/L)": "=", "pH": ">", "Catalyst dosage (g/L)": "="}, "answer_column": {"Illumination time (min)": "avg"}, "condition": {"Antibiotic dosage (mg/L)": "=='200.0'", "pH": ">3.45", "Catalyst dosage (g/L)": "=='0.25'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is {}, pH > {}, and Catalyst dosage (g/L) is {}."}
{"question": "Determine the average temperature (°C) required to achieve C2 yield (%) over 2.299800228% with M2 as Mo and PAr below 0.7 atm.", "refer_dataset": "table21", "column names": ["C2 yield (%)", "M2", "PAr (atm)", "Temp. (°C)"], "condition_column": {"C2 yield (%)": ">", "M2": "=", "PAr (atm)": "<"}, "answer_column": {"Temp. (°C)": "avg"}, "condition": {"C2 yield (%)": ">2.299800228", "M2": "=='Mo'", "PAr (atm)": "<0.7"}, "tool": "calculate_data", "answer": 808.5227272727273, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average temperature (°C) required to achieve C2 yield (%) over {}% with M2 as {} and PAr below {} atm."}
{"question": "What is the maximum bandgap observed in materials from source_id mp-28117?", "refer_dataset": "table67", "column names": ["source_id", "bandgap"], "condition_column": {"source_id": "="}, "answer_column": {"bandgap": "max"}, "condition": {"source_id": "=='mp-28117'"}, "tool": "calculate_data", "answer": 2.2073, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bandgap observed in materials from source_id {}?"}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than -1.01991467884693?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<-1.01991467884693"}, "tool": "calculate_data", "answer": 2.04884424920197, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"FM\", SOC False, and Direct_or_indirect_HSE \"Direct\"?", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "SOC", "Direct_or_indirect_HSE", "Band_gap_HSE"], "condition_column": {"Magnetic_ordering": "=", "SOC": "=", "Direct_or_indirect_HSE": "="}, "answer_column": {"Band_gap_HSE": "max"}, "condition": {"Magnetic_ordering": "=='FM'", "SOC": "=='False'", "Direct_or_indirect_HSE": "=='Direct'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"{}\", SOC {}, and Direct_or_indirect_HSE \"{}\"?"}
{"question": "What is the maximum Onset potential for alloys where Platinum > 2.3%, Ruthenium < 83.4%, and Palladium > 12.8%?", "refer_dataset": "table15", "column names": ["Pt", "Ru", "Pd", "Onset"], "condition_column": {"Pt": ">", "Ru": "<", "Pd": ">"}, "answer_column": {"Onset": "max"}, "condition": {"Pt": ">2.3", "Ru": "<83.4", "Pd": ">12.8"}, "tool": "calculate_data", "answer": 0.600639, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Onset potential for alloys where Platinum > {}%, Ruthenium < {}%, and Palladium > {}%?"}
{"question": "Compute the average Catalyst dosage (g/L) for experiments where pH equals 9.0.", "refer_dataset": "table6", "column names": ["pH", "Catalyst dosage (g/L)"], "condition_column": {"pH": "="}, "answer_column": {"Catalyst dosage (g/L)": "avg"}, "condition": {"pH": "=='9.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Catalyst dosage (g/L) for experiments where pH equals {}."}
{"question": "Determine the highest overpotential in acidic conditions for articles published in ACS SUSTAINABLE CHEMISTRY & ENGINEERING journal.", "refer_dataset": "table13", "column names": ["Journal_Name", "Acid_OVP"], "condition_column": {"Journal_Name": "="}, "answer_column": {"Acid_OVP": "max"}, "condition": {"Journal_Name": "=='ACS SUSTAINABLE CHEMISTRY & ENGINEERING'"}, "tool": "calculate_data", "answer": 305.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the highest overpotential in acidic conditions for articles published in {} journal."}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MB under Experimental Temperature 25°C and Light Wavelength 420 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MB'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='420'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than 6.41.", "refer_dataset": "table66", "column names": ["scf_vbm", "efermi"], "condition_column": {"scf_vbm": ">"}, "answer_column": {"efermi": "min"}, "condition": {"scf_vbm": ">6.41"}, "tool": "calculate_data", "answer": 7.27774779, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than {}."}
{"question": "What is the minimum Gold percentage in alloys where Ruthenium exceeds 69.1%?", "refer_dataset": "table15", "column names": ["Ru", "Au"], "condition_column": {"Ru": ">"}, "answer_column": {"Au": "min"}, "condition": {"Ru": ">69.1"}, "tool": "calculate_data", "answer": 22.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Gold percentage in alloys where Ruthenium exceeds {}%?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 8.3?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">8.3"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "What is the average number of atoms per structure in materials with a crystal system of cubic and space group symbol Fd-3m?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='cubic'", "spacegroup_symbol": "=='Fd-3m'"}, "tool": "calculate_data", "answer": 3.44954128440367, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "What is the minimum Gold percentage in alloys where Ruthenium exceeds 56.2%?", "refer_dataset": "table15", "column names": ["Ru", "Au"], "condition_column": {"Ru": ">"}, "answer_column": {"Au": "min"}, "condition": {"Ru": ">56.2"}, "tool": "calculate_data", "answer": 30.3, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Gold percentage in alloys where Ruthenium exceeds {}%?"}
{"question": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below 727.0 K, the electron affinity of element A (EAa) exceeds 14.0 eV, and the hydrogen production rate (RH2) is higher than 52.0 µmol h⁻¹ g⁻¹.", "refer_dataset": "table3", "column names": ["A_Tm", "EAa", "RH2(µmol h-1 g-1)", "χpb"], "condition_column": {"A_Tm": "<", "EAa": ">", "RH2(µmol h-1 g-1)": ">"}, "answer_column": {"χpb": "median"}, "condition": {"A_Tm": "<727.0", "EAa": ">14.0", "RH2(µmol h-1 g-1)": ">52.0"}, "tool": "calculate_data", "answer": [{"χpb": 1.54}, {"χpb": 1.6}, {"χpb": 1.6}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.52}, {"χpb": 1.53}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below {} K, the electron affinity of element A (EAa) exceeds {} eV, and the hydrogen production rate (RH2) is higher than {} µmol h⁻¹ g⁻¹."}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below -189.60347562?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<-189.60347562"}, "tool": "calculate_data", "answer": 21.744707196414268, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than 44?", "refer_dataset": "table22", "column names": ["B_AtomN", "Direct_Band"], "condition_column": {"B_AtomN": ">"}, "answer_column": {"Direct_Band": "max"}, "condition": {"B_AtomN": ">44"}, "tool": "calculate_data", "answer": 4.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than {}?"}
{"question": "What is the average Degradation efficiency (%) when pH is 7.0?", "refer_dataset": "table6", "column names": ["pH", "Degradation efficiency (%)"], "condition_column": {"pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"pH": "=='7.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when pH is {}?"}
{"question": "What is the average Degradation efficiency (%) when Surface area (m2/g) > 303.9, Pore Volume (cm3/g) < 0.464, and pH is 5.9?", "refer_dataset": "table6", "column names": ["Surface area (m2/g)", "Pore Volume (cm3/g)", "pH", "Degradation efficiency (%)"], "condition_column": {"Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<", "pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Surface area (m2/g)": ">303.9", "Pore Volume (cm3/g)": "<0.464", "pH": "=='5.9'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when Surface area (m2/g) > {}, Pore Volume (cm3/g) < {}, and pH is {}?"}
{"question": "How many Preparations have Contact-times shorter than 0.04 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<0.04"}, "tool": "calculate_data", "answer": 214, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than 46?", "refer_dataset": "table22", "column names": ["B_AtomN", "Direct_Band"], "condition_column": {"B_AtomN": ">"}, "answer_column": {"Direct_Band": "max"}, "condition": {"B_AtomN": ">46"}, "tool": "calculate_data", "answer": 4.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than {}?"}
{"question": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > -2.1796, scf_vbm < 1.818, and formula contains 'CdS'?", "refer_dataset": "table66", "column names": ["surf_cbm", "scf_vbm", "formula", "efermi"], "condition_column": {"surf_cbm": ">", "scf_vbm": "<", "formula": "="}, "answer_column": {"efermi": "min"}, "condition": {"surf_cbm": ">-2.1796", "scf_vbm": "<1.818", "formula": "=='CdS'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > {}, scf_vbm < {}, and formula contains '{}'?"}
{"question": "Determine the total Yield (μmol/g/h) for photocatalysts containing a Bi type of Bi2S3.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Yield (μmol/g/h)"], "condition_column": {"Bi type in photocatalyst": "="}, "answer_column": {"Yield (μmol/g/h)": "count"}, "condition": {"Bi type in photocatalyst": "=='Bi2S3'"}, "tool": "calculate_data", "answer": 8, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total Yield (μmol/g/h) for photocatalysts containing a Bi type of {}."}
{"question": "What is the total sum of optb88vdw_cbm values where offset equals -1.484328942123752?", "refer_dataset": "table52", "column names": ["optb88vdw_cbm", "offset"], "condition_column": {"offset": "="}, "answer_column": {"optb88vdw_cbm": "sum"}, "condition": {"offset": "=='-1.484328942123752'"}, "tool": "calculate_data", "answer": 3.4271, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total sum of optb88vdw_cbm values where offset equals {}?"}
{"question": "List references (Ref) where initial concentration (C0) is greater than 100.0 mg/L.", "refer_dataset": "table9", "column names": ["Ref", "C0, mg/L"], "condition_column": {"C0, mg/L": ">"}, "answer_column": {"Ref": ""}, "condition": {"C0, mg/L": ">100.0"}, "tool": "calculate_data", "answer": [{"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 28}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 41}, {"Ref": 41}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List references (Ref) where initial concentration (C0) is greater than {} mg/L."}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than -0.37392566667732.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<-0.37392566667732"}, "tool": "calculate_data", "answer": [{"U": 5.85213296706841}, {"U": 4.65046636299255}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.49215677563079}, {"U": 4.28237851192289}, {"U": 3.48205825390004}, {"U": 3.84218486416411}, {"U": 3.59120067297812}, {"U": 4.04224794538619}, {"U": 2.32843082719585}, {"U": 3.10486997561481}, {"U": 2.87727568521372}, {"U": 3.40896742676009}, {"U": 3.67920543596261}, {"U": 3.50620848322923}, {"U": 3.85279288440392}, {"U": 3.79629603178194}, {"U": 4.01220582304204}, {"U": 3.343989383572}, {"U": 3.48011432112703}, {"U": 2.33181180704568}, {"U": 3.14268260342526}, {"U": 3.11768059710145}, {"U": 2.90524062132865}, {"U": 3.42470701147057}, {"U": 3.70139344282871}, {"U": 2.93806538937609}, {"U": 2.88729059693273}, {"U": 2.6839196946211}, {"U": 3.14934788904884}, {"U": 2.40585108525634}, {"U": 2.85478720486792}, {"U": 2.70098658826799}, {"U": 3.14826095889619}, {"U": 3.11768059710145}, {"U": 3.41623627215593}, {"U": 2.37801678978476}, {"U": 2.8860834773882}, {"U": 2.86988403761313}, {"U": 3.35562946489425}, {"U": 1.16038589909186}, {"U": 1.92953268679917}, {"U": 2.28527238425964}, {"U": 2.72447316312897}, {"U": 2.31258411715782}, {"U": 2.41553678255411}, {"U": 2.60964265043955}, {"U": 2.82259473753427}, {"U": 2.84902856530917}, {"U": 1.16853003679813}, {"U": 1.93984807199787}, {"U": 1.7171136135293}, {"U": 2.54799071803108}, {"U": 2.39293595125502}, {"U": 2.81528147431969}, {"U": 3.31151473244873}, {"U": 3.23426692003746}, {"U": 1.13787651624311}, {"U": 1.70976377093458}, {"U": 2.25440983867527}, {"U": 2.48600695838852}, {"U": 3.51293908917448}, {"U": 3.8794096090795}, {"U": 4.26122256613922}, {"U": 3.6358719345643}, {"U": 4.00801487120346}, {"U": 3.77914030249757}, {"U": 2.34274381608099}, {"U": 2.68851301964119}, {"U": 3.11872310943536}, {"U": 3.4701333759753}, {"U": 2.45309335470359}, {"U": 3.22368241511346}, {"U": 2.92036880782827}, {"U": 2.64929731132119}, {"U": 2.31851781517866}, {"U": 2.67760975154742}, {"U": 2.91045579581107}, {"U": 3.11934757171056}, {"U": 3.48049579180561}, {"U": 2.42810441244412}, {"U": 2.6649245450784}, {"U": 2.89022739859517}, {"U": 3.16814707762652}, {"U": 3.25061790295881}, {"U": 1.94760551339983}, {"U": 1.17218536199899}, {"U": 1.96951656210204}, {"U": 2.70679225845834}, {"U": 1.73075772232049}, {"U": 2.25303549910725}, {"U": 2.51584789414191}, {"U": 2.50045581354273}, {"U": 1.70911056771784}, {"U": 2.23273916875681}, {"U": 2.49787696724305}, {"U": 2.48938793823835}, {"U": 2.88747871945915}, {"U": 2.19163178392115}, {"U": 2.6253613326471}, {"U": 3.09010758291656}, {"U": 2.68753060200322}, {"U": 2.1718423392669}, {"U": 2.62327892079214}, {"U": 1.64135771726506}, {"U": 2.44017299507654}, {"U": 3.70032218955327}, {"U": 4.08428810441536}, {"U": 3.47676208221874}, {"U": 3.8520194917953}, {"U": 3.6209240321525}, {"U": 2.3447112641698}, {"U": 2.68727193352939}, {"U": 2.97555402839104}, {"U": 2.45045180089511}, {"U": 2.88384168394836}, {"U": 3.18138358761047}, {"U": 2.15110705635481}, {"U": 2.31569597728236}, {"U": 2.64140661646301}, {"U": 2.18470260419801}, {"U": 2.98655135774802}, {"U": 3.34788247474375}, {"U": 2.3204121045072}, {"U": 3.12092048505646}, {"U": 1.17116897779374}, {"U": 1.96785481311867}, {"U": 1.97744122352749}, {"U": 1.95555107732822}, {"U": 1.75035904444832}, {"U": 2.53867081453469}, {"U": 2.54472992757313}, {"U": 1.76046279180481}, {"U": 2.28046219577159}, {"U": 2.54073232388671}, {"U": 2.29892955711516}, {"U": 1.74315029374842}, {"U": 2.26055256172546}, {"U": 2.52790341271}, {"U": 2.28906880135531}, {"U": 2.52321080080096}, {"U": 1.7114620992981}, {"U": 2.22915438950336}, {"U": 2.50857904874607}, {"U": 2.30140389090016}, {"U": 2.83922006580665}, {"U": 3.10349302323393}, {"U": 2.83373577159893}, {"U": 2.96123581388017}, {"U": 3.52770148187273}, {"U": 4.05308066753255}, {"U": 4.02434756443474}, {"U": 4.10524547642113}, {"U": 3.2568076566406}, {"U": 3.22741089907459}, {"U": 3.73809039954498}, {"U": 2.91773770527125}, {"U": 3.42698799710342}, {"U": 3.26105347754939}, {"U": 3.7613522724994}, {"U": 3.34254449805658}, {"U": 3.40934367181293}, {"U": 3.9173842312877}, {"U": 3.67682777625369}, {"U": 3.79454022153535}, {"U": 4.29453070456706}, {"U": 4.15638867547874}, {"U": 3.69410369492993}, {"U": 4.58038549627531}, {"U": 1.74567427097789}, {"U": 1.88080633964348}, {"U": 1.30191152084287}, {"U": 2.271244191977}, {"U": 1.73102422923292}, {"U": 2.95948261644645}, {"U": 1.77998572954663}, {"U": 2.57333500284046}, {"U": 1.70974025561878}, {"U": 1.64642396141407}, {"U": 2.1463177703697}, {"U": 1.70500583870387}, {"U": 4.42997892358955}, {"U": 1.22788008107081}, {"U": 1.51526075549337}, {"U": 1.49882616256027}, {"U": 1.79034814537694}, {"U": 1.50814606605667}, {"U": 1.95663278185513}, {"U": 1.93287186164312}, {"U": 2.22382163844193}, {"U": 1.73389309776083}, {"U": 2.01547332761876}, {"U": 2.00502730177671}, {"U": 2.29010347525062}, {"U": 2.00256864486891}, {"U": 2.7228584447772}, {"U": 2.443836158716}, {"U": 2.42822982746173}, {"U": 2.71046848616214}, {"U": 0.71325000754561}, {"U": 0.99688652112983}, {"U": 1.21985874556929}, {"U": 1.4996544242391}, {"U": 1.94306967026281}, {"U": 1.95863419651121}, {"U": 1.72729835808466}, {"U": 2.00521542430313}, {"U": 2.27581661449416}, {"U": 2.44934135542666}, {"U": 1.88285478493117}, {"U": 2.39306920471124}, {"U": 1.25304669460524}, {"U": 1.52388565076716}, {"U": 1.69967308764243}, {"U": 1.96208049668272}, {"U": 1.96775030060399}, {"U": 2.44427249846478}, {"U": 2.27701850841295}, {"U": 2.74762529794298}, {"U": 3.22444013084487}, {"U": 2.03377085612599}, {"U": 2.53071218654197}, {"U": 2.54599975462647}, {"U": 2.50459189631111}, {"U": 2.99396390785154}, {"U": 1.92634766791436}, {"U": 2.41846574577796}, {"U": 2.44163355746917}, {"U": 2.40438268442512}, {"U": 2.88882693089849}, {"U": 2.23618546892832}, {"U": 2.73040947396267}, {"U": 2.7559000762926}, {"U": 2.70981267013253}, {"U": 3.19697946761327}, {"U": 1.20133912796837}, {"U": 1.20324648136124}, {"U": 1.70306974436946}, {"U": 1.69390399683222}, {"U": 1.19705150205371}, {"U": 1.68320452814207}, {"U": 1.70306974436946}, {"U": 1.68452922426561}, {"U": 2.16382622939111}, {"U": 1.19495863894729}, {"U": 1.69334746769156}, {"U": 2.17423567585302}, {"U": 2.18468170169507}, {"U": 1.66761648657787}, {"U": 2.13839310894425}, {"U": 2.17422261178868}, {"U": 2.14589188187239}, {"U": 2.60838066182481}, {"U": 1.46465057026062}, {"U": 1.96686978266783}, {"U": 2.43766469472428}, {"U": 2.46008524193554}, {"U": 1.92647308293197}, {"U": 2.41128834883245}, {"U": 2.43766469472428}, {"U": 2.41023538524708}, {"U": 2.88790722076933}, {"U": 1.23013232576212}, {"U": 1.51854767407998}, {"U": 1.96521848493592}, {"U": 1.51293796485465}, {"U": 1.49841595094016}, {"U": 1.79108757141828}, {"U": 1.93920270721973}, {"U": 2.2304555703111}, {"U": 2.01540278167136}, {"U": 2.47016808678909}, {"U": 2.29865259895127}, {"U": 2.44682260382292}, {"U": 2.74152699271153}, {"U": 2.29564786415428}, {"U": 2.27910875870651}, {"U": 2.72729761383814}, {"U": 1.23259359548278}, {"U": 1.52550820755753}, {"U": 2.00764272745652}, {"U": 2.03140103485567}, {"U": 1.90741522588047}, {"U": 1.88304552027046}, {"U": 2.18751137802997}, {"U": 2.35404161891766}, {"U": 2.65499063055827}, {"U": 2.3599909938157}, {"U": 2.66264094663269}, {"U": 2.22868669600018}, {"U": 2.54053375010882}, {"U": 2.70472552348059}, {"U": 3.0137925446988}, {"U": 2.71321716529817}, {"U": 3.02474545623704}, {"U": 1.88717899022597}, {"U": 2.3603071441726}, {"U": 2.19111705978636}, {"U": 2.66040960444431}, {"U": 2.22590927592262}, {"U": 2.70499203039302}, {"U": 2.53705870899578}, {"U": 3.01276832205496}, {"U": 1.98064714491524}, {"U": 2.2877336539803}, {"U": 2.45842610576503}, {"U": 2.76006228718964}, {"U": 2.46912818726804}, {"U": 2.77137054127779}, {"U": 1.98316850933184}, {"U": 2.46408284562197}, {"U": 2.29458967494317}, {"U": 2.7686427646447}, {"U": 1.97215027747193}, {"U": 2.45238005679092}, {"U": 2.02567636186419}, {"U": 2.31601474045213}, {"U": 1.5436280647898}, {"U": 2.00858595290149}, {"U": 1.98419534478855}, {"U": 1.82498881836691}, {"U": 2.29382673358602}, {"U": 1.81105991297322}, {"U": 1.26174997426504}, {"U": 1.71044310227999}, {"U": 1.55615911529968}, {"U": 2.00299453336623}, {"U": 1.98961693148746}, {"U": 1.83788827549103}, {"U": 2.28800799933133}, {"U": 0.01045298978153}, {"U": 0.7670661141661}, {"U": -0.02066822427667}, {"U": 0.73644656017835}, {"U": 1.40137869387465}, {"U": 1.21879271791957}, {"U": 1.64417171672276}, {"U": 1.63449385786359}, {"U": -0.02693897515734}, {"U": 0.74575601242328}, {"U": 0.5422152772753}, {"U": 1.30805946951879}, {"U": 1.17494187957361}, {"U": 1.51937593575881}, {"U": 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1.82099382749335}, {"U": 1.95814298769223}, {"U": 1.92229780797059}, {"U": 2.2709437184973}, {"U": 2.22039362796049}, {"U": 0.79971582375146}, {"U": 1.09758955464767}, {"U": 1.28709425907442}, {"U": 1.58078487657064}, {"U": 1.26993330416431}, {"U": 1.56322677410477}, {"U": 1.3000668749588}, {"U": 1.58649387268492}, {"U": 1.79025930973946}, {"U": 2.07547396229532}, {"U": 2.03963662101228}, {"U": 1.57008802069337}, {"U": 2.02231889733016}, {"U": 0.710080665538}, {"U": 1.05503467148372}, {"U": 1.17859197914874}, {"U": 1.53071293078849}, {"U": 1.01212705858272}, {"U": 1.36413043364346}, {"U": 1.47863173191165}, {"U": 1.83919206911163}, {"U": 1.21835637817079}, {"U": 1.56254221713363}, {"U": 1.67552024550038}, {"U": 2.02648894666581}, {"U": 1.5196450554841}, {"U": 1.87092990700643}, {"U": 1.97622626554436}, {"U": 2.33568922134023}, {"U": 1.49011243164901}, {"U": 1.8360645321099}, {"U": 1.93898061812604}, {"U": 2.2923818480706}, {"U": 2.24439231414339}, {"U": 2.60675287940871}, {"U": 0.79312892251389}, {"U": 1.28663962963557}, {"U": 1.11196002541587}, {"U": 1.5793896344997}, {"U": 1.3003046409297}, {"U": 1.77981328389741}, {"U": 1.61880130378471}, {"U": 2.07593643017277}, {"U": 1.57283147420366}, {"U": 2.04403398506735}, {"U": 2.3459601887202}, {"U": 0.73400619296063}, {"U": 1.07179325321231}, {"U": 1.20516951163132}, {"U": 1.54875440363475}, {"U": 0.82858479311835}, {"U": 1.30861599865945}, {"U": 0.840943397979}, {"U": 1.3489656677637}, {"U": 1.62569129131485}, {"U": 0.83668190019301}, {"U": 1.34527115036984}, {"U": 1.61814026212938}, {"U": 1.12397373897809}, {"U": 1.62989792003063}, {"U": 0.63583758792372}, {"U": 0.06896954674966}, {"U": 0.35578062796722}, {"U": 0.33991040261339}, {"U": 0.63083405128352}, {"U": 0.79752889938182}, {"U": 0.77326109347363}, {"U": 1.06460540501534}, {"U": 0.36796156155292}, {"U": 0.59469623652079}, {"U": 0.87487338586917}, {"U": 0.8658356661624}, {"U": 1.14969688165318}, {"U": 0.80298967827374}, {"U": 1.30139157108235}, {"U": 1.28701848750127}, {"U": 1.56766333035284}, {"U": 0.64885200881398}, {"U": 0.86725964917489}, {"U": 1.15516288617083}, {"U": 1.29515217395608}, {"U": 1.59204348721432}, {"U": 0.84557852800497}, {"U": 1.29361583999031}, {"U": 1.14350712797138}, {"U": 1.58293260874727}, {"U": 1.31354115091365}, {"U": 1.58801714258635}, {"U": 1.11684859828993}, {"U": 1.55633156094889}, {"U": 1.85256444536466}, {"U": 0.11299021793197}, {"U": 0.55543349756918}, {"U": 0.39066690536668}, {"U": 0.8340429591974}, {"U": 0.33676457592158}, {"U": 0.62359655964208}, {"U": 0.81073666842424}, {"U": -0.44554817582227}, {"U": -0.16258315514485}, {"U": 0.06106317501428}, {"U": 0.33990517698765}, {"U": 0.78343277396465}, {"U": 0.79941273745889}, {"U": 0.08059656400757}, {"U": 0.35932882784053}, {"U": 0.86475657444835}, {"U": 0.85739105497643}, {"U": 0.81792974224694}, {"U": 1.30886160306894}, {"U": 0.79834932262205}, {"U": 1.30474380999064}, {"U": 1.31076373083608}, {"U": 0.35315475103594}, {"U": 0.64056416640003}, {"U": 1.14598668738211}, {"U": 1.10216720279056}, {"U": 1.5928508463902}, {"U": 0.83737690841562}, {"U": 1.12472100345804}, {"U": 1.30045618407598}, {"U": 1.58693282524657}, {"U": 1.57058445513809}, {"U": 1.10532086792096}, {"U": 1.57281841013933}, {"U": 0.72422904721251}, {"U": 1.53072338203995}, {"U": 1.51704791949436}, {"U": 0.63216919865853}, {"U": 0.34959871272402}, {"U": 0.08367445756483}, {"U": 0.52587735841829}, {"U": 0.58956205923724}, {"U": 0.85813048101778}, {"U": 0.37046724909232}, {"U": 0.81138725882811}, {"U": 0.87010500238699}, {"U": 1.29798446310385}, {"U": 1.57700936197791}, {"U": 0.36226562950298}, {"U": 0.80512434638604}, {"U": 0.8676385070406}, {"U": 1.30082720350309}, {"U": 0.65170258765182}, {"U": 1.09612376662931}, {"U": 1.15108167247266}, {"U": 1.58341075350193}, {"U": 0.84596783712214}, {"U": 1.13269792114083}, {"U": 0.08537017311548}, {"U": 0.35609155269838}, {"U": 0.53242768027572}, {"U": 0.79471489992412}, {"U": 1.777190019779}, {"U": 1.84216283734135}, {"U": 2.05515411662908}, {"U": 2.07187611897753}, {"U": 2.16404309285906}, {"U": 2.37747071189557}, {"U": 1.97574812078971}, {"U": 2.28544221709599}, {"U": 2.59587312663074}, {"U": 0.02272537181758}, {"U": 0.2923624340607}, {"U": 0.02470065834499}, {"U": 0.49344973792662}, {"U": 0.75029446837317}, {"U": 0.02821227883816}, {"U": 0.51782989478809}, {"U": 0.79154817072939}, {"U": 0.51016651464934}, {"U": 0.97053107774094}, {"U": 1.23259620829565}, {"U": 0.51314512131766}, {"U": 0.7839265955965}, {"U": 0.52253034513573}, {"U": 0.99154331881692}, {"U": 1.25255809859912}, {"U": 1.00063068196816}, {"U": 1.27568671809733}, {"U": 0.51222279837563}, {"U": 0.7826306404145}, {"U": 1.24278095285101}, {"U": 1.27492377674018}, {"U": 1.46573227478753}, {"U": 1.72787840254112}, {"U": 1.25718800299935}, {"U": 1.4641384589387}, {"U": 1.72453138925856}, {"U": 1.73750400514295}, {"U": 1.04952424914733}, {"U": 1.51195032159095}, {"U": 1.54291737968999}, {"U": 2.00154964785081}, {"U": 1.99893160935813}, {"U": 0.74577952773909}, {"U": 0.85288133996808}, {"U": 1.05577148471219}, {"U": 1.22325540229632}, {"U": 1.52839797858837}, {"U": 1.2517847059905}, {"U": 1.35575898121776}, {"U": 1.56485978214661}, {"U": 1.22768412010579}, {"U": 1.53960694578757}, {"U": 1.70899037832597}, {"U": 2.01559090419778}, {"U": 1.70760297469362}, {"U": 1.8083974566618}, {"U": 2.02033054673842}, {"U": 1.80642739576012}, {"U": 2.31184730392935}, {"U": 2.09894747309196}, {"U": 2.30945135453036}, {"U": 0.78695484570929}, {"U": 1.26177087676797}, {"U": 1.09546795059971}, {"U": 1.56442605521069}, {"U": 1.27204968258654}, {"U": 1.74523270560338}, {"U": 1.58354661977101}, {"U": 1.82557670126198}, {"U": 2.05182800584945}, {"U": 1.57562457115843}, {"U": 2.0052023602388}, {"U": 1.88527424964596}, {"U": 0.77189981796995}, {"U": 1.26158797986729}, {"U": 1.28404249364582}, {"U": 1.24731418317516}, {"U": 1.7286230542082}, {"U": 1.66401341763435}, {"U": 1.68445345269247}, {"U": 1.68175702981378}, {"U": 1.66775235284695}, {"U": 1.69638355624295}, {"U": 2.15033105093333}, {"U": 1.66656613580536}, {"U": 2.16992976024829}, {"U": 0.89750818373552}, {"U": 1.39497991516349}, {"U": 1.41447149915091}, {"U": 1.41040334951708}, {"U": 1.89166257710565}, {"U": 1.91104442295265}, {"U": 1.91333063421123}, {"U": 1.89792548954772}, {"U": 1.93441342123462}, {"U": 2.3823932513369}, {"U": 1.87871086372419}, {"U": 2.38514454328579}, {"U": 0.05679645160256}, {"U": 0.341940558211}, {"U": 0.32816580877646}, {"U": 0.56508000267395}, {"U": 0.84792744677235}, {"U": 0.82872065938743}, {"U": 0.56060164142}, {"U": 0.84336024988093}, {"U": 1.11763766777575}, {"U": 0.82945747261591}, {"U": 1.10670304592758}, {"U": 0.83144582320765}, {"U": 1.10423132495545}, {"U": 0.32545370902057}, {"U": 0.32289576522383}, {"U": 1.10490543067512}, {"U": 0.34283675302437}, {"U": 0.61549161412881}, {"U": 0.33741516632545}, {"U": 0.83953247903085}, {"U": 1.12195403463194}, {"U": 1.11910084298124}, {"U": 1.61456854694026}, {"U": 1.60701229212905}, {"U": 1.33528236677951}, {"U": 1.34363552951513}, {"U": 1.61223269223721}, {"U": 1.34519276598383}, {"U": 1.62650648892934}, {"U": 1.62129392725978}, {"U": 1.88609206007332}, {"U": 0.7265936428571}, {"U": 1.23522992366553}, {"U": 1.5090683889987}, {"U": -0.43341427286817}, {"U": 0.06862465545122}, {"U": 0.57407591737485}, {"U": 1.11634693821948}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.52441679602566}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.4278.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.4278"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -1.77790756800166.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-1.77790756800166'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below -6.789240837097168 and heat capacity (Cv) exceeds 15.291999816894531?", "refer_dataset": "table60", "column names": ["homo", "Cv", "zpve"], "condition_column": {"homo": "<", "Cv": ">"}, "answer_column": {"zpve": "avg"}, "condition": {"homo": "<-6.789240837097168", "Cv": ">15.291999816894531"}, "tool": "calculate_data", "answer": 3.010792058529558, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below {} and heat capacity (Cv) exceeds {}?"}
{"question": "What is the average Power(W) for materials where X is O, A mole is greater than 0.478, and Wave length(<nm) below 300.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='O'", "A mole": ">0.478", "Wave length(<nm)": "<300.0"}, "tool": "calculate_data", "answer": 284.2352941176471, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below -1.57213091?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<-1.57213091"}, "tool": "calculate_data", "answer": 27.176800780182003, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Null\", Band_gap_HSE_optical < 0.65611, and Magnetic_ordering \"NM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Null'", "Band_gap_HSE_optical": "<0.65611", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "What is the average BandGap(eV) for materials where B is Fe?", "refer_dataset": "table4", "column names": ["B", "BandGap(eV)"], "condition_column": {"B": "="}, "answer_column": {"BandGap(eV)": "avg"}, "condition": {"B": "=='Fe'"}, "tool": "calculate_data", "answer": 1.901111111111111, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average BandGap(eV) for materials where B is {}?"}
{"question": "What is the maximum light intensity (I) recorded for organic compound Nitrobenzene with nanoparticle dose (D) ≥ 1.875 g/L and reaction rate (-log(k)) > 0.5616?", "refer_dataset": "table9", "column names": ["OC", "D, g/L", "-log(k), min-1", "I, mW/cm2"], "condition_column": {"OC": "=", "D, g/L": ">=", "-log(k), min-1": ">"}, "answer_column": {"I, mW/cm2": "max"}, "condition": {"OC": "=='Nitrobenzene'", "D, g/L": ">=1.875", "-log(k), min-1": ">0.5616"}, "tool": "calculate_data", "answer": 0.176, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum light intensity (I) recorded for organic compound {} with nanoparticle dose (D) ≥ {} g/L and reaction rate (-log(k)) > {}?"}
{"question": "What is the average degradation rate for experiments using Dopant S with a Calcination Temperature above 550°C?", "refer_dataset": "table8", "column names": ["Dopant", "Calcination temperature(°C)", "Degradation rate(%)"], "condition_column": {"Dopant": "=", "Calcination temperature(°C)": ">"}, "answer_column": {"Degradation rate(%)": "avg"}, "condition": {"Dopant": "=='S'", "Calcination temperature(°C)": ">550"}, "tool": "calculate_data", "answer": 53.725, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average degradation rate for experiments using Dopant {} with a Calcination Temperature above {}°C?"}
{"question": "Calculate the average reaction temperature for noble metal none, synthesis time 72.0 hours, and additional components containing TiO2.", "refer_dataset": "table7", "column names": ["Noble_Metal", "Synthesis_Time", "Additional", "Rxn_Temp"], "condition_column": {"Noble_Metal": "=", "Synthesis_Time": "=", "Additional": "="}, "answer_column": {"Rxn_Temp": "avg"}, "condition": {"Noble_Metal": "=='none'", "Synthesis_Time": "=='72.0'", "Additional": "=='TiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average reaction temperature for noble metal {}, synthesis time {} hours, and additional components containing {}."}
{"question": "What is the average calcination temperature (CT) for samples referenced in study [26]?", "refer_dataset": "table11", "column names": ["Ref.", "CT (℃)"], "condition_column": {"Ref.": "="}, "answer_column": {"CT (℃)": "avg"}, "condition": {"Ref.": "=='[26]'"}, "tool": "calculate_data", "answer": 900.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature (CT) for samples referenced in study {}?"}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 300°C and references in study [41]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">300", "Ref.": "=='[41]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "Calculate the total final energy for all materials with formula MgF2 and indirect band gap greater than 6.508.", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "final_energy"], "condition_column": {"formula": "=", "indir_gap": ">"}, "answer_column": {"final_energy": "sum"}, "condition": {"formula": "=='MgF2'", "indir_gap": ">6.508"}, "tool": "calculate_data", "answer": -2447.847475297931, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total final energy for all materials with formula {} and indirect band gap greater than {}."}
{"question": "Calculate the average overpotential in alkaline conditions for articles from South Korea country.", "refer_dataset": "table13", "column names": ["Country", "Alkaline_OVP"], "condition_column": {"Country": "="}, "answer_column": {"Alkaline_OVP": "avg"}, "condition": {"Country": "=='South Korea'"}, "tool": "calculate_data", "answer": 112.19285714285714, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average overpotential in alkaline conditions for articles from {} country."}
{"question": "How many unique surfaces are recorded for the element Mn?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='Mn'"}, "tool": "calculate_data", "answer": 12, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than 0.5429516705?", "refer_dataset": "table51", "column names": ["b3lyp_homo", "b3lyp_scharber_voc"], "condition_column": {"b3lyp_scharber_voc": ">"}, "answer_column": {"b3lyp_homo": "avg"}, "condition": {"b3lyp_scharber_voc": ">0.5429516705"}, "tool": "calculate_data", "answer": -0.19631326644370087, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than {}?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Indirect\", Band_gap_HSE_optical < 2.987947, and Magnetic_ordering \"NM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Indirect'", "Band_gap_HSE_optical": "<2.987947", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 1.150497}, {"Band_gap_GGA": 1.119908}, {"Band_gap_GGA": 1.173072}, {"Band_gap_GGA": 1.426179}, {"Band_gap_GGA": 0.846528}, {"Band_gap_GGA": 1.082826}, {"Band_gap_GGA": 0.812729}, {"Band_gap_GGA": 0.121138}, {"Band_gap_GGA": 1.327256}, {"Band_gap_GGA": 0.763006}, {"Band_gap_GGA": 1.472881}, {"Band_gap_GGA": 0.736109}, {"Band_gap_GGA": 1.199719}, {"Band_gap_GGA": 0.476453}, 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{"Band_gap_GGA": 0.853574}, {"Band_gap_GGA": 1.201798}, {"Band_gap_GGA": 0.044612}, {"Band_gap_GGA": 1.263702}, {"Band_gap_GGA": 1.68655}, {"Band_gap_GGA": 1.8878}, {"Band_gap_GGA": 1.207162}, {"Band_gap_GGA": 0.3737000000000003}, {"Band_gap_GGA": 1.429847}, {"Band_gap_GGA": 0.645766}, {"Band_gap_GGA": 1.074611}, {"Band_gap_GGA": 1.409758}, {"Band_gap_GGA": 0.444592}, {"Band_gap_GGA": 0.924272}, {"Band_gap_GGA": 1.215515}, {"Band_gap_GGA": 0.811707}, {"Band_gap_GGA": 1.235843}, {"Band_gap_GGA": 1.562761}, {"Band_gap_GGA": 0.892895}, {"Band_gap_GGA": 0.477598}, {"Band_gap_GGA": 1.70482}, {"Band_gap_GGA": 1.666039}, {"Band_gap_GGA": 1.381963}, {"Band_gap_GGA": 1.27965}, {"Band_gap_GGA": 0.380005}, {"Band_gap_GGA": 0.957195}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is 0.70212317856886.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='0.70212317856886'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than 7.095.", "refer_dataset": "table66", "column names": ["scf_vbm", "efermi"], "condition_column": {"scf_vbm": ">"}, "answer_column": {"efermi": "min"}, "condition": {"scf_vbm": ">7.095"}, "tool": "calculate_data", "answer": 7.27774779, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than {}."}
{"question": "What Light Wavelength achieves Degradation Rate above 79.0% within 20 minutes of Illumination Time for Dopant C?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Degradation rate(%)", "Illumination time(min)", "Dopant"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "Dopant": "="}, "answer_column": {"Light wavelength(nm)": ""}, "condition": {"Degradation rate(%)": ">79.0", "Illumination time(min)": "<20", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Light Wavelength achieves Degradation Rate above {}% within {} minutes of Illumination Time for Dopant {}?"}
{"question": "What is the highest Bandgap (Eg) observed in experiments where the Main product is CO?", "refer_dataset": "table10", "column names": ["Main product", "Eg(eV)"], "condition_column": {"Main product": "="}, "answer_column": {"Eg(eV)": "max"}, "condition": {"Main product": "=='CO'"}, "tool": "calculate_data", "answer": 3.4, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Bandgap (Eg) observed in experiments where the Main product is {}?"}
{"question": "What is the minimum Tc recorded for materials where formula contains Rh1Te2?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "min"}, "condition": {"formula": "=='Rh1Te2'"}, "tool": "calculate_data", "answer": 0.755, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Tc recorded for materials where formula contains {}?"}
{"question": "Find the median Band_gap_GGA where Band_gap_HSE_optical < 2.958342.", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": "<"}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Band_gap_HSE_optical": "<2.958342"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.137147}, {"Band_gap_GGA": 1.07639}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.726702}, {"Band_gap_GGA": 0.684651}, {"Band_gap_GGA": 1.173072}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.426179}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.846528}, {"Band_gap_GGA": 1.082826}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.29665}, {"Band_gap_GGA": 0.812729}, {"Band_gap_GGA": 1.253241}, {"Band_gap_GGA": 1.521543}, {"Band_gap_GGA": 0.121138}, {"Band_gap_GGA": 1.327256}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.763006}, {"Band_gap_GGA": 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{"Band_gap_GGA": 1.256404}, {"Band_gap_GGA": 1.550506}, {"Band_gap_GGA": 1.77982}, {"Band_gap_GGA": 1.379217}, {"Band_gap_GGA": 1.461383}, {"Band_gap_GGA": 0.962026}, {"Band_gap_GGA": 0.498645}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.064657}, {"Band_gap_GGA": 1.76803}, {"Band_gap_GGA": 1.381861}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.321152}, {"Band_gap_GGA": 0.707323}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.417882}, {"Band_gap_GGA": 0.780584}, {"Band_gap_GGA": 0.3010500000000005}, {"Band_gap_GGA": 1.014796}, {"Band_gap_GGA": 1.1879239999999998}, {"Band_gap_GGA": 1.082056}, {"Band_gap_GGA": 0.619668}, {"Band_gap_GGA": 1.669786}, {"Band_gap_GGA": 1.088248}, {"Band_gap_GGA": 0.7087529999999989}, {"Band_gap_GGA": 0.010004}, {"Band_gap_GGA": 0.0510400000000004}, {"Band_gap_GGA": 1.7838190000000005}, {"Band_gap_GGA": 0.4122590000000006}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.122611}, {"Band_gap_GGA": 0.599232}, {"Band_gap_GGA": 0.795217}, {"Band_gap_GGA": 0.441676}, {"Band_gap_GGA": 0.569089}, {"Band_gap_GGA": 0.4406449999999999}, {"Band_gap_GGA": 0.593264}, {"Band_gap_GGA": 0.1285660000000001}, {"Band_gap_GGA": 1.063134}, {"Band_gap_GGA": 0.04091}, {"Band_gap_GGA": 0.114593}, {"Band_gap_GGA": 0.046088}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.9551550000000002}, {"Band_gap_GGA": 0.8245889999999998}, {"Band_gap_GGA": 0.848223}, {"Band_gap_GGA": 0.07145}, {"Band_gap_GGA": 0.776494}, {"Band_gap_GGA": 1.031638}, {"Band_gap_GGA": 0.013837}, {"Band_gap_GGA": 1.069505}, {"Band_gap_GGA": 1.478028}, {"Band_gap_GGA": 1.016602}, {"Band_gap_GGA": 0.813493}, {"Band_gap_GGA": 1.918516}, {"Band_gap_GGA": 0.942312}, {"Band_gap_GGA": 1.052641}, {"Band_gap_GGA": 0.974305}, {"Band_gap_GGA": 1.702772}, {"Band_gap_GGA": 1.068715}, {"Band_gap_GGA": 0.798378}, {"Band_gap_GGA": 1.400749}, {"Band_gap_GGA": 1.123257}, {"Band_gap_GGA": 1.027479}, {"Band_gap_GGA": 2.000535}, {"Band_gap_GGA": 0.731232}, {"Band_gap_GGA": 1.794819}, {"Band_gap_GGA": 1.794836}, {"Band_gap_GGA": 2.147943}, {"Band_gap_GGA": 1.105534}, {"Band_gap_GGA": 0.140116}, {"Band_gap_GGA": 2.029843}, {"Band_gap_GGA": 1.48767}, {"Band_gap_GGA": 1.613056}, {"Band_gap_GGA": 2.145223}, {"Band_gap_GGA": 1.204301}, {"Band_gap_GGA": 0.868662}, {"Band_gap_GGA": 0.429583}, {"Band_gap_GGA": 2.28785}, {"Band_gap_GGA": 1.009335}, {"Band_gap_GGA": 1.325181}, {"Band_gap_GGA": 0.8734719999999996}, {"Band_gap_GGA": 0.611021}, {"Band_gap_GGA": 2.570189}, {"Band_gap_GGA": 0.430945}, {"Band_gap_GGA": 1.894755}, {"Band_gap_GGA": 0.499722}, {"Band_gap_GGA": 1.13968}, {"Band_gap_GGA": 1.476618}, {"Band_gap_GGA": 1.4191330000000002}, {"Band_gap_GGA": 0.731782}, {"Band_gap_GGA": 0.138691}, {"Band_gap_GGA": 1.911492}, {"Band_gap_GGA": 1.004588}, {"Band_gap_GGA": 1.287787}, {"Band_gap_GGA": 0.8474620000000002}, {"Band_gap_GGA": 1.7024890000000004}, {"Band_gap_GGA": 1.190505}, {"Band_gap_GGA": 0.835267}, {"Band_gap_GGA": 0.822738}, {"Band_gap_GGA": 0.357758}, {"Band_gap_GGA": 2.102841}, {"Band_gap_GGA": 0.686362}, {"Band_gap_GGA": 0.925348}, {"Band_gap_GGA": 0.077827}, {"Band_gap_GGA": 0.208789}, {"Band_gap_GGA": 1.645783}, {"Band_gap_GGA": 1.129361}, {"Band_gap_GGA": 1.654697}, {"Band_gap_GGA": 1.667675}, {"Band_gap_GGA": 1.614546}, {"Band_gap_GGA": 0.927177}, {"Band_gap_GGA": 1.457538}, {"Band_gap_GGA": 0.952176}, {"Band_gap_GGA": 0.876747}, {"Band_gap_GGA": 1.211805}, {"Band_gap_GGA": 1.876854}, {"Band_gap_GGA": 1.490522}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.330583}, {"Band_gap_GGA": 1.243413}, {"Band_gap_GGA": 1.997233}, {"Band_gap_GGA": 2.029982}, {"Band_gap_GGA": 0.949497}, {"Band_gap_GGA": 2.147805}, {"Band_gap_GGA": 2.14552}, {"Band_gap_GGA": 0.903644}, {"Band_gap_GGA": 1.284232}, {"Band_gap_GGA": 1.125111}, {"Band_gap_GGA": 0.96445}, {"Band_gap_GGA": 0.962134}, {"Band_gap_GGA": 0.4111180000000001}, {"Band_gap_GGA": 1.520556}, {"Band_gap_GGA": 1.032317}, {"Band_gap_GGA": 1.55756}, {"Band_gap_GGA": 0.910215}, {"Band_gap_GGA": 1.382571}, {"Band_gap_GGA": 0.606807}, {"Band_gap_GGA": 1.743149}, {"Band_gap_GGA": 0.823484}, {"Band_gap_GGA": 0.727435}, {"Band_gap_GGA": 0.188778}, {"Band_gap_GGA": 1.12308}, {"Band_gap_GGA": 0.999406}, {"Band_gap_GGA": 1.439385}, {"Band_gap_GGA": 1.03154}, {"Band_gap_GGA": 0.827258}, {"Band_gap_GGA": 0.275451}, {"Band_gap_GGA": 0.689105}, {"Band_gap_GGA": 0.394198}, {"Band_gap_GGA": 1.463383}, {"Band_gap_GGA": 1.185585}, {"Band_gap_GGA": 0.99778}, {"Band_gap_GGA": 0.853574}, {"Band_gap_GGA": 1.034119}, {"Band_gap_GGA": 1.201798}, {"Band_gap_GGA": 0.044612}, {"Band_gap_GGA": 0.174608}, {"Band_gap_GGA": 1.263702}, {"Band_gap_GGA": 1.68655}, {"Band_gap_GGA": 1.8878}, {"Band_gap_GGA": 1.207162}, {"Band_gap_GGA": 0.3737000000000003}, {"Band_gap_GGA": 0.970382}, {"Band_gap_GGA": 0.93313}, {"Band_gap_GGA": 1.666143}, {"Band_gap_GGA": 1.429847}, {"Band_gap_GGA": 0.645766}, {"Band_gap_GGA": 0.423326}, {"Band_gap_GGA": 1.549965}, {"Band_gap_GGA": 1.074611}, {"Band_gap_GGA": 0.855654}, {"Band_gap_GGA": 1.769321}, {"Band_gap_GGA": 1.109291}, {"Band_gap_GGA": 0.129031}, {"Band_gap_GGA": 0.818666}, {"Band_gap_GGA": 1.573899}, {"Band_gap_GGA": 1.612963}, {"Band_gap_GGA": 1.51003}, {"Band_gap_GGA": 0.90871}, {"Band_gap_GGA": 0.654414}, {"Band_gap_GGA": 0.662021}, {"Band_gap_GGA": 0.444592}, {"Band_gap_GGA": 0.140697}, {"Band_gap_GGA": 0.060698}, {"Band_gap_GGA": 0.924272}, {"Band_gap_GGA": 1.215515}, {"Band_gap_GGA": 0.811707}, {"Band_gap_GGA": 0.600486}, {"Band_gap_GGA": 1.732283}, {"Band_gap_GGA": 1.634283}, {"Band_gap_GGA": 1.634473}, {"Band_gap_GGA": 1.235843}, {"Band_gap_GGA": 0.13966}, {"Band_gap_GGA": 1.315377}, {"Band_gap_GGA": 1.181219}, {"Band_gap_GGA": 1.544537}, {"Band_gap_GGA": 1.562761}, {"Band_gap_GGA": 0.97917}, {"Band_gap_GGA": 0.892895}, {"Band_gap_GGA": 0.456143}, {"Band_gap_GGA": 0.568376}, {"Band_gap_GGA": 1.420798}, {"Band_gap_GGA": 1.175897}, {"Band_gap_GGA": 0.477598}, {"Band_gap_GGA": 1.015622}, {"Band_gap_GGA": 1.607063}, {"Band_gap_GGA": 0.093388}, {"Band_gap_GGA": 0.16859}, {"Band_gap_GGA": 0.332569}, {"Band_gap_GGA": 1.783169}, {"Band_gap_GGA": 0.1090209999999999}, {"Band_gap_GGA": 1.381963}, {"Band_gap_GGA": 0.987243}, {"Band_gap_GGA": 0.768662}, {"Band_gap_GGA": 0.852572}, {"Band_gap_GGA": 0.204799}, {"Band_gap_GGA": 0.5355}, {"Band_gap_GGA": 0.775819}, {"Band_gap_GGA": 1.27965}, {"Band_gap_GGA": 0.380005}, {"Band_gap_GGA": 0.957195}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Band_gap_GGA where Band_gap_HSE_optical < {}."}
{"question": "What is the maximum pH observed where Degradation efficiency (%) is greater than 4.1?", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "pH"], "condition_column": {"pH": ">"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"pH": ">4.1"}, "tool": "calculate_data", "answer": 99.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH observed where Degradation efficiency (%) is greater than {}?"}
{"question": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding 0.0014083?", "refer_dataset": "table54", "column names": ["mu_b", "shear modulus"], "condition_column": {"mu_b": ">"}, "answer_column": {"shear modulus": "max"}, "condition": {"mu_b": ">0.0014083"}, "tool": "calculate_data", "answer": 213.9683850846991, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding {}?"}
{"question": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than 0.1221254606249986.", "refer_dataset": "table56", "column names": ["gap pbe", "e_hull"], "condition_column": {"e_hull": "<"}, "answer_column": {"gap pbe": "max"}, "condition": {"e_hull": "<0.1221254606249986"}, "tool": "calculate_data", "answer": 7.7947, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than {}."}
{"question": "Calculate the maximum formation energy per atom for materials with space group number 221.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "max"}, "condition": {"spacegroup_number": "=='221'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum formation energy per atom for materials with space group number {}."}
{"question": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above 6, support material La2O3, and argon pressure 0.7 atm.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Support", "PAr (atm)", "C2 selectivity(%)"], "condition_column": {"CH4/O2 (mol/mol)": ">", "Support": "=", "PAr (atm)": "="}, "answer_column": {"C2 selectivity(%)": "min"}, "condition": {"CH4/O2 (mol/mol)": ">6", "Support": "=='La2O3'", "PAr (atm)": "=='0.7'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above {}, support material {}, and argon pressure {} atm."}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than -1.73819887423718?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">-1.73819887423718"}, "tool": "calculate_data", "answer": -0.06082781412803505, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "Calculate the minimum CH4-pressure when C2-selectivity is greater than 50.0%?", "refer_dataset": "table20", "column names": ["CH4-pressure", "C2-selectivity"], "condition_column": {"C2-selectivity": ">"}, "answer_column": {"CH4-pressure": "min"}, "condition": {"C2-selectivity": ">50.0"}, "tool": "calculate_data", "answer": 0.97, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum CH4-pressure when C2-selectivity is greater than {}%?"}
{"question": "How many references document samples calcined for over 7.0 hours?", "refer_dataset": "table1", "column names": ["Calcination time(h)", "Ref"], "condition_column": {"Calcination time(h)": ">"}, "answer_column": {"Ref": "count"}, "condition": {"Calcination time(h)": ">7.0"}, "tool": "calculate_data", "answer": 74, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document samples calcined for over {} hours?"}
{"question": "What is the highest Rhodium percentage observed in alloys with Onset potential below 0.594615V?", "refer_dataset": "table15", "column names": ["Rh", "Onset"], "condition_column": {"Onset": "<"}, "answer_column": {"Rh": "max"}, "condition": {"Onset": "<0.594615"}, "tool": "calculate_data", "answer": 98.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Rhodium percentage observed in alloys with Onset potential below {}V?"}
{"question": "Materials with bandgap of 2.6526000000000005, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='2.6526000000000005'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "Determine the maximum irradiation time (h) for Bi type BiOCl, Main product CH4, and loading > 0.142857143 g/l.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Main product", "loading (g/l)", "irradiation time(h)"], "condition_column": {"Bi type in photocatalyst": "=", "Main product": "=", "loading (g/l)": ">"}, "answer_column": {"irradiation time(h)": "max"}, "condition": {"Bi type in photocatalyst": "=='BiOCl'", "Main product": "=='CH4'", "loading (g/l)": ">0.142857143"}, "tool": "calculate_data", "answer": 8.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum irradiation time (h) for Bi type {}, Main product {}, and loading > {} g/l."}
{"question": "What is the median Anion2-mol when CH4-pressure is 0.4?", "refer_dataset": "table20", "column names": ["Anion2-mol", "CH4-pressure"], "condition_column": {"CH4-pressure": "="}, "answer_column": {"Anion2-mol": "median"}, "condition": {"CH4-pressure": "=='0.4'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Anion2-mol when CH4-pressure is {}?"}
{"question": "How many unique surfaces are recorded for the element V(?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='V('"}, "tool": "calculate_data", "answer": 2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the Combustion method?", "refer_dataset": "table1", "column names": ["Preparation method", "RH2(µmol h-1 g-1)"], "condition_column": {"Preparation method": "="}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Preparation method": "=='Combustion'"}, "tool": "calculate_data", "answer": 1986.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the {} method?"}
{"question": "Calculate the median Palladium percentage for alloys where Gold percentage is under 11.6%.", "refer_dataset": "table15", "column names": ["Pd", "Au"], "condition_column": {"Au": "<"}, "answer_column": {"Pd": "median"}, "condition": {"Au": "<11.6"}, "tool": "calculate_data", "answer": [{"Pd": 15.2}, {"Pd": 16.8}, {"Pd": 15.8}, {"Pd": 7.6}, {"Pd": 12.8}, {"Pd": 8.7}, {"Pd": 6.0}, {"Pd": 4.8}, {"Pd": 7.0}, {"Pd": 0.3}, {"Pd": 2.3}, {"Pd": 4.7}, {"Pd": 9.6}, {"Pd": 8.0}, {"Pd": 10.2}, {"Pd": 25.1}, {"Pd": 20.1}, {"Pd": 25.2}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.6}, {"Pd": 0.8}, {"Pd": 2.4}, {"Pd": 1.2}, {"Pd": 2.6}, {"Pd": 5.8}, {"Pd": 7.5}, {"Pd": 9.4}, {"Pd": 39.7}, {"Pd": 42.7}, {"Pd": 40.2}, {"Pd": 9.7}, {"Pd": 9.8}, {"Pd": 9.1}, {"Pd": 8.6}, {"Pd": 3.1}, {"Pd": 2.9}, {"Pd": 3.3}, {"Pd": 3.3}, {"Pd": 2.6}, {"Pd": 1.1}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 5.2}, {"Pd": 5.0}, {"Pd": 9.8}, {"Pd": 47.1}, {"Pd": 46.9}, {"Pd": 49.8}, {"Pd": 15.8}, {"Pd": 17.8}, {"Pd": 16.8}, {"Pd": 4.3}, {"Pd": 7.0}, {"Pd": 5.0}, {"Pd": 34.9}, {"Pd": 39.2}, {"Pd": 35.1}, {"Pd": 72.8}, {"Pd": 72.0}, {"Pd": 70.7}, {"Pd": 10.2}, {"Pd": 9.6}, {"Pd": 10.2}, {"Pd": 3.4}, {"Pd": 4.0}, {"Pd": 2.4}, {"Pd": 10.2}, {"Pd": 10.2}, {"Pd": 8.0}, {"Pd": 29.2}, {"Pd": 32.1}, {"Pd": 28.2}, {"Pd": 3.1}, {"Pd": 0.0}, {"Pd": 1.9}, {"Pd": 13.2}, {"Pd": 17.6}, {"Pd": 15.3}, {"Pd": 5.7}, {"Pd": 1.3}, {"Pd": 0.6}, {"Pd": 15.3}, {"Pd": 10.7}, {"Pd": 10.2}, {"Pd": 72.8}, {"Pd": 73.5}, {"Pd": 75.3}, {"Pd": 1.6}, {"Pd": 1.9}, {"Pd": 3.0}, {"Pd": 5.4}, {"Pd": 4.3}, {"Pd": 2.1}, {"Pd": 8.1}, {"Pd": 0.0}, {"Pd": 3.1}, {"Pd": 5.8}, {"Pd": 7.5}, {"Pd": 9.1}, {"Pd": 4.1}, {"Pd": 1.7}, {"Pd": 3.3}, {"Pd": 97.9}, {"Pd": 97.7}, {"Pd": 98.1}, {"Pd": 3.1}, {"Pd": 4.0}, {"Pd": 3.4}, {"Pd": 3.3}, {"Pd": 2.6}, {"Pd": 1.7}, {"Pd": 9.4}, {"Pd": 5.8}, {"Pd": 9.1}, {"Pd": 28.7}, {"Pd": 25.8}, {"Pd": 41.7}, {"Pd": 43.3}, {"Pd": 42.1}, {"Pd": 23.4}, {"Pd": 23.1}, {"Pd": 23.8}, {"Pd": 0.3}, {"Pd": 0.5}, {"Pd": 0.0}, {"Pd": 17.6}, {"Pd": 23.0}, {"Pd": 15.3}, {"Pd": 25.0}, {"Pd": 26.3}, {"Pd": 26.7}, {"Pd": 46.6}, {"Pd": 44.7}, {"Pd": 44.6}, {"Pd": 5.4}, {"Pd": 2.1}, {"Pd": 4.9}, {"Pd": 2.9}, {"Pd": 2.9}, {"Pd": 8.6}, {"Pd": 49.8}, {"Pd": 46.9}, {"Pd": 48.2}, {"Pd": 2.9}, {"Pd": 0.8}, {"Pd": 8.0}, {"Pd": 9.6}, {"Pd": 10.2}, {"Pd": 26.3}, {"Pd": 25.0}, {"Pd": 30.0}, {"Pd": 2.4}, {"Pd": 2.1}, {"Pd": 1.2}, {"Pd": 19.3}, {"Pd": 23.3}, {"Pd": 12.9}, {"Pd": 44.6}, {"Pd": 46.6}, {"Pd": 45.4}, {"Pd": 5.7}, {"Pd": 1.3}, {"Pd": 0.0}, {"Pd": 48.9}, {"Pd": 39.3}, {"Pd": 38.6}, {"Pd": 1.7}, {"Pd": 4.1}, {"Pd": 2.2}, {"Pd": 15.2}, {"Pd": 17.8}, {"Pd": 15.8}, {"Pd": 0.8}, {"Pd": 0.6}, {"Pd": 2.9}, {"Pd": 42.5}, {"Pd": 41.7}, {"Pd": 43.2}, {"Pd": 42.1}, {"Pd": 10.2}, {"Pd": 15.3}, {"Pd": 13.1}, {"Pd": 42.5}, {"Pd": 29.2}, {"Pd": 28.2}, {"Pd": 26.8}, {"Pd": 98.1}, {"Pd": 98.8}, {"Pd": 97.9}, {"Pd": 22.1}, {"Pd": 23.9}, {"Pd": 24.6}, {"Pd": 25.2}, {"Pd": 20.1}, {"Pd": 25.2}, {"Pd": 29.2}, {"Pd": 26.8}, {"Pd": 32.1}, {"Pd": 45.4}, {"Pd": 46.6}, {"Pd": 44.7}, {"Pd": 30.0}, {"Pd": 26.7}, {"Pd": 26.3}, {"Pd": 4.8}, {"Pd": 6.0}, {"Pd": 7.6}, {"Pd": 64.9}, {"Pd": 68.4}, {"Pd": 0.0}, {"Pd": 0.5}, {"Pd": 0.2}, {"Pd": 68.4}, {"Pd": 69.6}, {"Pd": 98.1}, {"Pd": 97.7}, {"Pd": 98.8}, {"Pd": 72.8}, {"Pd": 73.5}, {"Pd": 75.3}, {"Pd": 4.6}, {"Pd": 5.6}, {"Pd": 2.9}, {"Pd": 73.5}, {"Pd": 75.3}, {"Pd": 75.3}, {"Pd": 28.2}, {"Pd": 32.1}, {"Pd": 26.8}, {"Pd": 48.2}, {"Pd": 47.1}, {"Pd": 49.8}, {"Pd": 4.6}, {"Pd": 6.5}, {"Pd": 3.0}, {"Pd": 9.8}, {"Pd": 11.9}, {"Pd": 5.0}, {"Pd": 0.2}, {"Pd": 0.3}, {"Pd": 0.0}, {"Pd": 2.5}, {"Pd": 4.4}, {"Pd": 4.3}, {"Pd": 43.2}, {"Pd": 43.3}, {"Pd": 41.7}, {"Pd": 44.7}, {"Pd": 44.6}, {"Pd": 45.4}, {"Pd": 19.3}, {"Pd": 12.9}, {"Pd": 16.5}, {"Pd": 25.2}, {"Pd": 25.2}, {"Pd": 25.1}, {"Pd": 3.1}, {"Pd": 4.0}, {"Pd": 2.4}, {"Pd": 23.0}, {"Pd": 13.2}, {"Pd": 17.6}, {"Pd": 69.6}, {"Pd": 68.4}, {"Pd": 64.9}, {"Pd": 75.8}, {"Pd": 70.7}, {"Pd": 72.0}, {"Pd": 0.6}, {"Pd": 2.9}, {"Pd": 8.1}, {"Pd": 3.1}, {"Pd": 1.9}, {"Pd": 0.0}, {"Pd": 1.1}, {"Pd": 0.0}, {"Pd": 20.5}, {"Pd": 17.3}, {"Pd": 18.2}, {"Pd": 97.9}, {"Pd": 97.7}, {"Pd": 98.8}, {"Pd": 1.6}, {"Pd": 3.0}, {"Pd": 5.6}, {"Pd": 42.1}, {"Pd": 43.2}, {"Pd": 43.3}, {"Pd": 5.0}, {"Pd": 4.2}, {"Pd": 5.5}, {"Pd": 23.9}, {"Pd": 22.9}, {"Pd": 22.1}, {"Pd": 5.0}, {"Pd": 11.9}, {"Pd": 5.2}, {"Pd": 34.8}, {"Pd": 35.9}, {"Pd": 30.2}, {"Pd": 1.9}, {"Pd": 3.0}, {"Pd": 5.6}, {"Pd": 7.0}, {"Pd": 7.9}, {"Pd": 5.0}, {"Pd": 21.2}, {"Pd": 20.5}, {"Pd": 17.3}, {"Pd": 9.7}, {"Pd": 9.1}, {"Pd": 10.7}, {"Pd": 40.2}, {"Pd": 43.1}, {"Pd": 39.7}, {"Pd": 69.6}, {"Pd": 64.9}, {"Pd": 7.7}, {"Pd": 5.6}, {"Pd": 5.0}, {"Pd": 10.7}, {"Pd": 13.1}, {"Pd": 10.2}, {"Pd": 8.1}, {"Pd": 12.8}, {"Pd": 7.6}, {"Pd": 4.2}, {"Pd": 5.0}, {"Pd": 4.9}, {"Pd": 4.3}, {"Pd": 4.4}, {"Pd": 6.2}, {"Pd": 9.8}, {"Pd": 11.9}, {"Pd": 5.2}, {"Pd": 32.5}, {"Pd": 35.9}, {"Pd": 30.2}, {"Pd": 7.7}, {"Pd": 5.6}, {"Pd": 6.5}, {"Pd": 1.7}, {"Pd": 2.2}, {"Pd": 3.3}, {"Pd": 4.6}, {"Pd": 0.6}, {"Pd": 3.0}, {"Pd": 6.4}, {"Pd": 5.6}, {"Pd": 4.6}, {"Pd": 5.5}, {"Pd": 4.9}, {"Pd": 5.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 7.0}, {"Pd": 4.3}, {"Pd": 7.9}, {"Pd": 3.2}, {"Pd": 4.1}, {"Pd": 3.2}, {"Pd": 6.5}, {"Pd": 5.0}, {"Pd": 5.6}, {"Pd": 8.2}, {"Pd": 3.2}, {"Pd": 4.1}, {"Pd": 34.9}, {"Pd": 39.2}, {"Pd": 38.8}, {"Pd": 75.3}, {"Pd": 75.3}, {"Pd": 72.8}, {"Pd": 2.4}, {"Pd": 3.4}, {"Pd": 3.1}, {"Pd": 4.2}, {"Pd": 5.5}, {"Pd": 4.9}, {"Pd": 5.7}, {"Pd": 0.0}, {"Pd": 0.6}, {"Pd": 16.4}, {"Pd": 16.8}, {"Pd": 18.2}, {"Pd": 1.2}, {"Pd": 2.6}, {"Pd": 2.1}, {"Pd": 9.1}, {"Pd": 10.7}, {"Pd": 9.8}, {"Pd": 28.7}, {"Pd": 25.8}, {"Pd": 34.8}, {"Pd": 32.5}, {"Pd": 35.9}, {"Pd": 2.6}, {"Pd": 1.7}, {"Pd": 3.3}, {"Pd": 9.8}, {"Pd": 10.7}, {"Pd": 9.7}, {"Pd": 48.2}, {"Pd": 46.9}, {"Pd": 47.1}, {"Pd": 9.2}, {"Pd": 8.7}, {"Pd": 13.2}, {"Pd": 15.3}, {"Pd": 23.0}, {"Pd": 2.7}, {"Pd": 4.7}, {"Pd": 0.3}, {"Pd": 16.5}, {"Pd": 23.3}, {"Pd": 12.9}, {"Pd": 43.1}, {"Pd": 42.7}, {"Pd": 40.2}, {"Pd": 17.8}, {"Pd": 15.2}, {"Pd": 16.8}, {"Pd": 16.8}, {"Pd": 18.2}, {"Pd": 18.4}, {"Pd": 2.9}, {"Pd": 2.9}, {"Pd": 3.1}, {"Pd": 2.7}, {"Pd": 0.3}, {"Pd": 2.3}, {"Pd": 2.3}, {"Pd": 2.7}, {"Pd": 4.7}, {"Pd": 4.6}, {"Pd": 6.4}, {"Pd": 2.9}, {"Pd": 21.2}, {"Pd": 20.5}, {"Pd": 18.2}, {"Pd": 23.4}, {"Pd": 23.8}, {"Pd": 25.0}, {"Pd": 25.8}, {"Pd": 38.8}, {"Pd": 35.1}, {"Pd": 34.9}, {"Pd": 6.5}, {"Pd": 5.0}, {"Pd": 7.7}, {"Pd": 4.3}, {"Pd": 2.1}, {"Pd": 4.9}, {"Pd": 8.2}, {"Pd": 3.2}, {"Pd": 3.2}, {"Pd": 42.5}, {"Pd": 21.2}, {"Pd": 18.2}, {"Pd": 17.3}, {"Pd": 70.7}, {"Pd": 72.8}, {"Pd": 75.8}, {"Pd": 8.7}, {"Pd": 8.1}, {"Pd": 12.8}, {"Pd": 47.0}, {"Pd": 48.9}, {"Pd": 38.6}, {"Pd": 3.3}, {"Pd": 3.3}, {"Pd": 1.7}, {"Pd": 7.5}, {"Pd": 9.1}, {"Pd": 9.4}, {"Pd": 4.8}, {"Pd": 7.6}, {"Pd": 7.0}, {"Pd": 23.8}, {"Pd": 25.0}, {"Pd": 23.1}, {"Pd": 39.7}, {"Pd": 42.7}, {"Pd": 43.1}, {"Pd": 7.0}, {"Pd": 7.6}, {"Pd": 6.0}, {"Pd": 0.6}, {"Pd": 4.6}, {"Pd": 6.5}, {"Pd": 9.0}, {"Pd": 8.7}, {"Pd": 9.2}, {"Pd": 16.4}, {"Pd": 18.2}, {"Pd": 18.4}, {"Pd": 25.1}, {"Pd": 25.2}, {"Pd": 20.1}, {"Pd": 39.2}, {"Pd": 38.8}, {"Pd": 35.1}, {"Pd": 2.6}, {"Pd": 2.4}, {"Pd": 2.1}, {"Pd": 24.6}, {"Pd": 22.9}, {"Pd": 23.9}, {"Pd": 3.3}, {"Pd": 4.1}, {"Pd": 2.2}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 5.4}, {"Pd": 4.9}, {"Pd": 4.3}, {"Pd": 0.6}, {"Pd": 1.3}, {"Pd": 0.0}, {"Pd": 32.5}, {"Pd": 34.8}, {"Pd": 30.2}, {"Pd": 6.2}, {"Pd": 2.5}, {"Pd": 4.3}, {"Pd": 30.0}, {"Pd": 25.0}, {"Pd": 26.7}, {"Pd": 9.2}, {"Pd": 9.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 16.8}, {"Pd": 16.4}, {"Pd": 18.4}, {"Pd": 8.2}, {"Pd": 4.1}, {"Pd": 3.2}, {"Pd": 9.0}, {"Pd": 8.7}, {"Pd": 72.8}, {"Pd": 72.0}, {"Pd": 75.8}, {"Pd": 23.3}, {"Pd": 16.5}, {"Pd": 19.3}, {"Pd": 6.5}, {"Pd": 0.6}, {"Pd": 3.0}, {"Pd": 47.0}, {"Pd": 48.9}, {"Pd": 39.3}, {"Pd": 38.6}, {"Pd": 39.3}, {"Pd": 47.0}, {"Pd": 25.0}, {"Pd": 23.1}, {"Pd": 23.4}, {"Pd": 7.9}, {"Pd": 5.0}, {"Pd": 4.3}, {"Pd": 8.1}, {"Pd": 0.0}, {"Pd": 1.9}, {"Pd": 8.7}, {"Pd": 7.6}, {"Pd": 8.1}, {"Pd": 5.6}, {"Pd": 6.4}, {"Pd": 2.9}, {"Pd": 2.9}, {"Pd": 8.6}, {"Pd": 3.1}, {"Pd": 5.6}, {"Pd": 1.9}, {"Pd": 1.6}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 1.1}, {"Pd": 22.1}, {"Pd": 22.9}, {"Pd": 24.6}, {"Pd": 0.3}, {"Pd": 0.5}, {"Pd": 0.2}, {"Pd": 28.7}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 2.5}, {"Pd": 6.2}, {"Pd": 4.4}, {"Pd": 15.3}, {"Pd": 13.1}, {"Pd": 10.7}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median Palladium percentage for alloys where Gold percentage is under {}%."}
{"question": "How many entries have SBET greater than 2.6 m²/g and produce CO as the Main product?", "refer_dataset": "table10", "column names": ["SBET (m2 /g)", "Main product"], "condition_column": {"SBET (m2 /g)": ">"}, "answer_column": {"Main product": "count"}, "condition": {"SBET (m2 /g)": ">2.6"}, "tool": "calculate_data", "answer": 138, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have SBET greater than {} m²/g and produce CO as the Main product?"}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 5.73468965326116?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='5.73468965326116'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "For materials in space group symbol P2/m, what is the minimum stress tensor value observed?", "refer_dataset": "table59", "column names": ["spacegroup_symbol", "stress"], "condition_column": {"spacegroup_symbol": "="}, "answer_column": {"stress": "min"}, "condition": {"spacegroup_symbol": "=='P2/m'"}, "tool": "calculate_data", "answer": "[[0.11134110594398658, 0.0, 0.0], [0.0, 0.06218609806241269, -0.000836900226339273], [0.0, -0.0008369002263391934, 0.39536557142750367]]", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials in space group symbol {}, what is the minimum stress tensor value observed?"}
{"question": "How many times has research from China West Normal Univ institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='China West Normal Univ'"}, "tool": "calculate_data", "answer": 1715, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "How many times has research from CAS Ctr Excellence Nanosci institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='CAS Ctr Excellence Nanosci'"}, "tool": "calculate_data", "answer": 64, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 12.0?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">12.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "What is the minimum Bandgap (Eg) observed at a loading of 0.428571429 g/l?", "refer_dataset": "table10", "column names": ["loading (g/l)", "Eg(eV)"], "condition_column": {"loading (g/l)": "="}, "answer_column": {"Eg(eV)": "min"}, "condition": {"loading (g/l)": "=='0.428571429'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Bandgap (Eg) observed at a loading of {} g/l?"}
{"question": "Calculate the total final energy for all materials with formula MgF2 and indirect band gap greater than 5.326.", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "final_energy"], "condition_column": {"formula": "=", "indir_gap": ">"}, "answer_column": {"final_energy": "sum"}, "condition": {"formula": "=='MgF2'", "indir_gap": ">5.326"}, "tool": "calculate_data", "answer": -4450.477464493131, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total final energy for all materials with formula {} and indirect band gap greater than {}."}
{"question": "Calculate the minimum COx when Cation3-mol < 0.0%, Anion2 = 0.0, and CH4-pressure > 0.4.", "refer_dataset": "table20", "column names": ["Cation3-mol", "Anion2", "CH4-pressure", "COx"], "condition_column": {"Cation3-mol": "<", "Anion2": "=", "CH4-pressure": ">"}, "answer_column": {"COx": "min"}, "condition": {"Cation3-mol": "<0.0", "Anion2": "=='0.0'", "CH4-pressure": ">0.4"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum COx when Cation3-mol < {}%, Anion2 = {}, and CH4-pressure > {}."}
{"question": "Calculate the maximum ethylene yield (C2H4y) when M2 is Li and M3_mol is 0.185.", "refer_dataset": "table17", "column names": ["M2", "M3_mol", "C2H4y"], "condition_column": {"M2": "=", "M3_mol": "="}, "answer_column": {"C2H4y": "max"}, "condition": {"M2": "=='Li'", "M3_mol": "=='0.185'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum ethylene yield (C2H4y) when M2 is {} and M3_mol is {}."}
{"question": "What Light Wavelength achieves Degradation Rate above 73.0% within 20 minutes of Illumination Time for Dopant C?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Degradation rate(%)", "Illumination time(min)", "Dopant"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "Dopant": "="}, "answer_column": {"Light wavelength(nm)": ""}, "condition": {"Degradation rate(%)": ">73.0", "Illumination time(min)": "<20", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Light Wavelength achieves Degradation Rate above {}% within {} minutes of Illumination Time for Dopant {}?"}
{"question": "What is the average calcination temperature (CT) for samples referenced in study [36]?", "refer_dataset": "table11", "column names": ["Ref.", "CT (℃)"], "condition_column": {"Ref.": "="}, "answer_column": {"CT (℃)": "avg"}, "condition": {"Ref.": "=='[36]'"}, "tool": "calculate_data", "answer": 700.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature (CT) for samples referenced in study {}?"}
{"question": "Calculate the total final energy for all materials with formula MgF2 and indirect band gap greater than 5.868.", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "final_energy"], "condition_column": {"formula": "=", "indir_gap": ">"}, "answer_column": {"final_energy": "sum"}, "condition": {"formula": "=='MgF2'", "indir_gap": ">5.868"}, "tool": "calculate_data", "answer": -3671.782142525095, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total final energy for all materials with formula {} and indirect band gap greater than {}."}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MO under Experimental Temperature 25°C and Light Wavelength 575 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MO'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='575'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding 2.84e-05?", "refer_dataset": "table54", "column names": ["mu_b", "shear modulus"], "condition_column": {"mu_b": ">"}, "answer_column": {"shear modulus": "max"}, "condition": {"mu_b": ">2.84e-05"}, "tool": "calculate_data", "answer": 347.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding {}?"}
{"question": "Determine the average H2 selectivity when Cation1 is V, Cation3Amount > 0%, and O2 conv < 7.1%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='V'", "Cation3Amount": ">0", "O2 conv": "<7.1"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "What is the minimum Duration of cycles (h) when B site is Ti?", "refer_dataset": "table5", "column names": ["B site", "Duration of cycles (h)"], "condition_column": {"B site": "="}, "answer_column": {"Duration of cycles (h)": "min"}, "condition": {"B site": "=='Ti'"}, "tool": "calculate_data", "answer": 43.7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Duration of cycles (h) when B site is {}?"}
{"question": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds 13.736308097839355?", "refer_dataset": "table60", "column names": ["gap", "Cv"], "condition_column": {"gap": ">"}, "answer_column": {"Cv": "min"}, "condition": {"gap": ">13.736308097839355"}, "tool": "calculate_data", "answer": 12.638999938964844, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds {}?"}
{"question": "Calculate the average chem_pot for symbol Cu?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Cu'"}, "tool": "calculate_data", "answer": 0.5628995500000001, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "What is the highest ethylene selectivity observed when Support is SiO3?", "refer_dataset": "table19", "column names": ["Support", "C2H4 sel"], "condition_column": {"Support": "="}, "answer_column": {"C2H4 sel": "max"}, "condition": {"Support": "=='SiO3'"}, "tool": "calculate_data", "answer": 16.7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ethylene selectivity observed when Support is {}?"}
{"question": "What is the highest light intensity used with the co-catalyst 'none'?", "refer_dataset": "table1", "column names": ["Co-catalyst", "Light intensity(W)"], "condition_column": {"Co-catalyst": "="}, "answer_column": {"Light intensity(W)": "max"}, "condition": {"Co-catalyst": "=='none'"}, "tool": "calculate_data", "answer": "Xe lamp (350 W), λ > 400 nm", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest light intensity used with the co-catalyst '{}'?"}
{"question": "Determine the total CO yield (COy) when Support_ID is 13 and M1_atom_number is less than 25.", "refer_dataset": "table17", "column names": ["Support_ID", "M1_atom_number", "COy"], "condition_column": {"Support_ID": "=", "M1_atom_number": "<"}, "answer_column": {"COy": "sum"}, "condition": {"Support_ID": "=='13'", "M1_atom_number": "<25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total CO yield (COy) when Support_ID is {} and M1_atom_number is less than {}."}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 6.3783488273620605?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='6.3783488273620605'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the Furfural alcohol derived polymerization-oxidation method?", "refer_dataset": "table1", "column names": ["Preparation method", "RH2(µmol h-1 g-1)"], "condition_column": {"Preparation method": "="}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Preparation method": "=='Furfural alcohol derived polymerization-oxidation'"}, "tool": "calculate_data", "answer": 423.3, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the {} method?"}
{"question": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above 0.699?", "refer_dataset": "table9", "column names": ["T, oC", "-log(k), min-1"], "condition_column": {"-log(k), min-1": ">"}, "answer_column": {"T, oC": "avg"}, "condition": {"-log(k), min-1": ">0.699"}, "tool": "calculate_data", "answer": 27.814917127071823, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above {}?"}
{"question": "How many organic compounds (OC) have pH values equal to 3.3?", "refer_dataset": "table9", "column names": ["OC", "pH"], "condition_column": {"pH": "="}, "answer_column": {"OC": "count"}, "condition": {"pH": "=='3.3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many organic compounds (OC) have pH values equal to {}?"}
{"question": "Calculate the average formula_energy for all materials with ID starting with 1454?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "avg"}, "condition": {"id": "=='1454'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average formula_energy for all materials with ID starting with {}?"}
{"question": "How many unique surfaces are recorded for the element Cu?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='Cu'"}, "tool": "calculate_data", "answer": 105, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "What is the average Surface Area(m2/g) for materials with A equal to Sr, B equal to Ti, and Wave length(<nm) below 440.0?", "refer_dataset": "table4", "column names": ["A", "B", "Wave length(<nm)", "Surface Area(m2/g)"], "condition_column": {"A": "=", "B": "=", "Wave length(<nm)": "<"}, "answer_column": {"Surface Area(m2/g)": "avg"}, "condition": {"A": "=='Sr'", "B": "=='Ti'", "Wave length(<nm)": "<440.0"}, "tool": "calculate_data", "answer": 12.193042857142856, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Area(m2/g) for materials with A equal to {}, B equal to {}, and Wave length(<nm) below {}?"}
{"question": "What is the minimum pH recorded for Degradation Rate > 79.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">79.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than -0.60227748041828?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">-0.60227748041828"}, "tool": "calculate_data", "answer": -0.17418574479125823, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "What is the average formation energy (ef) for bulk_formula Sm and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Sm'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 1.735315, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > 0.0, Mg < 0.0, and La = 0.0?", "refer_dataset": "table16", "column names": ["Ca", "Mg", "La", "J.uAcm2_0.80_fromCV"], "condition_column": {"Ca": ">", "Mg": "<", "La": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "max"}, "condition": {"Ca": ">0.0", "Mg": "<0.0", "La": "=='0.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > {}, Mg < {}, and La = {}?"}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 120°C and references in study [42]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">120", "Ref.": "=='[42]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds -6.993326187133789, internal energy at 0K (U0) is below -12.005853652954102, and Gibbs free energy (G) equals -11.24600315093994?", "refer_dataset": "table60", "column names": ["homo", "U0", "G", "Cv"], "condition_column": {"homo": ">", "U0": "<", "G": "="}, "answer_column": {"Cv": "min"}, "condition": {"homo": ">-6.993326187133789", "U0": "<-12.005853652954102", "G": "=='-11.24600315093994'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds {}, internal energy at 0K (U0) is below {}, and Gibbs free energy (G) equals {}?"}
{"question": "Determine the highest overpotential in acidic conditions for articles published in RSC ADVANCES journal.", "refer_dataset": "table13", "column names": ["Journal_Name", "Acid_OVP"], "condition_column": {"Journal_Name": "="}, "answer_column": {"Acid_OVP": "max"}, "condition": {"Journal_Name": "=='RSC ADVANCES'"}, "tool": "calculate_data", "answer": 250.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the highest overpotential in acidic conditions for articles published in {} journal."}
{"question": "What is the highest SSA observed when CT exceeds 700°C and preparation method is 2?", "refer_dataset": "table11", "column names": ["CT (℃)", "PM", "SSA (m2 g -1 )"], "condition_column": {"CT (℃)": ">", "PM": "="}, "answer_column": {"SSA (m2 g -1 )": "avg"}, "condition": {"CT (℃)": ">700", "PM": "=='2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SSA observed when CT exceeds {}°C and preparation method is {}?"}
{"question": "Calculate the average Alcohol% when Light Type is visible?", "refer_dataset": "table4", "column names": ["Light Type", "Alcohol%"], "condition_column": {"Light Type": "="}, "answer_column": {"Alcohol%": "avg"}, "condition": {"Light Type": "=='visible'"}, "tool": "calculate_data", "answer": 2.625, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Alcohol% when Light Type is {}?"}
{"question": "What is the maximum Tc for materials with formula containing Ca0.31Sr0.7Ti1O3?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "max"}, "condition": {"formula": "=='Ca0.31Sr0.7Ti1O3'"}, "tool": "calculate_data", "answer": 0.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Tc for materials with formula containing {}?"}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -6.19729982493282.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-6.19729982493282"}, "tool": "calculate_data", "answer": -3.7717596263294566, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds 6.1579365730285645?", "refer_dataset": "table60", "column names": ["gap", "Cv"], "condition_column": {"gap": ">"}, "answer_column": {"Cv": "min"}, "condition": {"gap": ">6.1579365730285645"}, "tool": "calculate_data", "answer": 38.01800155639648, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds {}?"}
{"question": "What Light Wavelength achieves Degradation Rate above 96.0% within 20 minutes of Illumination Time for Dopant C?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Degradation rate(%)", "Illumination time(min)", "Dopant"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "Dopant": "="}, "answer_column": {"Light wavelength(nm)": ""}, "condition": {"Degradation rate(%)": ">96.0", "Illumination time(min)": "<20", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Light Wavelength achieves Degradation Rate above {}% within {} minutes of Illumination Time for Dopant {}?"}
{"question": "What is the highest Lattice Parameter observed when A_AtomN is 40.0, B_AtomN > 44.0, and Volume < 64.4121955981?", "refer_dataset": "table22", "column names": ["A_AtomN", "B_AtomN", "Volume", "Lattice"], "condition_column": {"A_AtomN": "=", "B_AtomN": ">", "Volume": "<"}, "answer_column": {"Lattice": "max"}, "condition": {"A_AtomN": "=='40.0'", "B_AtomN": ">44.0", "Volume": "<64.4121955981"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Lattice Parameter observed when A_AtomN is {}, B_AtomN > {}, and Volume < {}?"}
{"question": "What is the average formation energy (ef) for bulk_formula Mn and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Mn'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 2.64471, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -7.59467417670514.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-7.59467417670514"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is Nd, Support is BaO, and CH4/O2 ratio is 6?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='Nd'", "Support": "=='BaO'", "CH4/O2 (mol/mol)": "=='6'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "What is the minimum initial concentration (C0) recorded when light intensity (I) is 0.855 mW/cm², nanoparticle dose (D) is 0.05 g/L, and reference (Ref) is 21.0?", "refer_dataset": "table9", "column names": ["I, mW/cm2", "D, g/L", "Ref", "C0, mg/L"], "condition_column": {"I, mW/cm2": "=", "D, g/L": "=", "Ref": "="}, "answer_column": {"C0, mg/L": "min"}, "condition": {"I, mW/cm2": "=='0.855'", "D, g/L": "=='0.05'", "Ref": "=='21.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum initial concentration (C0) recorded when light intensity (I) is {} mW/cm², nanoparticle dose (D) is {} g/L, and reference (Ref) is {}?"}
{"question": "How many references document samples calcined for over 48.0 hours?", "refer_dataset": "table1", "column names": ["Calcination time(h)", "Ref"], "condition_column": {"Calcination time(h)": ">"}, "answer_column": {"Ref": "count"}, "condition": {"Calcination time(h)": ">48.0"}, "tool": "calculate_data", "answer": 1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document samples calcined for over {} hours?"}
{"question": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > 0.6, Ni < 0.0, and Fe = 0.1?", "refer_dataset": "table16", "column names": ["Mn", "Ni", "Fe", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">", "Ni": "<", "Fe": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.6", "Ni": "<0.0", "Fe": "=='0.1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > {}, Ni < {}, and Fe = {}?"}
{"question": "What is the maximum light intensity (I) recorded for organic compound Methanol with nanoparticle dose (D) ≥ 1.875 g/L and reaction rate (-log(k)) > 0.7992?", "refer_dataset": "table9", "column names": ["OC", "D, g/L", "-log(k), min-1", "I, mW/cm2"], "condition_column": {"OC": "=", "D, g/L": ">=", "-log(k), min-1": ">"}, "answer_column": {"I, mW/cm2": "max"}, "condition": {"OC": "=='Methanol'", "D, g/L": ">=1.875", "-log(k), min-1": ">0.7992"}, "tool": "calculate_data", "answer": 0.176, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum light intensity (I) recorded for organic compound {} with nanoparticle dose (D) ≥ {} g/L and reaction rate (-log(k)) > {}?"}
{"question": "What is the highest methane conversion rate when Cation1 is Fe, Cation2Amount > 70%, and Support is Al2O3?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='Fe'", "Cation2Amount": ">70", "Support": "=='Al2O3'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "Calculate the minimum CH4-pressure when C2-selectivity is greater than 1.9%?", "refer_dataset": "table20", "column names": ["CH4-pressure", "C2-selectivity"], "condition_column": {"C2-selectivity": ">"}, "answer_column": {"CH4-pressure": "min"}, "condition": {"C2-selectivity": ">1.9"}, "tool": "calculate_data", "answer": 2.7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum CH4-pressure when C2-selectivity is greater than {}%?"}
{"question": "Calculate the average reaction temperature for noble metal none, synthesis time 24.0 hours, and additional components containing nonmetal.", "refer_dataset": "table7", "column names": ["Noble_Metal", "Synthesis_Time", "Additional", "Rxn_Temp"], "condition_column": {"Noble_Metal": "=", "Synthesis_Time": "=", "Additional": "="}, "answer_column": {"Rxn_Temp": "avg"}, "condition": {"Noble_Metal": "=='none'", "Synthesis_Time": "=='24.0'", "Additional": "=='nonmetal'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average reaction temperature for noble metal {}, synthesis time {} hours, and additional components containing {}."}
{"question": "What is the average bulk_energy for bulk_formula Mn?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Mn'"}, "tool": "calculate_data", "answer": -327.13856, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "Calculate the maximum J.uAcm2_0.63_secondCA where Mg concentration is below 0.5?", "refer_dataset": "table16", "column names": ["Mg", "J.uAcm2_0.63_secondCA"], "condition_column": {"Mg": "<"}, "answer_column": {"J.uAcm2_0.63_secondCA": "max"}, "condition": {"Mg": "<0.5"}, "tool": "calculate_data", "answer": 4786.048, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum J.uAcm2_0.63_secondCA where Mg concentration is below {}?"}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 1.94216821965969.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<1.94216821965969"}, "tool": "calculate_data", "answer": [{"U": 6.19311549745637}, {"U": 5.74085587987803}, {"U": 5.85213296706841}, {"U": 4.54692058907546}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 4.1619487412596}, {"U": 4.19426139798513}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 2.9854853300983}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 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1.28404249364582}, {"U": 1.24731418317516}, {"U": 1.7286230542082}, {"U": 1.66401341763435}, {"U": 1.68445345269247}, {"U": 1.68175702981378}, {"U": 1.66775235284695}, {"U": 1.69638355624295}, {"U": 2.15033105093333}, {"U": 1.66656613580536}, {"U": 2.16992976024829}, {"U": 0.89750818373552}, {"U": 1.39497991516349}, {"U": 1.41447149915091}, {"U": 1.41040334951708}, {"U": 1.89166257710565}, {"U": 1.91104442295265}, {"U": 1.91333063421123}, {"U": 1.89792548954772}, {"U": 1.93441342123462}, {"U": 2.3823932513369}, {"U": 1.87871086372419}, {"U": 2.38514454328579}, {"U": 0.05679645160256}, {"U": 0.341940558211}, {"U": 0.32816580877646}, {"U": 0.56508000267395}, {"U": 0.84792744677235}, {"U": 0.82872065938743}, {"U": 0.56060164142}, {"U": 0.83194487046524}, {"U": 0.84336024988093}, {"U": 1.11763766777575}, {"U": 0.82945747261591}, {"U": 1.10670304592758}, {"U": 0.83144582320765}, {"U": 1.10423132495545}, {"U": -0.451758832007}, {"U": 0.05719098634546}, {"U": 0.32545370902057}, {"U": 0.05198626311451}, {"U": 0.83160520479254}, {"U": 0.32289576522383}, {"U": 0.82306914515622}, {"U": 1.10490543067512}, {"U": -0.16529525490075}, {"U": 0.34283675302437}, {"U": 0.61549161412881}, {"U": 0.33741516632545}, {"U": 0.83953247903085}, {"U": 1.12195403463194}, {"U": 1.11910084298124}, {"U": 1.61456854694026}, {"U": 1.60701229212905}, {"U": 1.33528236677951}, {"U": 1.34363552951513}, {"U": 1.61223269223721}, {"U": 1.34519276598383}, {"U": 1.62650648892934}, {"U": 1.62129392725978}, {"U": 1.88609206007332}, {"U": 0.7265936428571}, {"U": 1.23522992366553}, {"U": 1.5090683889987}, {"U": 1.01337598313312}, {"U": 1.52077379064262}, {"U": -0.43341427286817}, {"U": 0.06862465545122}, {"U": 0.33831136113882}, {"U": 0.77490193995407}, {"U": 0.57407591737485}, {"U": 0.84317735298024}, {"U": 1.2810560485389}, {"U": 1.11634693821948}, {"U": 0.79919587399094}, {"U": 1.55600757215339}, {"U": -0.42890717067269}, {"U": 0.07262748476338}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "What is the minimum initial concentration (C0) recorded when light intensity (I) is 3.15 mW/cm², nanoparticle dose (D) is 2.5 g/L, and reference (Ref) is 20.0?", "refer_dataset": "table9", "column names": ["I, mW/cm2", "D, g/L", "Ref", "C0, mg/L"], "condition_column": {"I, mW/cm2": "=", "D, g/L": "=", "Ref": "="}, "answer_column": {"C0, mg/L": "min"}, "condition": {"I, mW/cm2": "=='3.15'", "D, g/L": "=='2.5'", "Ref": "=='20.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum initial concentration (C0) recorded when light intensity (I) is {} mW/cm², nanoparticle dose (D) is {} g/L, and reference (Ref) is {}?"}
{"question": "What is the maximum BandGap(eV) for composites with X1 substitution nan, Sac. Agent1 equal to HCOOH, and Power(W) less than 150.0?", "refer_dataset": "table4", "column names": ["X1", "Sac. Agent1", "Power(W)", "BandGap(eV)"], "condition_column": {"X1": "=", "Sac. Agent1": "=", "Power(W)": "<"}, "answer_column": {"BandGap(eV)": "max"}, "condition": {"X1": "=='nan'", "Sac. Agent1": "=='HCOOH'", "Power(W)": "<150.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum BandGap(eV) for composites with X1 substitution {}, Sac. Agent1 equal to {}, and Power(W) less than {}?"}
{"question": "Calculate the average chem_pot for symbol Nd?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Nd'"}, "tool": "calculate_data", "answer": -2.1809815, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "Determine the average H2 selectivity when Cation1 is Na, Cation3Amount > 0%, and O2 conv < 17.9%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='Na'", "Cation3Amount": ">0", "O2 conv": "<17.9"}, "tool": "calculate_data", "answer": 27.066666666666663, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > 0.8, Ni < 0.0, and Fe = 0.1?", "refer_dataset": "table16", "column names": ["Mn", "Ni", "Fe", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">", "Ni": "<", "Fe": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.8", "Ni": "<0.0", "Fe": "=='0.1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > {}, Ni < {}, and Fe = {}?"}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 2.91 eV, light source Visible, and Reaction medium gas-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<2.91", "light source": "=='Visible'", "Reaction medium": "=='gas-solid'"}, "tool": "calculate_data", "answer": 2.153805555555556, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "What is the minimum pH recorded for Degradation Rate > 43.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">43.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "For surfaces with Miller indices -1, what is the maximum activation energy?", "refer_dataset": "table18", "column names": ["surfaces", "activation_energy"], "condition_column": {"surfaces": "="}, "answer_column": {"activation_energy": "max"}, "condition": {"surfaces": "=='-1'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For surfaces with Miller indices {}, what is the maximum activation energy?"}
{"question": "What is the highest methane conversion rate when Cation1 is Cu, Cation2Amount > 70%, and Support is SiO2?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='Cu'", "Cation2Amount": ">70", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "What is the minimum total energy for materials with an LCD of 1.6925400000000002?", "refer_dataset": "table62", "column names": ["lcd", "energy_total"], "condition_column": {"lcd": "="}, "answer_column": {"energy_total": "min"}, "condition": {"lcd": "=='1.6925400000000002'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum total energy for materials with an LCD of {}?"}
{"question": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above -1.26198861.", "refer_dataset": "table66", "column names": ["efermi", "final_energy"], "condition_column": {"efermi": ">"}, "answer_column": {"final_energy": "min"}, "condition": {"efermi": ">-1.26198861"}, "tool": "calculate_data", "answer": 485.35742061, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above {}."}
{"question": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than 39.34 eV.", "refer_dataset": "table3", "column names": ["EAa", "Ra"], "condition_column": {"EAa": ">"}, "answer_column": {"Ra": "max"}, "condition": {"EAa": ">39.34"}, "tool": "calculate_data", "answer": 139.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than {} eV."}
{"question": "What is the maximum pH recorded for Pollutant MO under Light Wavelength 600 nm?", "refer_dataset": "table8", "column names": ["Pollutant", "Light wavelength(nm)", "pH"], "condition_column": {"Pollutant": "=", "Light wavelength(nm)": "<"}, "answer_column": {"pH": "max"}, "condition": {"Pollutant": "=='MO'", "Light wavelength(nm)": "<600"}, "tool": "calculate_data", "answer": 7.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH recorded for Pollutant {} under Light Wavelength {} nm?"}
{"question": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"NM\", Space_group_rlx 9, and Band_gap_HSE > 1.97659.", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Space_group_rlx", "Band_gap_HSE", "Band_gap_GGA_optical"], "condition_column": {"Magnetic_ordering": "=", "Space_group_rlx": "=", "Band_gap_HSE": ">"}, "answer_column": {"Band_gap_GGA_optical": "avg"}, "condition": {"Magnetic_ordering": "=='NM'", "Space_group_rlx": "=='9'", "Band_gap_HSE": ">1.97659"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"{}\", Space_group_rlx {}, and Band_gap_HSE > {}."}
{"question": "For Support1 13, what is the maximum C2-yield?", "refer_dataset": "table20", "column names": ["Support1", "C2-yield"], "condition_column": {"Support1": "="}, "answer_column": {"C2-yield": "max"}, "condition": {"Support1": "=='13'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For Support1 {}, what is the maximum C2-yield?"}
{"question": "What is the median atomic number of elements with activation energy below 1.6?", "refer_dataset": "table18", "column names": ["activation_energy", "A_AtimicN"], "condition_column": {"activation_energy": "<"}, "answer_column": {"A_AtimicN": "median"}, "condition": {"activation_energy": "<1.6"}, "tool": "calculate_data", "answer": [{"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 42}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 25}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 27}, {"A_AtimicN": 78}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 26}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 42}, {"A_AtimicN": 28}, {"A_AtimicN": 47}, {"A_AtimicN": 26}, {"A_AtimicN": 26}, {"A_AtimicN": 23}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 42}, {"A_AtimicN": 74}, {"A_AtimicN": 79}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 73}, {"A_AtimicN": 23}, {"A_AtimicN": 29}, {"A_AtimicN": 28}, {"A_AtimicN": 73}, {"A_AtimicN": 74}, {"A_AtimicN": 45}, {"A_AtimicN": 77}, {"A_AtimicN": 27}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 76}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 47}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 30}, {"A_AtimicN": 25}, {"A_AtimicN": 26}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 26}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 77}, {"A_AtimicN": 25}, {"A_AtimicN": 44}, {"A_AtimicN": 26}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 77}, {"A_AtimicN": 75}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 26}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 26}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 77}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 26}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 47}, {"A_AtimicN": 45}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median atomic number of elements with activation energy below {}?"}
{"question": "How many preparation methods resulted in SSA > 10.88 m²/g and AH < 5.0 hours?", "refer_dataset": "table11", "column names": ["SSA (m2 g -1 )", "AH (h)", "PM"], "condition_column": {"SSA (m2 g -1 )": ">", "AH (h)": "<"}, "answer_column": {"PM": "count"}, "condition": {"SSA (m2 g -1 )": ">10.88", "AH (h)": "<5.0"}, "tool": "calculate_data", "answer": 29, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many preparation methods resulted in SSA > {} m²/g and AH < {} hours?"}
{"question": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than 0.0318?", "refer_dataset": "table54", "column names": ["gap pbe", "mu_b"], "condition_column": {"gap pbe": "<"}, "answer_column": {"mu_b": "max"}, "condition": {"gap pbe": "<0.0318"}, "tool": "calculate_data", "answer": 50.9549641, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than {}?"}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 9.298130989074709?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='9.298130989074709'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.139558475603449?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.139558475603449"}, "tool": "calculate_data", "answer": 0.01088533464566929, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "What is the average shear modulus for materials with e_hull under 0.019272106249998 and elastic anisotropy greater than 0.03?", "refer_dataset": "table56", "column names": ["shear modulus", "e_hull", "elastic anisotropy"], "condition_column": {"e_hull": "<", "elastic anisotropy": ">"}, "answer_column": {"shear modulus": "avg"}, "condition": {"e_hull": "<0.019272106249998", "elastic anisotropy": ">0.03"}, "tool": "calculate_data", "answer": 60.82204951768469, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average shear modulus for materials with e_hull under {} and elastic anisotropy greater than {}?"}
{"question": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds 78.5 kJ/mol.", "refer_dataset": "table3", "column names": ["ΔfusHa", "B_Tm"], "condition_column": {"ΔfusHa": ">"}, "answer_column": {"B_Tm": "min"}, "condition": {"ΔfusHa": ">78.5"}, "tool": "calculate_data", "answer": 2952.29, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds {} kJ/mol."}
{"question": "What is the average overpotential in neutral conditions for studies using the nan method published in journals with an impact factor above 2.933?", "refer_dataset": "table13", "column names": ["Judge_Phys_Chem_Deposition", "Neutral_OVP", "IF"], "condition_column": {"Neutral_OVP": "=", "IF": ">"}, "answer_column": {"Judge_Phys_Chem_Deposition": "avg"}, "condition": {"Neutral_OVP": "=='nan'", "IF": ">2.933"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average overpotential in neutral conditions for studies using the {} method published in journals with an impact factor above {}?"}
{"question": "What is the average calcination temperature for experiments using a photocatalyst dose of 2.0 g/L?", "refer_dataset": "table1", "column names": ["Photocatalyst dose(g L-1)", "Calcination temperature(K)"], "condition_column": {"Photocatalyst dose(g L-1)": "="}, "answer_column": {"Calcination temperature(K)": "avg"}, "condition": {"Photocatalyst dose(g L-1)": "=='2.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature for experiments using a photocatalyst dose of {} g/L?"}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'CdSe'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='CdSe'"}, "tool": "calculate_data", "answer": 0.922, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"AFM\", SOC False, and Direct_or_indirect_HSE \"Indirect\"?", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "SOC", "Direct_or_indirect_HSE", "Band_gap_HSE"], "condition_column": {"Magnetic_ordering": "=", "SOC": "=", "Direct_or_indirect_HSE": "="}, "answer_column": {"Band_gap_HSE": "max"}, "condition": {"Magnetic_ordering": "=='AFM'", "SOC": "=='False'", "Direct_or_indirect_HSE": "=='Indirect'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"{}\", SOC {}, and Direct_or_indirect_HSE \"{}\"?"}
{"question": "Calculate the maximum offset value where optb88vdw_vbm is below 5.2089.", "refer_dataset": "table52", "column names": ["offset", "optb88vdw_vbm"], "condition_column": {"optb88vdw_vbm": "<"}, "answer_column": {"offset": "max"}, "condition": {"optb88vdw_vbm": "<5.2089"}, "tool": "calculate_data", "answer": "{}", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum offset value where optb88vdw_vbm is below {}."}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.6068.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.6068"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above 0.406?", "refer_dataset": "table9", "column names": ["T, oC", "-log(k), min-1"], "condition_column": {"-log(k), min-1": ">"}, "answer_column": {"T, oC": "avg"}, "condition": {"-log(k), min-1": ">0.406"}, "tool": "calculate_data", "answer": 27.734597156398106, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above {}?"}
{"question": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN 7.0, Bn (count of B) 1.0, and Formation Energy ≤ 1.96?", "refer_dataset": "table22", "column names": ["C_AtomN", "Bn", "Formation_E", "Volume"], "condition_column": {"C_AtomN": "=", "Bn": "=", "Formation_E": "<="}, "answer_column": {"Volume": "min"}, "condition": {"C_AtomN": "=='7.0'", "Bn": "=='1.0'", "Formation_E": "<=1.96"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN {}, Bn (count of B) {}, and Formation Energy ≤ {}?"}
{"question": "What is the average Cation1-mol for Cation1 56?", "refer_dataset": "table20", "column names": ["Cation1", "Cation1-mol"], "condition_column": {"Cation1": "="}, "answer_column": {"Cation1-mol": "avg"}, "condition": {"Cation1": "=='56'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Cation1-mol for Cation1 {}?"}
{"question": "How many times has research from Nanjing Univ Sci & Technol institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='Nanjing Univ Sci & Technol'"}, "tool": "calculate_data", "answer": 43, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below 1.0698996060198978?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<1.0698996060198978"}, "tool": "calculate_data", "answer": 20.232, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "What is the average reaction energy for elements with atomic number greater than 42?", "refer_dataset": "table18", "column names": ["A_AtimicN", "reaction_energy"], "condition_column": {"A_AtimicN": ">"}, "answer_column": {"reaction_energy": "avg"}, "condition": {"A_AtimicN": ">42"}, "tool": "calculate_data", "answer": 0.044003602941176403, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction energy for elements with atomic number greater than {}?"}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'ZnO'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='ZnO'"}, "tool": "calculate_data", "answer": 1.682, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "What is the highest Rhodium percentage observed in alloys with Onset potential below 0.562701V?", "refer_dataset": "table15", "column names": ["Rh", "Onset"], "condition_column": {"Onset": "<"}, "answer_column": {"Rh": "max"}, "condition": {"Onset": "<0.562701"}, "tool": "calculate_data", "answer": 51.9, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Rhodium percentage observed in alloys with Onset potential below {}V?"}
{"question": "Determine the average bulk modulus for materials where formation energy (e_form) is less than -1.6533411120312502.", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-1.6533411120312502"}, "tool": "calculate_data", "answer": 329.9221031604914, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average bulk modulus for materials where formation energy (e_form) is less than {}."}
{"question": "Determine the minimum Calcination Temperature required for 48.0% Degradation Rate when pH is 7.0 and Catalyst/Pollutant mass ratio is 100.0.", "refer_dataset": "table8", "column names": ["Calcination temperature(°C)", "Degradation rate(%)", "pH", "Catalyst/Pollutant mass ratio"], "condition_column": {"Degradation rate(%)": "=", "pH": "=", "Catalyst/Pollutant mass ratio": "="}, "answer_column": {"Calcination temperature(°C)": "min"}, "condition": {"Degradation rate(%)": "=='48.0'", "pH": "=='7.0'", "Catalyst/Pollutant mass ratio": "=='100.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Calcination Temperature required for {}% Degradation Rate when pH is {} and Catalyst/Pollutant mass ratio is {}."}
{"question": "Calculate the total final energy for all materials with formula MgF2 and indirect band gap greater than 6.082.", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "final_energy"], "condition_column": {"formula": "=", "indir_gap": ">"}, "answer_column": {"final_energy": "sum"}, "condition": {"formula": "=='MgF2'", "indir_gap": ">6.082"}, "tool": "calculate_data", "answer": -3226.6586495864717, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total final energy for all materials with formula {} and indirect band gap greater than {}."}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below 485.35742061?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<485.35742061"}, "tool": "calculate_data", "answer": 167.57883710812715, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > 20.0, pH < 2.2, and Antibiotic dosage (mg/L) = 50.0.", "refer_dataset": "table6", "column names": ["Illumination time (min)", "pH", "Antibiotic dosage (mg/L)", "Pore Volume (cm3/g)"], "condition_column": {"Illumination time (min)": ">", "pH": "<", "Antibiotic dosage (mg/L)": "="}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Illumination time (min)": ">20.0", "pH": "<2.2", "Antibiotic dosage (mg/L)": "=='50.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > {}, pH < {}, and Antibiotic dosage (mg/L) = {}."}
{"question": "Calculate the average formula_energy for all materials with ID starting with 1847?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "avg"}, "condition": {"id": "=='1847'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average formula_energy for all materials with ID starting with {}?"}
{"question": "What is the number of articles from MD 20742 USA country that triggered an OER data warning?", "refer_dataset": "table13", "column names": ["Country", "Warning_OER.1"], "condition_column": {"Country": "="}, "answer_column": {"Warning_OER.1": "count"}, "condition": {"Country": "=='MD 20742 USA'"}, "tool": "calculate_data", "answer": 1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the number of articles from {} country that triggered an OER data warning?"}
{"question": "What is the average Light Wavelength used for Calcination Temperatures above 400°C when Pollutant is Phenol?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Calcination temperature(°C)", "Pollutant"], "condition_column": {"Calcination temperature(°C)": ">", "Pollutant": "="}, "answer_column": {"Light wavelength(nm)": "avg"}, "condition": {"Calcination temperature(°C)": ">400", "Pollutant": "=='Phenol'"}, "tool": "calculate_data", "answer": 537.3648648648649, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Light Wavelength used for Calcination Temperatures above {}°C when Pollutant is {}?"}
{"question": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above 1017.103?", "refer_dataset": "table16", "column names": ["Ca", "J.uAcm2_0.80_fromCV"], "condition_column": {"J.uAcm2_0.80_fromCV": ">"}, "answer_column": {"Ca": "avg"}, "condition": {"J.uAcm2_0.80_fromCV": ">1017.103"}, "tool": "calculate_data", "answer": 0.10217391304347828, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above {}?"}
{"question": "Calculate the total number of Preparations with Cation2-mol above 95.4%.", "refer_dataset": "table20", "column names": ["Cation2-mol", "Preparation"], "condition_column": {"Cation2-mol": ">"}, "answer_column": {"Preparation": "count"}, "condition": {"Cation2-mol": ">95.4"}, "tool": "calculate_data", "answer": 124, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total number of Preparations with Cation2-mol above {}%."}
{"question": "Calculate the maximum ethylene selectivity (C2H4s) when Support is CeO2.", "refer_dataset": "table17", "column names": ["Support", "C2H4s"], "condition_column": {"Support": "="}, "answer_column": {"C2H4s": "max"}, "condition": {"Support": "=='CeO2'"}, "tool": "calculate_data", "answer": 76.34, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum ethylene selectivity (C2H4s) when Support is {}."}
{"question": "What is the maximum bandgap observed in materials from source_id mp-1416?", "refer_dataset": "table67", "column names": ["source_id", "bandgap"], "condition_column": {"source_id": "="}, "answer_column": {"bandgap": "max"}, "condition": {"source_id": "=='mp-1416'"}, "tool": "calculate_data", "answer": 1.9863, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bandgap observed in materials from source_id {}?"}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 6.4534769699168?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='6.4534769699168'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the average calcination temperature (CT) for samples referenced in study [30]?", "refer_dataset": "table11", "column names": ["Ref.", "CT (℃)"], "condition_column": {"Ref.": "="}, "answer_column": {"CT (℃)": "avg"}, "condition": {"Ref.": "=='[30]'"}, "tool": "calculate_data", "answer": 700.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature (CT) for samples referenced in study {}?"}
{"question": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than 0.22691826560345.", "refer_dataset": "table57", "column names": ["_oqmd_delta_e", "_oqmd_stability"], "condition_column": {"_oqmd_delta_e": ">"}, "answer_column": {"_oqmd_stability": "min"}, "condition": {"_oqmd_delta_e": ">0.22691826560345"}, "tool": "calculate_data", "answer": 4.152984231249998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than {}."}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MB under Experimental Temperature 25°C and Light Wavelength 580 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MB'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='580'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "What is the average indirect band gap for compounds in the crystal system trigonal?", "refer_dataset": "table59", "column names": ["crystal_system", "indir_gap"], "condition_column": {"crystal_system": "="}, "answer_column": {"indir_gap": "avg"}, "condition": {"crystal_system": "=='trigonal'"}, "tool": "calculate_data", "answer": 0.5210000000000001, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average indirect band gap for compounds in the crystal system {}?"}
{"question": "For entries where dipole moment (mu) is below 2.7362000942230225, what is the average polarizability (alpha)?", "refer_dataset": "table60", "column names": ["mu", "alpha"], "condition_column": {"mu": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": "<2.7362000942230225"}, "tool": "calculate_data", "answer": 60.78381124322095, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For entries where dipole moment (mu) is below {}, what is the average polarizability (alpha)?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) greater than 0.1811112450000003?", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": ">"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": ">0.1811112450000003"}, "tool": "calculate_data", "answer": 191.39848189980435, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) greater than {}?"}
{"question": "Calculate the average Band_gap_GGA for Space_group_rlx 81, SOC False, and Magnetic_ordering \"NM\".", "refer_dataset": "table63", "column names": ["Space_group_rlx", "SOC", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "=", "SOC": "=", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "avg"}, "condition": {"Space_group_rlx": "=='81'", "SOC": "=='False'", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA for Space_group_rlx {}, SOC {}, and Magnetic_ordering \"{}\"."}
{"question": "What is the maximum PLD observed in compounds with a topology of bnn and synthesized status True?", "refer_dataset": "table62", "column names": ["topology", "synthesized", "pld"], "condition_column": {"topology": "=", "synthesized": "="}, "answer_column": {"pld": "max"}, "condition": {"topology": "=='bnn'", "synthesized": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD observed in compounds with a topology of {} and synthesized status {}?"}
{"question": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than 0.7804000000000002?", "refer_dataset": "table54", "column names": ["gap pbe", "mu_b"], "condition_column": {"gap pbe": "<"}, "answer_column": {"mu_b": "max"}, "condition": {"gap pbe": "<0.7804000000000002"}, "tool": "calculate_data", "answer": 55.98974449999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than {}?"}
{"question": "Calculate the maximum offset value where optb88vdw_vbm is below 5.501.", "refer_dataset": "table52", "column names": ["offset", "optb88vdw_vbm"], "condition_column": {"optb88vdw_vbm": "<"}, "answer_column": {"offset": "max"}, "condition": {"optb88vdw_vbm": "<5.501"}, "tool": "calculate_data", "answer": "{}", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum offset value where optb88vdw_vbm is below {}."}
{"question": "What is the average J.uAcm2_0.80_fromCV when Mn concentration exceeds 0.5?", "refer_dataset": "table16", "column names": ["Mn", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">"}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.5"}, "tool": "calculate_data", "answer": 565.238591891892, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average J.uAcm2_0.80_fromCV when Mn concentration exceeds {}?"}
{"question": "Calculate the average C2 yield (%) for catalysts with primary metal Sr, secondary metal Y, and support material BaO–La2O3.", "refer_dataset": "table21", "column names": ["M1", "M2", "Support", "C2 yield (%)"], "condition_column": {"M1": "=", "M2": "=", "Support": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='Sr'", "M2": "=='Y'", "Support": "=='BaO–La2O3'"}, "tool": "calculate_data", "answer": 12.842351371507691, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average C2 yield (%) for catalysts with primary metal {}, secondary metal {}, and support material {}."}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.546628680144628?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.546628680144628"}, "tool": "calculate_data", "answer": 0.001903827751196172, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "Determine the maximum irradiation time (h) for Bi type BiOCl, Main product CH4, and loading > 0.25 g/l.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Main product", "loading (g/l)", "irradiation time(h)"], "condition_column": {"Bi type in photocatalyst": "=", "Main product": "=", "loading (g/l)": ">"}, "answer_column": {"irradiation time(h)": "max"}, "condition": {"Bi type in photocatalyst": "=='BiOCl'", "Main product": "=='CH4'", "loading (g/l)": ">0.25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum irradiation time (h) for Bi type {}, Main product {}, and loading > {} g/l."}
{"question": "What is the maximum pH recorded for Pollutant MO under Light Wavelength 475 nm?", "refer_dataset": "table8", "column names": ["Pollutant", "Light wavelength(nm)", "pH"], "condition_column": {"Pollutant": "=", "Light wavelength(nm)": "<"}, "answer_column": {"pH": "max"}, "condition": {"Pollutant": "=='MO'", "Light wavelength(nm)": "<475"}, "tool": "calculate_data", "answer": 2.5, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH recorded for Pollutant {} under Light Wavelength {} nm?"}
{"question": "What is the minimum loading (g/l) required when light source is UV–VIS and Reaction medium is gas-solid to achieve Yield > 0.175 μmol/g/h?", "refer_dataset": "table10", "column names": ["light source", "Reaction medium", "Yield (μmol/g/h)", "loading (g/l)"], "condition_column": {"light source": "=", "Reaction medium": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"loading (g/l)": "min"}, "condition": {"light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'", "Yield (μmol/g/h)": ">0.175"}, "tool": "calculate_data", "answer": 0.5, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum loading (g/l) required when light source is {} and Reaction medium is {} to achieve Yield > {} μmol/g/h?"}
{"question": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds 103.2 Å, the electronegativity of element B (χpb) is below 1.83, and the molar mass (M) is less than 242.75 g/mol?", "refer_dataset": "table3", "column names": ["Ra", "χpb", "M", "RH2(µmol h-1 g-1)"], "condition_column": {"Ra": ">", "χpb": "<", "M": "<"}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Ra": ">103.2", "χpb": "<1.83", "M": "<242.75"}, "tool": "calculate_data", "answer": 962.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds {} Å, the electronegativity of element B (χpb) is below {}, and the molar mass (M) is less than {} g/mol?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -8.43892288823109.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-8.43892288823109"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 4.75962657949374?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='4.75962657949374'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 1.290397355%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">1.290397355"}, "tool": "calculate_data", "answer": 48.26126007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds 4.0 hours.", "refer_dataset": "table10", "column names": ["irradiation time(h)", "CB edge(V)"], "condition_column": {"irradiation time(h)": ">"}, "answer_column": {"CB edge(V)": "min"}, "condition": {"irradiation time(h)": ">4.0"}, "tool": "calculate_data", "answer": "− 1.3", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds {} hours."}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) N?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='N'"}, "tool": "calculate_data", "answer": -4.1474743680007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the average Surface Area(m2/g) for materials with A equal to K, B equal to Ta, and Wave length(<nm) below 365.0?", "refer_dataset": "table4", "column names": ["A", "B", "Wave length(<nm)", "Surface Area(m2/g)"], "condition_column": {"A": "=", "B": "=", "Wave length(<nm)": "<"}, "answer_column": {"Surface Area(m2/g)": "avg"}, "condition": {"A": "=='K'", "B": "=='Ta'", "Wave length(<nm)": "<365.0"}, "tool": "calculate_data", "answer": 7.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Area(m2/g) for materials with A equal to {}, B equal to {}, and Wave length(<nm) below {}?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than -0.76304115349828?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">-0.76304115349828"}, "tool": "calculate_data", "answer": -0.12171231317066654, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "Determine the average ethane yield (C2H6y) for M1 = Mn, Support_ID = 14, and M3_mol > 0.185.", "refer_dataset": "table17", "column names": ["M1", "Support_ID", "M3_mol", "C2H6y"], "condition_column": {"M1": "=", "Support_ID": "=", "M3_mol": ">"}, "answer_column": {"C2H6y": "avg"}, "condition": {"M1": "=='Mn'", "Support_ID": "=='14'", "M3_mol": ">0.185"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average ethane yield (C2H6y) for M1 = {}, Support_ID = {}, and M3_mol > {}."}
{"question": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds 135.0 Å, the electronegativity of element B (χpb) is below 1.54, and the molar mass (M) is less than 211.88 g/mol?", "refer_dataset": "table3", "column names": ["Ra", "χpb", "M", "RH2(µmol h-1 g-1)"], "condition_column": {"Ra": ">", "χpb": "<", "M": "<"}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Ra": ">135.0", "χpb": "<1.54", "M": "<211.88"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds {} Å, the electronegativity of element B (χpb) is below {}, and the molar mass (M) is less than {} g/mol?"}
{"question": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > 0.1, Mg < 0.1, and La = 0.5?", "refer_dataset": "table16", "column names": ["Ca", "Mg", "La", "J.uAcm2_0.80_fromCV"], "condition_column": {"Ca": ">", "Mg": "<", "La": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "max"}, "condition": {"Ca": ">0.1", "Mg": "<0.1", "La": "=='0.5'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > {}, Mg < {}, and La = {}?"}
{"question": "What is the average total yield for experiments with photocatalyst(s) UiO-66-NH2, Liquid phase, and sacrificial agent percentage above 62.5%?", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Phase", "SacrAgentPercent", "total"], "condition_column": {"Photocatalyst(s)": "=", "Phase": "=", "SacrAgentPercent": ">"}, "answer_column": {"total": "avg"}, "condition": {"Photocatalyst(s)": "=='UiO-66-NH2'", "Phase": "=='Liquid'", "SacrAgentPercent": ">62.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average total yield for experiments with photocatalyst(s) {}, {} phase, and sacrificial agent percentage above {}%?"}
{"question": "Calculate the lowest Illumination Time required to achieve at least 88.0% Degradation Rate with Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": "<", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": "min"}, "condition": {"Degradation rate(%)": "<88.0", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the lowest Illumination Time required to achieve at least {}% Degradation Rate with Dopant/Ti mole ratio {}."}
{"question": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding 70.0°C?", "refer_dataset": "table7", "column names": ["Synhesis_Temp", "Reactor_Volume"], "condition_column": {"Synhesis_Temp": ">"}, "answer_column": {"Reactor_Volume": "min"}, "condition": {"Synhesis_Temp": ">70.0"}, "tool": "calculate_data", "answer": 1000.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding {}°C?"}
{"question": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above 574.76 K.", "refer_dataset": "table3", "column names": ["A_Tm", "RH2(µmol h-1 g-1)"], "condition_column": {"A_Tm": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "min"}, "condition": {"A_Tm": ">574.76"}, "tool": "calculate_data", "answer": 8600.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above {} K."}
{"question": "What is the total sum of optb88vdw_cbm values where offset equals 0.5978046988467991?", "refer_dataset": "table52", "column names": ["optb88vdw_cbm", "offset"], "condition_column": {"offset": "="}, "answer_column": {"optb88vdw_cbm": "sum"}, "condition": {"offset": "=='0.5978046988467991'"}, "tool": "calculate_data", "answer": 6.8134, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total sum of optb88vdw_cbm values where offset equals {}?"}
{"question": "What is the maximum yield of C2 hydrocarbons for catalysts with Support material SiO5?", "refer_dataset": "table19", "column names": ["Support", "C2 yield"], "condition_column": {"Support": "="}, "answer_column": {"C2 yield": "max"}, "condition": {"Support": "=='SiO5'"}, "tool": "calculate_data", "answer": 99.9, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum yield of C2 hydrocarbons for catalysts with Support material {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than -0.0411816112500003?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.0411816112500003"}, "tool": "calculate_data", "answer": 125.65737743837221, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A81]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A81]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 13.736308097839355?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='13.736308097839355'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the average net magnetic moment for materials referenced under DOI https://doi.org/10.1016/j.ica.2004.12.011?", "refer_dataset": "table62", "column names": ["doi", "net_magmom"], "condition_column": {"doi": "="}, "answer_column": {"net_magmom": "avg"}, "condition": {"doi": "=='https://doi.org/10.1016/j.ica.2004.12.011'"}, "tool": "calculate_data", "answer": 10.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average net magnetic moment for materials referenced under DOI {}?"}
{"question": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above -3.01634556.", "refer_dataset": "table66", "column names": ["efermi", "final_energy"], "condition_column": {"efermi": ">"}, "answer_column": {"final_energy": "min"}, "condition": {"efermi": ">-3.01634556"}, "tool": "calculate_data", "answer": 485.35742061, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above {}."}
{"question": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below 1.53?", "refer_dataset": "table3", "column names": ["χpb", "ρb"], "condition_column": {"χpb": "<"}, "answer_column": {"ρb": "avg"}, "condition": {"χpb": "<1.53"}, "tool": "calculate_data", "answer": 9.10375, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below {}?"}
{"question": "What is the average reaction energy for elements with atomic number greater than 77?", "refer_dataset": "table18", "column names": ["A_AtimicN", "reaction_energy"], "condition_column": {"A_AtimicN": ">"}, "answer_column": {"reaction_energy": "avg"}, "condition": {"A_AtimicN": ">77"}, "tool": "calculate_data", "answer": 0.8401272499999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction energy for elements with atomic number greater than {}?"}
{"question": "Determine the maximum irradiation time (h) for Bi type BiOBr, Main product CH4, and loading > 0.142857143 g/l.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Main product", "loading (g/l)", "irradiation time(h)"], "condition_column": {"Bi type in photocatalyst": "=", "Main product": "=", "loading (g/l)": ">"}, "answer_column": {"irradiation time(h)": "max"}, "condition": {"Bi type in photocatalyst": "=='BiOBr'", "Main product": "=='CH4'", "loading (g/l)": ">0.142857143"}, "tool": "calculate_data", "answer": 4.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum irradiation time (h) for Bi type {}, Main product {}, and loading > {} g/l."}
{"question": "Calculate the minimum COx when Cation3-mol < 0.0%, Anion2 = 0.0, and CH4-pressure > 0.065.", "refer_dataset": "table20", "column names": ["Cation3-mol", "Anion2", "CH4-pressure", "COx"], "condition_column": {"Cation3-mol": "<", "Anion2": "=", "CH4-pressure": ">"}, "answer_column": {"COx": "min"}, "condition": {"Cation3-mol": "<0.0", "Anion2": "=='0.0'", "CH4-pressure": ">0.065"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum COx when Cation3-mol < {}%, Anion2 = {}, and CH4-pressure > {}."}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 120°C and references in study [44]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">120", "Ref.": "=='[44]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "What is the maximum ethane selectivity when O2 conv exceeds 2.5%?", "refer_dataset": "table19", "column names": ["O2 conv", "C2H6 sel"], "condition_column": {"O2 conv": ">"}, "answer_column": {"C2H6 sel": "max"}, "condition": {"O2 conv": ">2.5"}, "tool": "calculate_data", "answer": 55.8, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum ethane selectivity when O2 conv exceeds {}%?"}
{"question": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < -2.6357, scf_vbm > 1.599, and formula is 'ZnO'.", "refer_dataset": "table66", "column names": ["surf_vbm", "scf_vbm", "formula", "final_energy"], "condition_column": {"surf_vbm": "<", "scf_vbm": ">", "formula": "="}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<-2.6357", "scf_vbm": ">1.599", "formula": "=='ZnO'"}, "tool": "calculate_data", "answer": -38.72416793, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < {}, scf_vbm > {}, and formula is '{}'."}
{"question": "What is the average reaction rate (-log(k)) when pH is 6.0?", "refer_dataset": "table9", "column names": ["pH", "-log(k), min-1"], "condition_column": {"pH": "="}, "answer_column": {"-log(k), min-1": "avg"}, "condition": {"pH": "=='6.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction rate (-log(k)) when pH is {}?"}
{"question": "How many preparation methods resulted in SSA > 51.2 m²/g and AH < 10.0 hours?", "refer_dataset": "table11", "column names": ["SSA (m2 g -1 )", "AH (h)", "PM"], "condition_column": {"SSA (m2 g -1 )": ">", "AH (h)": "<"}, "answer_column": {"PM": "count"}, "condition": {"SSA (m2 g -1 )": ">51.2", "AH (h)": "<10.0"}, "tool": "calculate_data", "answer": 1, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many preparation methods resulted in SSA > {} m²/g and AH < {} hours?"}
{"question": "What is the average bulk_energy for bulk_formula Hg?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Hg'"}, "tool": "calculate_data", "answer": 53.89752, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "What is the total number of articles indexed on 2015-11-01 00:00:00 that used the electrochemical deposition method?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Judge_Electrochemical_Deposition"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Judge_Electrochemical_Deposition": "count"}, "condition": {"Indexed_Date": "=='2015-11-01 00:00:00'"}, "tool": "calculate_data", "answer": 1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total number of articles indexed on {} that used the electrochemical deposition method?"}
{"question": "Find the minimum activation energy for adsorbed species CH* on surfaces with key 4 and elements of atomic number 47.", "refer_dataset": "table18", "column names": ["ab", "surfaces_key", "A_AtimicN", "activation_energy"], "condition_column": {"ab": "=", "surfaces_key": "=", "A_AtimicN": "="}, "answer_column": {"activation_energy": "min"}, "condition": {"ab": "=='CH*'", "surfaces_key": "=='4'", "A_AtimicN": "=='47'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum activation energy for adsorbed species {} on surfaces with key {} and elements of atomic number {}."}
{"question": "Find the highest defective_energy where wycoff position is a and material_type is 2D?", "refer_dataset": "table68", "column names": ["wycoff", "material_type", "defective_energy"], "condition_column": {"wycoff": "=", "material_type": "="}, "answer_column": {"defective_energy": "max"}, "condition": {"wycoff": "=='a'", "material_type": "=='2D'"}, "tool": "calculate_data", "answer": -0.82288046, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest defective_energy where wycoff position is {} and material_type is {}?"}
{"question": "How many entries have a wycoff position of f?", "refer_dataset": "table68", "column names": ["wycoff", "jid"], "condition_column": {"wycoff": "="}, "answer_column": {"jid": "count"}, "condition": {"wycoff": "=='f'"}, "tool": "calculate_data", "answer": 19, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have a wycoff position of {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than -0.3431781066666677?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.3431781066666677"}, "tool": "calculate_data", "answer": 125.63855571146438, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.6825.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.6825"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above -0.7178921.", "refer_dataset": "table66", "column names": ["efermi", "final_energy"], "condition_column": {"efermi": ">"}, "answer_column": {"final_energy": "min"}, "condition": {"efermi": ">-0.7178921"}, "tool": "calculate_data", "answer": 263.97339737, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above {}."}
{"question": "Compute the average Catalyst dosage (g/L) for experiments where pH equals 6.3.", "refer_dataset": "table6", "column names": ["pH", "Catalyst dosage (g/L)"], "condition_column": {"pH": "="}, "answer_column": {"Catalyst dosage (g/L)": "avg"}, "condition": {"pH": "=='6.3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Catalyst dosage (g/L) for experiments where pH equals {}."}
{"question": "Find the maximum formation energy (ef) for entries where material_type is 2D?", "refer_dataset": "table68", "column names": ["material_type", "ef"], "condition_column": {"material_type": "="}, "answer_column": {"ef": "max"}, "condition": {"material_type": "=='2D'"}, "tool": "calculate_data", "answer": 9.48986, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum formation energy (ef) for entries where material_type is {}?"}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 20 minutes, pH > 10.0, and Dopant C?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<20", "pH": ">10.0", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) greater than -0.4785471074374996?", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": ">"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": ">-0.4785471074374996"}, "tool": "calculate_data", "answer": 157.7063282631904, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) greater than {}?"}
{"question": "What is the average calcination temperature for experiments using a photocatalyst dose of 0.75 g/L?", "refer_dataset": "table1", "column names": ["Photocatalyst dose(g L-1)", "Calcination temperature(K)"], "condition_column": {"Photocatalyst dose(g L-1)": "="}, "answer_column": {"Calcination temperature(K)": "avg"}, "condition": {"Photocatalyst dose(g L-1)": "=='0.75'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature for experiments using a photocatalyst dose of {} g/L?"}
{"question": "What is the minimum total energy for materials with an LCD of 2.42132?", "refer_dataset": "table62", "column names": ["lcd", "energy_total"], "condition_column": {"lcd": "="}, "answer_column": {"energy_total": "min"}, "condition": {"lcd": "=='2.42132'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum total energy for materials with an LCD of {}?"}
{"question": "What is the highest density for materials with pretty_formula equal to Li6FeS4?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='Li6FeS4'"}, "tool": "calculate_data", "answer": 2.337936405134654, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "How many unique surfaces are recorded for the element Ag?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='Ag'"}, "tool": "calculate_data", "answer": 87, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "What is the maximum bandgap observed in materials from source_id mp-1009641?", "refer_dataset": "table67", "column names": ["source_id", "bandgap"], "condition_column": {"source_id": "="}, "answer_column": {"bandgap": "max"}, "condition": {"source_id": "=='mp-1009641'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bandgap observed in materials from source_id {}?"}
{"question": "How many unique surfaces are recorded for the element Os?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='Os'"}, "tool": "calculate_data", "answer": 1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "What is the minimum Gold percentage in alloys where Ruthenium exceeds 83.4%?", "refer_dataset": "table15", "column names": ["Ru", "Au"], "condition_column": {"Ru": ">"}, "answer_column": {"Au": "min"}, "condition": {"Ru": ">83.4"}, "tool": "calculate_data", "answer": 11.6, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Gold percentage in alloys where Ruthenium exceeds {}%?"}
{"question": "What is the highest methane conversion rate when Cation1 is Na, Cation2Amount > 80%, and Support is Al2O3?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='Na'", "Cation2Amount": ">80", "Support": "=='Al2O3'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds 9.836915969848633?", "refer_dataset": "table60", "column names": ["gap", "Cv"], "condition_column": {"gap": ">"}, "answer_column": {"Cv": "min"}, "condition": {"gap": ">9.836915969848633"}, "tool": "calculate_data", "answer": 36.540000915527344, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds {}?"}
{"question": "How many synthesized compounds have a net magnetic moment above 3.0?", "refer_dataset": "table62", "column names": ["synthesized", "net_magmom"], "condition_column": {"net_magmom": ">"}, "answer_column": {"synthesized": "count"}, "condition": {"net_magmom": ">3.0"}, "tool": "calculate_data", "answer": 475, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many synthesized compounds have a net magnetic moment above {}?"}
{"question": "Find the median Band_gap_GGA where Band_gap_HSE_optical < 0.5201560000000001.", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": "<"}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Band_gap_HSE_optical": "<0.5201560000000001"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.116559}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.1012110000000001}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0501729999999991}, {"Band_gap_GGA": 0.035107}, {"Band_gap_GGA": 0.035018}, {"Band_gap_GGA": 0.036726}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.067083}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.220214}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.048536}, {"Band_gap_GGA": 0.038092}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.016113}, {"Band_gap_GGA": 0.025665}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.076361}, {"Band_gap_GGA": 0.0880399999999999}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.046588}, {"Band_gap_GGA": 0.052264}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.086018}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.026395}, {"Band_gap_GGA": 0.177484}, {"Band_gap_GGA": 0.011479}, {"Band_gap_GGA": 0.089123}, {"Band_gap_GGA": 0.288479}, {"Band_gap_GGA": 0.207136}, {"Band_gap_GGA": 0.08064}, {"Band_gap_GGA": 0.030189}, {"Band_gap_GGA": 0.035519}, {"Band_gap_GGA": 0.053101}, {"Band_gap_GGA": 0.139055}, {"Band_gap_GGA": 0.0537489999999998}, {"Band_gap_GGA": 0.076168}, {"Band_gap_GGA": 0.053609}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.118526}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.079423}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.023344}, {"Band_gap_GGA": 0.137577}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.062749}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.088268}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.010004}, {"Band_gap_GGA": 0.077827}, {"Band_gap_GGA": 0.174608}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Band_gap_GGA where Band_gap_HSE_optical < {}."}
{"question": "What is the highest Surface area (m2/g) observed when Material is MIL-101, Catalyst dosage (g/L) > 0.05, and Degradation efficiency (%) > 35.0?", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Degradation efficiency (%)", "Surface area (m2/g)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Degradation efficiency (%)": ">"}, "answer_column": {"Surface area (m2/g)": "max"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.05", "Degradation efficiency (%)": ">35.0"}, "tool": "calculate_data", "answer": 252.59, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Surface area (m2/g) observed when Material is {}, Catalyst dosage (g/L) > {}, and Degradation efficiency (%) > {}?"}
{"question": "Find the minimum formation_energy_per_atom for materials in tags [].", "refer_dataset": "table55", "column names": ["formation_energy_per_atom", "tags"], "condition_column": {"tags": "="}, "answer_column": {"formation_energy_per_atom": "min"}, "condition": {"tags": "=='[]'"}, "tool": "calculate_data", "answer": 5.205960005, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum formation_energy_per_atom for materials in tags {}."}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) NC(=O)N?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='NC(=O)N'"}, "tool": "calculate_data", "answer": -3.36994918174234, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the median atomic number of elements with activation energy below 2.07?", "refer_dataset": "table18", "column names": ["activation_energy", "A_AtimicN"], "condition_column": {"activation_energy": "<"}, "answer_column": {"A_AtimicN": "median"}, "condition": {"activation_energy": "<2.07"}, "tool": "calculate_data", "answer": [{"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 42}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 26}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, 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{"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 26}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 47}, {"A_AtimicN": 45}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median atomic number of elements with activation energy below {}?"}
{"question": "Determine the highest overpotential in acidic conditions for articles published in APPLIED SURFACE SCIENCE journal.", "refer_dataset": "table13", "column names": ["Journal_Name", "Acid_OVP"], "condition_column": {"Journal_Name": "="}, "answer_column": {"Acid_OVP": "max"}, "condition": {"Journal_Name": "=='APPLIED SURFACE SCIENCE'"}, "tool": "calculate_data", "answer": 186.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the highest overpotential in acidic conditions for articles published in {} journal."}
{"question": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below 1590.32 K.", "refer_dataset": "table3", "column names": ["A_Tb", "Rb"], "condition_column": {"A_Tb": "<"}, "answer_column": {"Rb": "median"}, "condition": {"A_Tb": "<1590.32"}, "tool": "calculate_data", "answer": [{"Rb": 67.0}, {"Rb": 65.8}, {"Rb": 64.6}, {"Rb": 63.4}, {"Rb": 62.2}, {"Rb": 61.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 66.74}, {"Rb": 66.61}, {"Rb": 66.48}, {"Rb": 66.45}, {"Rb": 72.0}, {"Rb": 72.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 66.86}, {"Rb": 74.17}, {"Rb": 74.17}, {"Rb": 74.48}, {"Rb": 73.24}, {"Rb": 73.86}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 75.1}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 72.0}, {"Rb": 66.87}, {"Rb": 72.62}, {"Rb": 66.73}, {"Rb": 74.17}, {"Rb": 67.0}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below {} K."}
{"question": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is 3.935041373?", "refer_dataset": "table22", "column names": ["Lattice", "D_AtomN"], "condition_column": {"Lattice": "="}, "answer_column": {"D_AtomN": "median"}, "condition": {"Lattice": "=='3.935041373'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is {}?"}
{"question": "What is the average Ruthenium content in alloys where Onset potential is greater than 0.49098V?", "refer_dataset": "table15", "column names": ["Ru", "Onset"], "condition_column": {"Onset": ">"}, "answer_column": {"Ru": "avg"}, "condition": {"Onset": ">0.49098"}, "tool": "calculate_data", "answer": 18.414743589743594, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Ruthenium content in alloys where Onset potential is greater than {}V?"}
{"question": "What is the highest reaction energy recorded for element Os?", "refer_dataset": "table18", "column names": ["AA", "reaction_energy"], "condition_column": {"AA": "="}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Os'"}, "tool": "calculate_data", "answer": 0.78, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy recorded for element {}?"}
{"question": "What is the minimum loading (g/l) required when light source is UV–VIS and Reaction medium is gas-solid to achieve Yield > 4.45 μmol/g/h?", "refer_dataset": "table10", "column names": ["light source", "Reaction medium", "Yield (μmol/g/h)", "loading (g/l)"], "condition_column": {"light source": "=", "Reaction medium": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"loading (g/l)": "min"}, "condition": {"light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'", "Yield (μmol/g/h)": ">4.45"}, "tool": "calculate_data", "answer": 0.25, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum loading (g/l) required when light source is {} and Reaction medium is {} to achieve Yield > {} μmol/g/h?"}
{"question": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is n-Propanol, temperature (T) is 40°C, and initial concentration (C0) is below 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "C0, mg/L", "-log(k), min-1"], "condition_column": {"OC": "=", "T, oC": "=", "C0, mg/L": "<"}, "answer_column": {"-log(k), min-1": "max"}, "condition": {"OC": "=='n-Propanol'", "T, oC": "=='40'", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is {}, temperature (T) is {}°C, and initial concentration (C0) is below {} mg/L."}
{"question": "Retrieve the ID with the highest Tc for materials where formula contains La1.85Ca0.989Sr0.161Cu2O5.93 and Tc exceeds 13.0.", "refer_dataset": "table65", "column names": ["id", "formula", "Tc"], "condition_column": {"formula": "=", "Tc": ">"}, "answer_column": {"id": "max"}, "condition": {"formula": "=='La1.85Ca0.989Sr0.161Cu2O5.93'", "Tc": ">13.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Retrieve the ID with the highest Tc for materials where formula contains {} and Tc exceeds {}."}
{"question": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above 7.862 eV, the density of element B (ρb) exceeds 7.74 g/cm³, and the tolerance factor (t) is less than 0.886.", "refer_dataset": "table3", "column names": ["I1b", "ρb", "t", "A_Tb"], "condition_column": {"I1b": ">", "ρb": ">", "t": "<"}, "answer_column": {"A_Tb": "max"}, "condition": {"I1b": ">7.862", "ρb": ">7.74", "t": "<0.886"}, "tool": "calculate_data", "answer": 3520.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above {} eV, the density of element B (ρb) exceeds {} g/cm³, and the tolerance factor (t) is less than {}."}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) C=O?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='C=O'"}, "tool": "calculate_data", "answer": -4.02684653612837, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What Light Wavelength achieves Degradation Rate above 86.0% within 40 minutes of Illumination Time for Dopant C?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Degradation rate(%)", "Illumination time(min)", "Dopant"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "Dopant": "="}, "answer_column": {"Light wavelength(nm)": ""}, "condition": {"Degradation rate(%)": ">86.0", "Illumination time(min)": "<40", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": [{"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Light Wavelength achieves Degradation Rate above {}% within {} minutes of Illumination Time for Dopant {}?"}
{"question": "What is the highest reaction energy for elements Pt with adsorbed species CCH* and activation energy greater than 2.45?", "refer_dataset": "table18", "column names": ["AA", "ab", "activation_energy", "reaction_energy"], "condition_column": {"AA": "=", "ab": "=", "activation_energy": ">"}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Pt'", "ab": "=='CCH*'", "activation_energy": ">2.45"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy for elements {} with adsorbed species {} and activation energy greater than {}?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than -0.82948836467202?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">-0.82948836467202"}, "tool": "calculate_data", "answer": -0.10574542714978376, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A152]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A152]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}, {"cycle5": "-"}, {"cycle5": "-"}, {"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "What is the highest Rhodium percentage observed in alloys with Onset potential below 0.476002V?", "refer_dataset": "table15", "column names": ["Rh", "Onset"], "condition_column": {"Onset": "<"}, "answer_column": {"Rh": "max"}, "condition": {"Onset": "<0.476002"}, "tool": "calculate_data", "answer": 45.6, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Rhodium percentage observed in alloys with Onset potential below {}V?"}
{"question": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than 4.62?", "refer_dataset": "table2", "column names": ["ρb", "t"], "condition_column": {"ρb": "<"}, "answer_column": {"t": "avg"}, "condition": {"ρb": "<4.62"}, "tool": "calculate_data", "answer": 0.8841612903225807, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than {}?"}
{"question": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > 0.345448, synthesized as True, and sourced from CSD?", "refer_dataset": "table62", "column names": ["bandgap", "synthesized", "source", "pld"], "condition_column": {"bandgap": ">", "synthesized": "=", "source": "="}, "answer_column": {"pld": "min"}, "condition": {"bandgap": ">0.345448", "synthesized": "=='True'", "source": "=='CSD'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > {}, synthesized as {}, and sourced from {}?"}
{"question": "What is the minimum formula_energy recorded for the chemical formula NTa2?", "refer_dataset": "table64", "column names": ["formula", "formula_energy"], "condition_column": {"formula": "="}, "answer_column": {"formula_energy": "min"}, "condition": {"formula": "=='NTa2'"}, "tool": "calculate_data", "answer": -0.93811153478, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum formula_energy recorded for the chemical formula {}?"}
{"question": "Calculate the minimum CH4-pressure when C2-selectivity is greater than 44.8%?", "refer_dataset": "table20", "column names": ["CH4-pressure", "C2-selectivity"], "condition_column": {"C2-selectivity": ">"}, "answer_column": {"CH4-pressure": "min"}, "condition": {"C2-selectivity": ">44.8"}, "tool": "calculate_data", "answer": 0.97, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum CH4-pressure when C2-selectivity is greater than {}%?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than -0.7648113232533321?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.7648113232533321"}, "tool": "calculate_data", "answer": 130.49893997630556, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "For materials in space group symbol Fm-3m, what is the minimum stress tensor value observed?", "refer_dataset": "table59", "column names": ["spacegroup_symbol", "stress"], "condition_column": {"spacegroup_symbol": "="}, "answer_column": {"stress": "min"}, "condition": {"spacegroup_symbol": "=='Fm-3m'"}, "tool": "calculate_data", "answer": "[[9.826322673643141e-06, 0.0, 3.645513621662518e-21], [6.075856036104198e-22, 9.826322673643144e-06, 2.4303424144416787e-21], [3.0379280180520984e-21, 2.4303424144416787e-21, 9.826322673643144e-06]]", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials in space group symbol {}, what is the minimum stress tensor value observed?"}
{"question": "How many references document samples calcined for over 15.0 hours?", "refer_dataset": "table1", "column names": ["Calcination time(h)", "Ref"], "condition_column": {"Calcination time(h)": ">"}, "answer_column": {"Ref": "count"}, "condition": {"Calcination time(h)": ">15.0"}, "tool": "calculate_data", "answer": 35, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document samples calcined for over {} hours?"}
{"question": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > 0.0, Mg < 0.1, and La = 0.0?", "refer_dataset": "table16", "column names": ["Ca", "Mg", "La", "J.uAcm2_0.80_fromCV"], "condition_column": {"Ca": ">", "Mg": "<", "La": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "max"}, "condition": {"Ca": ">0.0", "Mg": "<0.1", "La": "=='0.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > {}, Mg < {}, and La = {}?"}
{"question": "Calculate the average C2 yield (%) for catalysts with primary metal Zn, secondary metal Cs, and support material La2O3.", "refer_dataset": "table21", "column names": ["M1", "M2", "Support", "C2 yield (%)"], "condition_column": {"M1": "=", "M2": "=", "Support": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='Zn'", "M2": "=='Cs'", "Support": "=='La2O3'"}, "tool": "calculate_data", "answer": 6.786490063000003, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average C2 yield (%) for catalysts with primary metal {}, secondary metal {}, and support material {}."}
{"question": "What is the minimum Tc recorded for materials where formula contains Ca0.31Sr0.7Ti1O3?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "min"}, "condition": {"formula": "=='Ca0.31Sr0.7Ti1O3'"}, "tool": "calculate_data", "answer": 0.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Tc recorded for materials where formula contains {}?"}
{"question": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is 50.0, pH > 6.3, and Catalyst dosage (g/L) is 0.15.", "refer_dataset": "table6", "column names": ["Antibiotic dosage (mg/L)", "pH", "Catalyst dosage (g/L)", "Illumination time (min)"], "condition_column": {"Antibiotic dosage (mg/L)": "=", "pH": ">", "Catalyst dosage (g/L)": "="}, "answer_column": {"Illumination time (min)": "avg"}, "condition": {"Antibiotic dosage (mg/L)": "=='50.0'", "pH": ">6.3", "Catalyst dosage (g/L)": "=='0.15'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is {}, pH > {}, and Catalyst dosage (g/L) is {}."}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 2.18 eV, light source Visible, and Reaction medium gas-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<2.18", "light source": "=='Visible'", "Reaction medium": "=='gas-solid'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "What is the minimum Tc recorded for materials where formula contains Rh0.005Ti0.995?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "min"}, "condition": {"formula": "=='Rh0.005Ti0.995'"}, "tool": "calculate_data", "answer": 1.295, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Tc recorded for materials where formula contains {}?"}
{"question": "Find the average Degradation efficiency (%) for Material MIL-101 when Catalyst dosage (g/L) > 0.2, Illumination time (min) > 10, and pH < 4.1.", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Illumination time (min)", "pH", "Degradation efficiency (%)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Illumination time (min)": ">", "pH": "<"}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.2", "Illumination time (min)": ">10", "pH": "<4.1"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Degradation efficiency (%) for Material {} when Catalyst dosage (g/L) > {}, Illumination time (min) > {}, and pH < {}."}
{"question": "What is the average Power(W) for materials where X is O, A mole is greater than 0.03, and Wave length(<nm) below 285.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='O'", "A mole": ">0.03", "Wave length(<nm)": "<285.0"}, "tool": "calculate_data", "answer": 318.3939393939394, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "What is the highest methane conversion rate when Cation1 is V, Cation2Amount > 80%, and Support is SiO2?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='V'", "Cation2Amount": ">80", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals 4.113?", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_delta_e"], "condition_column": {"_oqmd_band_gap": "="}, "answer_column": {"_oqmd_delta_e": "max"}, "condition": {"_oqmd_band_gap": "=='4.113'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals {}?"}
{"question": "What is the highest Yield (μmol/g/h) for Bi type BiOBr, Reaction medium gas-solid, and light source UV–VIS?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Reaction medium", "light source", "Yield (μmol/g/h)"], "condition_column": {"Bi type in photocatalyst": "=", "Reaction medium": "=", "light source": "="}, "answer_column": {"Yield (μmol/g/h)": "max"}, "condition": {"Bi type in photocatalyst": "=='BiOBr'", "Reaction medium": "=='gas-solid'", "light source": "=='UV–VIS'"}, "tool": "calculate_data", "answer": 6.25, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Yield (μmol/g/h) for Bi type {}, Reaction medium {}, and light source {}?"}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 5.68508295617329?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='5.68508295617329'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the number of articles from Japan country that triggered an OER data warning?", "refer_dataset": "table13", "column names": ["Country", "Warning_OER.1"], "condition_column": {"Country": "="}, "answer_column": {"Warning_OER.1": "count"}, "condition": {"Country": "=='Japan'"}, "tool": "calculate_data", "answer": 16, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the number of articles from {} country that triggered an OER data warning?"}
{"question": "What is the minimum reaction solution volume used when the preparation method is 'Sol-gel hydrothermal method'?", "refer_dataset": "table1", "column names": ["Preparation method", "Reaction solution"], "condition_column": {"Preparation method": "="}, "answer_column": {"Reaction solution": "min"}, "condition": {"Preparation method": "=='Sol-gel hydrothermal method'"}, "tool": "calculate_data", "answer": "5/22 v/v CH3OH", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reaction solution volume used when the preparation method is '{}'?"}
{"question": "What is the maximum BandGap(eV) for composites with X1 substitution nan, Sac. Agent1 equal to Na2S, and Power(W) less than 300.0?", "refer_dataset": "table4", "column names": ["X1", "Sac. Agent1", "Power(W)", "BandGap(eV)"], "condition_column": {"X1": "=", "Sac. Agent1": "=", "Power(W)": "<"}, "answer_column": {"BandGap(eV)": "max"}, "condition": {"X1": "=='nan'", "Sac. Agent1": "=='Na2S'", "Power(W)": "<300.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum BandGap(eV) for composites with X1 substitution {}, Sac. Agent1 equal to {}, and Power(W) less than {}?"}
{"question": "For entries where dipole moment (mu) is below 2.56820011138916, what is the average polarizability (alpha)?", "refer_dataset": "table60", "column names": ["mu", "alpha"], "condition_column": {"mu": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": "<2.56820011138916"}, "tool": "calculate_data", "answer": 60.940791857351186, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For entries where dipole moment (mu) is below {}, what is the average polarizability (alpha)?"}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 20 minutes, pH > 3.0, and Dopant C?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<20", "pH": ">3.0", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "For materials with B_AtomN 46, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='46'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "What is the highest density for materials with pretty_formula equal to Na2Nb4Se4O19?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='Na2Nb4Se4O19'"}, "tool": "calculate_data", "answer": 3.9076934674797497, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above 0.353098671453079?", "refer_dataset": "table54", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"elastic anisotropy": ">"}, "answer_column": {"gap pbe": "min"}, "condition": {"elastic anisotropy": ">0.353098671453079"}, "tool": "calculate_data", "answer": 11.803, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above {}?"}
{"question": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below -9.211053848266602 and heat capacity (Cv) exceeds 10.097999572753906?", "refer_dataset": "table60", "column names": ["homo", "Cv", "zpve"], "condition_column": {"homo": "<", "Cv": ">"}, "answer_column": {"zpve": "avg"}, "condition": {"homo": "<-9.211053848266602", "Cv": ">10.097999572753906"}, "tool": "calculate_data", "answer": 1.3983586470286051, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below {} and heat capacity (Cv) exceeds {}?"}
{"question": "Determine the total CO yield (COy) when Support_ID is 14 and M1_atom_number is less than 25.", "refer_dataset": "table17", "column names": ["Support_ID", "M1_atom_number", "COy"], "condition_column": {"Support_ID": "=", "M1_atom_number": "<"}, "answer_column": {"COy": "sum"}, "condition": {"Support_ID": "=='14'", "M1_atom_number": "<25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total CO yield (COy) when Support_ID is {} and M1_atom_number is less than {}."}
{"question": "What is the maximum light intensity (I) recorded for organic compound Benzoic acid with nanoparticle dose (D) ≥ 1.875 g/L and reaction rate (-log(k)) > 0.5246?", "refer_dataset": "table9", "column names": ["OC", "D, g/L", "-log(k), min-1", "I, mW/cm2"], "condition_column": {"OC": "=", "D, g/L": ">=", "-log(k), min-1": ">"}, "answer_column": {"I, mW/cm2": "max"}, "condition": {"OC": "=='Benzoic acid'", "D, g/L": ">=1.875", "-log(k), min-1": ">0.5246"}, "tool": "calculate_data", "answer": 0.176, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum light intensity (I) recorded for organic compound {} with nanoparticle dose (D) ≥ {} g/L and reaction rate (-log(k)) > {}?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than 0.93, Element B's Electronegativity (χpb) is less than 1.54, and the Tolerance Factor (t) is 0.92?", "refer_dataset": "table2", "column names": ["χpa", "χpb", "t", "Eg(eV)"], "condition_column": {"χpa": ">", "χpb": "<", "t": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"χpa": ">0.93", "χpb": "<1.54", "t": "=='0.92'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than {}, Element B's Electronegativity (χpb) is less than {}, and the Tolerance Factor (t) is {}?"}
{"question": "Find the minimum formation energy per atom for compounds in the space group number 74.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "min"}, "condition": {"spacegroup_number": "=='74'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum formation energy per atom for compounds in the space group number {}."}
{"question": "Calculate the maximum offset value where optb88vdw_vbm is below 6.7298.", "refer_dataset": "table52", "column names": ["offset", "optb88vdw_vbm"], "condition_column": {"optb88vdw_vbm": "<"}, "answer_column": {"offset": "max"}, "condition": {"optb88vdw_vbm": "<6.7298"}, "tool": "calculate_data", "answer": "{}", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum offset value where optb88vdw_vbm is below {}."}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 1.12422472457635.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<1.12422472457635"}, "tool": "calculate_data", "answer": [{"U": 5.85213296706841}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 4.28237851192289}, {"U": 2.92411819429234}, {"U": 3.06909011621485}, {"U": 3.53668171969642}, {"U": 3.36763795283073}, {"U": 3.83280486597178}, {"U": 3.48205825390004}, {"U": 3.84218486416411}, {"U": 3.91996307758737}, {"U": 3.59120067297812}, {"U": 4.04224794538619}, {"U": 3.07303546364394}, {"U": 3.00402846301502}, {"U": 2.32843082719585}, {"U": 3.10486997561481}, {"U": 2.77914365955695}, {"U": 3.06939058969455}, {"U": 2.29578111761049}, {"U": 2.73295174088221}, {"U": 2.7462483455621}, {"U": 3.20788012289417}, {"U": 2.81559501186372}, {"U": 3.01722055518023}, {"U": 3.53752565825245}, {"U": 3.37981888641644}, {"U": 2.87727568521372}, {"U": 3.31659404066207}, {"U": 3.5800413492234}, {"U": 3.40896742676009}, {"U": 3.67920543596261}, {"U": 3.19802459276005}, {"U": 3.41227002222391}, {"U": 3.7561109698883}, {"U": 3.50620848322923}, {"U": 3.85279288440392}, {"U": 3.79629603178194}, {"U": 4.07281263030373}, {"U": 4.01220582304204}, {"U": 3.343989383572}, {"U": 3.70197087447231}, {"U": 3.48011432112703}, {"U": 2.99771851994134}, {"U": 2.20011297448726}, {"U": 2.87185932414054}, {"U": 3.10782767978019}, {"U": 3.04636386989815}, {"U": 3.39147725742875}, {"U": 2.33181180704568}, {"U": 2.76428981840836}, {"U": 3.05134389122255}, {"U": 3.14268260342526}, {"U": 3.11768059710145}, {"U": 2.81154776473282}, {"U": 3.33365570868323}, {"U": 3.60468278737157}, {"U": 3.67911398751226}, {"U": 3.95505054157759}, {"U": 2.90524062132865}, {"U": 3.42470701147057}, {"U": 3.70139344282871}, {"U": 3.40352493755824}, {"U": 2.11772837197957}, {"U": 3.34306967344284}, {"U": 2.91047147268827}, {"U": 3.57964681448049}, {"U": 4.10826066246959}, {"U": 4.04158951654372}, {"U": 4.06600625278533}, {"U": 4.09285029218034}, {"U": 3.92455117698173}, {"U": 4.43969858745459}, {"U": 4.3833846317333}, {"U": 4.3600104078256}, {"U": 4.95561416491033}, {"U": 4.48485583223402}, {"U": 4.99847997280546}, {"U": 5.56271429860964}, {"U": 2.93806538937609}, {"U": 2.5419107024897}, {"U": 1.76650100234032}, {"U": 2.35525135127506}, {"U": 2.88729059693273}, {"U": 3.15656186537448}, {"U": 3.06547137039413}, {"U": 3.35502851793485}, {"U": 3.64805025533714}, {"U": 1.89117659391239}, {"U": 2.1821028553954}, {"U": 2.64545125078105}, {"U": 2.6406645776088}, {"U": 2.39771739880154}, {"U": 2.6839196946211}, {"U": 3.14934788904884}, {"U": 3.12904633307267}, {"U": 2.66695992630175}, {"U": 3.13765032584352}, {"U": 3.10786948478607}, {"U": 1.89657727810837}, {"U": 2.35611619233402}, {"U": 2.19279448564694}, {"U": 2.64948543384761}, {"U": 2.40585108525634}, {"U": 2.85478720486792}, {"U": 2.70098658826799}, {"U": 3.14826095889619}, {"U": 2.67689384082188}, {"U": 3.11768059710145}, {"U": 3.41623627215593}, {"U": 1.9167795471956}, {"U": 2.38252389198024}, {"U": 1.87960705853756}, {"U": 2.37801678978476}, {"U": 2.8860834773882}, {"U": 2.86988403761313}, {"U": 3.35562946489425}, {"U": 1.9021556335793}, {"U": 1.83801369050864}, {"U": 1.16038589909186}, {"U": 1.92953268679917}, {"U": 2.28527238425964}, {"U": 2.72447316312897}, {"U": 1.03726754398848}, {"U": 1.81408032464741}, {"U": 2.31258411715782}, {"U": 2.65920771052552}, {"U": 2.75568582563751}, {"U": 3.09788853963433}, {"U": 2.58501950198145}, {"U": 2.8723766610882}, {"U": 2.41553678255411}, {"U": 2.60964265043955}, {"U": 2.82259473753427}, {"U": 2.86177386647413}, {"U": 2.84902856530917}, {"U": 3.06817563171142}, {"U": 3.27877618722589}, {"U": 3.30953422029558}, {"U": 1.95777719389086}, {"U": 1.16853003679813}, {"U": 1.59527292391786}, {"U": 1.87619995055906}, {"U": 1.93984807199787}, {"U": 1.7171136135293}, {"U": 1.91925649379347}, {"U": 1.13575752500802}, {"U": 1.57278444357206}, {"U": 1.57857443688521}, {"U": 2.04017224765001}, {"U": 1.84336995688588}, {"U": 1.95611805772034}, {"U": 2.39647631268974}, {"U": 2.35541857129854}, {"U": 2.54799071803108}, {"U": 2.39293595125502}, {"U": 2.81528147431969}, {"U": 3.31151473244873}, {"U": 3.23426692003746}, {"U": 1.13787651624311}, {"U": 1.5713264939923}, {"U": 1.89686207471087}, {"U": 2.3313362751039}, {"U": 1.60660730613468}, {"U": 2.06615405879892}, {"U": 2.19719446251488}, {"U": 1.70976377093458}, {"U": 2.14155983813899}, {"U": 2.39778794474894}, {"U": 2.25440983867527}, {"U": 2.48600695838852}, {"U": 1.77758716733477}, {"U": 3.51293908917448}, {"U": 3.8794096090795}, {"U": 4.26122256613922}, {"U": 3.6358719345643}, {"U": 4.00801487120346}, {"U": 3.77914030249757}, {"U": 2.24843172283569}, {"U": 2.59098194094382}, {"U": 3.11062338954783}, {"U": 3.46630560512522}, {"U": 3.03605893595091}, {"U": 3.38471268491623}, {"U": 3.74454404732633}, {"U": 2.34274381608099}, {"U": 2.68851301964119}, {"U": 3.11872310943536}, {"U": 3.4701333759753}, {"U": 2.45309335470359}, {"U": 2.60818992648553}, {"U": 2.82854411243231}, {"U": 3.22368241511346}, {"U": 2.92036880782827}, {"U": 2.64929731132119}, {"U": 2.31851781517866}, {"U": 2.67760975154742}, {"U": 2.91045579581107}, {"U": 2.76950499289079}, {"U": 3.05170968502392}, {"U": 3.41474435600891}, {"U": 3.11934757171056}, {"U": 3.48049579180561}, {"U": 2.42810441244412}, {"U": 2.6649245450784}, {"U": 2.89022739859517}, {"U": 3.16814707762652}, {"U": 3.25061790295881}, {"U": 1.13370646690747}, {"U": 1.93469560502425}, {"U": 1.58463354992366}, {"U": 1.85484020537177}, {"U": 2.38910556759208}, {"U": 2.3677850145978}, {"U": 2.63449833924281}, {"U": 2.73792914939374}, {"U": 1.67643734281668}, {"U": 1.91225938093578}, {"U": 1.842032196698}, {"U": 1.94189913009842}, {"U": 1.87698640723201}, {"U": 2.20871435444524}, {"U": 2.70000155781715}, {"U": 2.42857471876017}, {"U": 2.69844432134845}, {"U": 2.61594475507462}, {"U": 2.96470562936748}, {"U": 1.94760551339983}, {"U": 1.17218536199899}, {"U": 1.92810347816095}, {"U": 1.61473054133801}, {"U": 1.96951656210204}, {"U": 2.70679225845834}, {"U": 1.64236887584457}, {"U": 2.16560816776636}, {"U": 2.50778997926025}, {"U": 2.42360776150011}, {"U": 2.77105961654662}, {"U": 2.48630481905535}, {"U": 2.42250515447025}, {"U": 2.76595418020461}, {"U": 1.73075772232049}, {"U": 2.25303549910725}, {"U": 2.51584789414191}, {"U": 2.50045581354273}, {"U": 1.70911056771784}, {"U": 2.14877381446463}, {"U": 2.21095092225935}, {"U": 2.41215318989141}, {"U": 2.23273916875681}, {"U": 2.49787696724305}, {"U": 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0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "What is the minimum desorption temperature (DT) observed for samples aged over 12 hours?", "refer_dataset": "table11", "column names": ["AH (h)", "DT (℃)"], "condition_column": {"AH (h)": ">"}, "answer_column": {"DT (℃)": "min"}, "condition": {"AH (h)": ">12"}, "tool": "calculate_data", "answer": 100, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum desorption temperature (DT) observed for samples aged over {} hours?"}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is Hf, Support is La2O3, and CH4/O2 ratio is 6?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='Hf'", "Support": "=='La2O3'", "CH4/O2 (mol/mol)": "=='6'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 5.62 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<5.62"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 240 minutes, pH > 7.0, and Dopant Fe?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<240", "pH": ">7.0", "Dopant": "=='Fe'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "For Support1 27, what is the maximum C2-yield?", "refer_dataset": "table20", "column names": ["Support1", "C2-yield"], "condition_column": {"Support1": "="}, "answer_column": {"C2-yield": "max"}, "condition": {"Support1": "=='27'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For Support1 {}, what is the maximum C2-yield?"}
{"question": "What is the maximum pH recorded for Pollutant RhB under Light Wavelength 420 nm?", "refer_dataset": "table8", "column names": ["Pollutant", "Light wavelength(nm)", "pH"], "condition_column": {"Pollutant": "=", "Light wavelength(nm)": "<"}, "answer_column": {"pH": "max"}, "condition": {"Pollutant": "=='RhB'", "Light wavelength(nm)": "<420"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH recorded for Pollutant {} under Light Wavelength {} nm?"}
{"question": "Calculate the average reaction temperature for noble metal none, synthesis time nan hours, and additional components containing CN.", "refer_dataset": "table7", "column names": ["Noble_Metal", "Synthesis_Time", "Additional", "Rxn_Temp"], "condition_column": {"Noble_Metal": "=", "Synthesis_Time": "=", "Additional": "="}, "answer_column": {"Rxn_Temp": "avg"}, "condition": {"Noble_Metal": "=='none'", "Synthesis_Time": "=='nan'", "Additional": "=='CN'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average reaction temperature for noble metal {}, synthesis time {} hours, and additional components containing {}."}
{"question": "What is the average BandGap(eV) for materials where B is Ni?", "refer_dataset": "table4", "column names": ["B", "BandGap(eV)"], "condition_column": {"B": "="}, "answer_column": {"BandGap(eV)": "avg"}, "condition": {"B": "=='Ni'"}, "tool": "calculate_data", "answer": 2.635, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average BandGap(eV) for materials where B is {}?"}
{"question": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above 97.79 K.", "refer_dataset": "table3", "column names": ["A_Tm", "RH2(µmol h-1 g-1)"], "condition_column": {"A_Tm": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "min"}, "condition": {"A_Tm": ">97.79"}, "tool": "calculate_data", "answer": 8600.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above {} K."}
{"question": "Calculate the average nanoparticle dose (D) for organic compound Biphthalate under light intensity (I) > 0.176 mW/cm² and initial concentration (C0) < 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2", "C0, mg/L", "D, g/L"], "condition_column": {"OC": "=", "I, mW/cm2": ">", "C0, mg/L": "<"}, "answer_column": {"D, g/L": "avg"}, "condition": {"OC": "=='Biphthalate'", "I, mW/cm2": ">0.176", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average nanoparticle dose (D) for organic compound {} under light intensity (I) > {} mW/cm² and initial concentration (C0) < {} mg/L."}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 2.9868473467998.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<2.9868473467998"}, "tool": "calculate_data", "answer": [{"U": 6.19311549745637}, {"U": 6.46228747900917}, {"U": 5.74085587987803}, {"U": 6.09199180106694}, {"U": 5.85213296706841}, {"U": 5.33647867089936}, {"U": 4.54692058907546}, {"U": 4.88454826774226}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 4.1619487412596}, {"U": 4.19426139798513}, {"U": 4.76626100362987}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 2.9854853300983}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 3.72489046894116}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 4.28237851192289}, {"U": 3.00182324895532}, {"U": 3.01987778586592}, {"U": 3.78009136638114}, {"U": 2.80742213321591}, {"U": 3.58342232907322}, {"U": 3.34822214041645}, {"U": 3.59604221522057}, {"U": 3.59705598661295}, {"U": 2.92411819429234}, {"U": 3.06909011621485}, {"U": 3.53668171969642}, {"U": 3.36763795283073}, {"U": 3.83280486597178}, {"U": 1.05065037149298}, {"U": 1.81243163972837}, {"U": 3.48205825390004}, {"U": 3.84218486416411}, {"U": 3.91996307758737}, {"U": 3.59120067297812}, {"U": 4.04224794538619}, {"U": 2.22476225107403}, {"U": 2.56144409148299}, {"U": 3.07303546364394}, {"U": 3.00402846301502}, {"U": 3.34725539965568}, {"U": 2.32843082719585}, {"U": 3.10486997561481}, {"U": 2.77914365955695}, {"U": 3.06939058969455}, {"U": 2.29578111761049}, {"U": 2.73295174088221}, {"U": 2.7462483455621}, {"U": 3.20788012289417}, {"U": 2.81559501186372}, {"U": 3.01722055518023}, {"U": 3.47164880743813}, {"U": 3.53752565825245}, {"U": 1.83656619218035}, {"U": 2.59857477513516}, {"U": 1.82454464017953}, {"U": 1.85095756545149}, {"U": 1.63625750654878}, {"U": 2.40314682393905}, {"U": 2.40901781445108}, {"U": 3.37981888641644}, {"U": 2.87727568521372}, {"U": 3.31659404066207}, {"U": 3.5800413492234}, {"U": 3.40896742676009}, {"U": 3.67920543596261}, {"U": 1.63873445314665}, {"U": 2.413869807945}, {"U": 2.42779348771295}, {"U": 2.40806936338038}, {"U": 3.20486493684571}, {"U": 1.6442474882959}, {"U": 2.42053248075571}, {"U": 2.18323681617965}, {"U": 2.40683350289431}, {"U": 3.19802459276005}, {"U": 3.10030277872339}, {"U": 3.41227002222391}, {"U": 3.7561109698883}, {"U": 4.11030388213154}, {"U": 3.50620848322923}, {"U": 3.85279288440392}, {"U": 3.79629603178194}, {"U": 4.07281263030373}, {"U": 4.01220582304204}, {"U": 3.343989383572}, {"U": 3.70197087447231}, {"U": 3.48011432112703}, {"U": 2.99771851994134}, {"U": 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0.83194487046524}, {"U": 0.84336024988093}, {"U": 1.11763766777575}, {"U": 0.82945747261591}, {"U": 1.10670304592758}, {"U": 0.83144582320765}, {"U": 1.10423132495545}, {"U": -0.451758832007}, {"U": 0.05719098634546}, {"U": 0.32545370902057}, {"U": 0.05198626311451}, {"U": 0.83160520479254}, {"U": 0.32289576522383}, {"U": 0.82306914515622}, {"U": 1.10490543067512}, {"U": -0.16529525490075}, {"U": 0.34283675302437}, {"U": 0.61549161412881}, {"U": 0.33741516632545}, {"U": 0.83953247903085}, {"U": 1.12195403463194}, {"U": 1.11910084298124}, {"U": 1.61456854694026}, {"U": 1.60701229212905}, {"U": 1.33528236677951}, {"U": 1.34363552951513}, {"U": 1.61223269223721}, {"U": 1.34519276598383}, {"U": 1.62650648892934}, {"U": 1.62129392725978}, {"U": 1.88609206007332}, {"U": 0.7265936428571}, {"U": 1.23522992366553}, {"U": 1.5090683889987}, {"U": 1.01337598313312}, {"U": 1.52077379064262}, {"U": -0.43341427286817}, {"U": 0.06862465545122}, {"U": 0.33831136113882}, {"U": 0.77490193995407}, {"U": 0.57407591737485}, {"U": 0.84317735298024}, {"U": 1.2810560485389}, {"U": 1.11634693821948}, {"U": 0.79919587399094}, {"U": 1.55600757215339}, {"U": -0.42890717067269}, {"U": 0.07262748476338}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than -1.4044813563392855?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-1.4044813563392855"}, "tool": "calculate_data", "answer": 171.055175822565, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "Calculate the maximum offset value where optb88vdw_vbm is below 4.0042.", "refer_dataset": "table52", "column names": ["offset", "optb88vdw_vbm"], "condition_column": {"optb88vdw_vbm": "<"}, "answer_column": {"offset": "max"}, "condition": {"optb88vdw_vbm": "<4.0042"}, "tool": "calculate_data", "answer": "{}", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum offset value where optb88vdw_vbm is below {}."}
{"question": "Determine the minimum Calcination Temperature required for 78.0% Degradation Rate when pH is 7.0 and Catalyst/Pollutant mass ratio is 100.0.", "refer_dataset": "table8", "column names": ["Calcination temperature(°C)", "Degradation rate(%)", "pH", "Catalyst/Pollutant mass ratio"], "condition_column": {"Degradation rate(%)": "=", "pH": "=", "Catalyst/Pollutant mass ratio": "="}, "answer_column": {"Calcination temperature(°C)": "min"}, "condition": {"Degradation rate(%)": "=='78.0'", "pH": "=='7.0'", "Catalyst/Pollutant mass ratio": "=='100.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Calcination Temperature required for {}% Degradation Rate when pH is {} and Catalyst/Pollutant mass ratio is {}."}
{"question": "Find the maximum Surface area (m2/g) for Material MIL-101.", "refer_dataset": "table6", "column names": ["Material", "Surface area (m2/g)"], "condition_column": {"Material": "="}, "answer_column": {"Surface area (m2/g)": "max"}, "condition": {"Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 252.59, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Surface area (m2/g) for Material {}."}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) C#N?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='C#N'"}, "tool": "calculate_data", "answer": -4.06692710208782, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the average methane conversion rate when Cation1 is V?", "refer_dataset": "table19", "column names": ["Cation1", "Temp CH4 conv"], "condition_column": {"Cation1": "="}, "answer_column": {"Temp CH4 conv": "avg"}, "condition": {"Cation1": "=='V'"}, "tool": "calculate_data", "answer": 750.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average methane conversion rate when Cation1 is {}?"}
{"question": "What is the highest density for materials with pretty_formula equal to In3Ga?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='In3Ga'"}, "tool": "calculate_data", "answer": 6.827571874242681, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than 0.0978438718534491.", "refer_dataset": "table57", "column names": ["_oqmd_delta_e", "_oqmd_stability"], "condition_column": {"_oqmd_delta_e": ">"}, "answer_column": {"_oqmd_stability": "min"}, "condition": {"_oqmd_delta_e": ">0.0978438718534491"}, "tool": "calculate_data", "answer": 4.152984231249998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than {}."}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 110°C and references in study [32]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">110", "Ref.": "=='[32]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "What is the median Onset potential for alloys with Ru > 87.9%, Rh > 0.0%, and Pd < 8.7%?", "refer_dataset": "table15", "column names": ["Ru", "Rh", "Pd", "Onset"], "condition_column": {"Ru": ">", "Rh": ">", "Pd": "<"}, "answer_column": {"Onset": "median"}, "condition": {"Ru": ">87.9", "Rh": ">0.0", "Pd": "<8.7"}, "tool": "calculate_data", "answer": [{"Onset": 0.490676}, {"Onset": 0.485673}, {"Onset": 0.486658}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Onset potential for alloys with Ru > {}%, Rh > {}%, and Pd < {}%?"}
{"question": "Determine the average journal impact factor for articles using 0 method in Peoples R China country with overpotential below 62.0 in neutral conditions.", "refer_dataset": "table13", "column names": ["Judge_Sol_Gel", "Country", "IF", "Neutral_OVP"], "condition_column": {"Judge_Sol_Gel": "=", "Country": "=", "Neutral_OVP": "<"}, "answer_column": {"IF": "avg"}, "condition": {"Judge_Sol_Gel": "=='0'", "Country": "=='Peoples R China'", "Neutral_OVP": "<62.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average journal impact factor for articles using {} method in {} country with overpotential below {} in neutral conditions."}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant Phenol under Experimental Temperature 25°C and Light Wavelength 365 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='Phenol'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='365'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "What is the average Surface Energy (surf_en) for materials with the chemical formula 'SiC'?", "refer_dataset": "table66", "column names": ["formula", "surf_en"], "condition_column": {"formula": "="}, "answer_column": {"surf_en": "avg"}, "condition": {"formula": "=='SiC'"}, "tool": "calculate_data", "answer": 4.808187154945441, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Energy (surf_en) for materials with the chemical formula '{}'?"}
{"question": "What is the maximum initial concentration (C0) recorded for reference number 17?", "refer_dataset": "table9", "column names": ["C0, mg/L", "Ref"], "condition_column": {"Ref": "="}, "answer_column": {"C0, mg/L": "max"}, "condition": {"Ref": "=='17'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum initial concentration (C0) recorded for reference number {}?"}
{"question": "How many references document perovskite oxides with a calcination temperature (CT) above 700°C?", "refer_dataset": "table11", "column names": ["CT (℃)", "Ref."], "condition_column": {"CT (℃)": ">"}, "answer_column": {"Ref.": "count"}, "condition": {"CT (℃)": ">700"}, "tool": "calculate_data", "answer": 49, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document perovskite oxides with a calcination temperature (CT) above {}°C?"}
{"question": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below 1400.2 K.", "refer_dataset": "table3", "column names": ["A_Tb", "Rb"], "condition_column": {"A_Tb": "<"}, "answer_column": {"Rb": "median"}, "condition": {"A_Tb": "<1400.2"}, "tool": "calculate_data", "answer": [{"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 72.0}, {"Rb": 72.0}, {"Rb": 66.86}, {"Rb": 74.17}, {"Rb": 74.17}, {"Rb": 74.48}, {"Rb": 73.24}, {"Rb": 73.86}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 75.1}, {"Rb": 67.0}, {"Rb": 72.62}, {"Rb": 74.17}, {"Rb": 67.0}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below {} K."}
{"question": "For Support1 62, what is the maximum C2-yield?", "refer_dataset": "table20", "column names": ["Support1", "C2-yield"], "condition_column": {"Support1": "="}, "answer_column": {"C2-yield": "max"}, "condition": {"Support1": "=='62'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For Support1 {}, what is the maximum C2-yield?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -4.47449996619039 and the HOMO-LUMO gap (gap) is less than 4.0378835477359?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-4.47449996619039", "gap": "<4.0378835477359"}, "tool": "calculate_data", "answer": 2.05689453649337, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "Find the minimum formation energy per atom for compounds in the space group number 191.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "min"}, "condition": {"spacegroup_number": "=='191'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum formation energy per atom for compounds in the space group number {}."}
{"question": "What is the average band_gap for materials with nelements equal to 6?", "refer_dataset": "table55", "column names": ["band_gap", "nelements"], "condition_column": {"nelements": "="}, "answer_column": {"band_gap": "avg"}, "condition": {"nelements": "=='6'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average band_gap for materials with nelements equal to {}?"}
{"question": "Determine the average H2 selectivity when Cation1 is V, Cation3Amount > 0%, and O2 conv < 25.1%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='V'", "Cation3Amount": ">0", "O2 conv": "<25.1"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "Calculate the maximum ethylene yield (C2H4y) when M2 is Ca and M3_mol is 0.185.", "refer_dataset": "table17", "column names": ["M2", "M3_mol", "C2H4y"], "condition_column": {"M2": "=", "M3_mol": "="}, "answer_column": {"C2H4y": "max"}, "condition": {"M2": "=='Ca'", "M3_mol": "=='0.185'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum ethylene yield (C2H4y) when M2 is {} and M3_mol is {}."}
{"question": "Compute the average Catalyst dosage (g/L) for experiments where pH equals 5.0.", "refer_dataset": "table6", "column names": ["pH", "Catalyst dosage (g/L)"], "condition_column": {"pH": "="}, "answer_column": {"Catalyst dosage (g/L)": "avg"}, "condition": {"pH": "=='5.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Catalyst dosage (g/L) for experiments where pH equals {}."}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 2.79 eV, light source UV–VIS, and Reaction medium gas-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<2.79", "light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'"}, "tool": "calculate_data", "answer": 2.904326923076923, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) C?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='C'"}, "tool": "calculate_data", "answer": -4.11464477806684, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the maximum Tc for materials with formula containing Pb0.5Ca1Sr2Y0.5Cu2O6.97?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "max"}, "condition": {"formula": "=='Pb0.5Ca1Sr2Y0.5Cu2O6.97'"}, "tool": "calculate_data", "answer": 55.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Tc for materials with formula containing {}?"}
{"question": "For materials with B_AtomN 76, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='76'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) greater than 0.0016083399999999?", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": ">"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": ">0.0016083399999999"}, "tool": "calculate_data", "answer": 159.68324563454667, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) greater than {}?"}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 1.440634743%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">1.440634743"}, "tool": "calculate_data", "answer": 48.26126007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "Determine the total CO yield (COy) when Support_ID is 11 and M1_atom_number is less than 25.", "refer_dataset": "table17", "column names": ["Support_ID", "M1_atom_number", "COy"], "condition_column": {"Support_ID": "=", "M1_atom_number": "<"}, "answer_column": {"COy": "sum"}, "condition": {"Support_ID": "=='11'", "M1_atom_number": "<25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total CO yield (COy) when Support_ID is {} and M1_atom_number is less than {}."}
{"question": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than 76?", "refer_dataset": "table22", "column names": ["B_AtomN", "Direct_Band"], "condition_column": {"B_AtomN": ">"}, "answer_column": {"Direct_Band": "max"}, "condition": {"B_AtomN": ">76"}, "tool": "calculate_data", "answer": 2.9, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than {}?"}
{"question": "What is the highest indirect band gap among materials with energy per atom below -195.1937 and space group number 225.0?", "refer_dataset": "table59", "column names": ["energy_per_atom", "spacegroup_number", "indir_gap"], "condition_column": {"energy_per_atom": "<", "spacegroup_number": "="}, "answer_column": {"indir_gap": "max"}, "condition": {"energy_per_atom": "<-195.1937", "spacegroup_number": "=='225.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest indirect band gap among materials with energy per atom below {} and space group number {}?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Direct\", Band_gap_HSE_optical < 1.692346, and Magnetic_ordering \"FM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Direct'", "Band_gap_HSE_optical": "<1.692346", "Magnetic_ordering": "=='FM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.521741}, {"Band_gap_GGA": 0.436652}, {"Band_gap_GGA": 0.107833}, {"Band_gap_GGA": 0.281613}, {"Band_gap_GGA": 0.298167}, {"Band_gap_GGA": 0.011479}, {"Band_gap_GGA": 0.3214700000000001}, {"Band_gap_GGA": 0.715366}, {"Band_gap_GGA": 0.114593}, {"Band_gap_GGA": 1.016602}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "What is the average final_energy for materials where optb88vdw_bandgap exceeds -0.5526?", "refer_dataset": "table52", "column names": ["final_energy", "optb88vdw_bandgap"], "condition_column": {"optb88vdw_bandgap": ">"}, "answer_column": {"final_energy": "avg"}, "condition": {"optb88vdw_bandgap": ">-0.5526"}, "tool": "calculate_data", "answer": -265.06372656595653, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average final_energy for materials where optb88vdw_bandgap exceeds {}?"}
{"question": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above 1125.245?", "refer_dataset": "table16", "column names": ["Ca", "J.uAcm2_0.80_fromCV"], "condition_column": {"J.uAcm2_0.80_fromCV": ">"}, "answer_column": {"Ca": "avg"}, "condition": {"J.uAcm2_0.80_fromCV": ">1125.245"}, "tool": "calculate_data", "answer": 0.1285714285714286, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above {}?"}
{"question": "What is the average Degradation efficiency (%) when pH is 4.1?", "refer_dataset": "table6", "column names": ["pH", "Degradation efficiency (%)"], "condition_column": {"pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"pH": "=='4.1'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when pH is {}?"}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is Ba, Support is BaO, and CH4/O2 ratio is 4?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='Ba'", "Support": "=='BaO'", "CH4/O2 (mol/mol)": "=='4'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is 3.745885406?", "refer_dataset": "table22", "column names": ["Lattice", "D_AtomN"], "condition_column": {"Lattice": "="}, "answer_column": {"D_AtomN": "median"}, "condition": {"Lattice": "=='3.745885406'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is {}?"}
{"question": "What is the average number of citations for studies indexed in 2021-10-29 00:00:00?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Cited_Time"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Cited_Time": "avg"}, "condition": {"Indexed_Date": "=='2021-10-29 00:00:00'"}, "tool": "calculate_data", "answer": 3.6666666666666665, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of citations for studies indexed in {}?"}
{"question": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > 0.0, Mg < 0.2, and La = 0.2?", "refer_dataset": "table16", "column names": ["Ca", "Mg", "La", "J.uAcm2_0.80_fromCV"], "condition_column": {"Ca": ">", "Mg": "<", "La": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "max"}, "condition": {"Ca": ">0.0", "Mg": "<0.2", "La": "=='0.2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > {}, Mg < {}, and La = {}?"}
{"question": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than 0.1074050600000005.", "refer_dataset": "table56", "column names": ["gap pbe", "e_hull"], "condition_column": {"e_hull": "<"}, "answer_column": {"gap pbe": "max"}, "condition": {"e_hull": "<0.1074050600000005"}, "tool": "calculate_data", "answer": 7.7947, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than {}."}
{"question": "What is the maximum CH4 conversion (%) recorded when M1 is Zn, temperature exceeds 700°C, and total flow is below 20 mL/min?", "refer_dataset": "table21", "column names": ["M1", "Temp. (°C)", "Total flow(mL/min)", "CH4 conversion (%)"], "condition_column": {"M1": "=", "Temp. (°C)": ">", "Total flow(mL/min)": "<"}, "answer_column": {"CH4 conversion (%)": "max"}, "condition": {"M1": "=='Zn'", "Temp. (°C)": ">700", "Total flow(mL/min)": "<20"}, "tool": "calculate_data", "answer": 55.76925153, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum CH4 conversion (%) recorded when M1 is {}, temperature exceeds {}°C, and total flow is below {} mL/min?"}
{"question": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below 3229.78 K.", "refer_dataset": "table3", "column names": ["A_Tb", "Rb"], "condition_column": {"A_Tb": "<"}, "answer_column": {"Rb": "median"}, "condition": {"A_Tb": "<3229.78"}, "tool": "calculate_data", "answer": [{"Rb": 67.0}, {"Rb": 67.02}, {"Rb": 67.04}, {"Rb": 67.06}, {"Rb": 55.0}, {"Rb": 67.0}, {"Rb": 65.8}, {"Rb": 64.6}, {"Rb": 63.4}, {"Rb": 62.2}, {"Rb": 61.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 66.74}, {"Rb": 66.61}, {"Rb": 66.48}, {"Rb": 66.45}, {"Rb": 72.0}, {"Rb": 72.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 66.86}, {"Rb": 66.45}, {"Rb": 65.9}, {"Rb": 74.17}, {"Rb": 74.17}, {"Rb": 74.48}, {"Rb": 73.24}, {"Rb": 73.86}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 75.1}, {"Rb": 55.0}, {"Rb": 55.0}, {"Rb": 55.0}, {"Rb": 101.0}, {"Rb": 101.0}, {"Rb": 101.0}, {"Rb": 101.0}, {"Rb": 67.0}, {"Rb": 101.0}, {"Rb": 67.0}, {"Rb": 72.0}, {"Rb": 66.87}, {"Rb": 72.62}, {"Rb": 67.0}, {"Rb": 66.73}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 74.17}, {"Rb": 67.0}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below {} K."}
{"question": "What is the minimum Bandgap (Eg) observed at a loading of 0.25 g/l?", "refer_dataset": "table10", "column names": ["loading (g/l)", "Eg(eV)"], "condition_column": {"loading (g/l)": "="}, "answer_column": {"Eg(eV)": "min"}, "condition": {"loading (g/l)": "=='0.25'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Bandgap (Eg) observed at a loading of {} g/l?"}
{"question": "What is the minimum nanoparticle dose (D) used for organic compound 2-Naphthol?", "refer_dataset": "table9", "column names": ["D, g/L", "OC"], "condition_column": {"OC": "="}, "answer_column": {"D, g/L": "min"}, "condition": {"OC": "=='2-Naphthol'"}, "tool": "calculate_data", "answer": 1.875, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum nanoparticle dose (D) used for organic compound {}?"}
{"question": "Calculate the average atomic number of elements in surface -211.0 where carbon species is 5.0 and reaction energy exceeds -0.148.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-211.0'", "b_key": "=='5.0'", "reaction_energy": ">-0.148"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "For materials with B_AtomN 33, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='33'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "Calculate the median Palladium percentage for alloys where Gold percentage is under 30.9%.", "refer_dataset": "table15", "column names": ["Pd", "Au"], "condition_column": {"Au": "<"}, "answer_column": {"Pd": "median"}, "condition": {"Au": "<30.9"}, "tool": "calculate_data", "answer": [{"Pd": 24.5}, {"Pd": 22.3}, {"Pd": 15.2}, {"Pd": 16.8}, {"Pd": 15.8}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 7.6}, {"Pd": 12.8}, {"Pd": 8.7}, {"Pd": 6.0}, {"Pd": 4.8}, {"Pd": 7.0}, {"Pd": 27.9}, {"Pd": 29.7}, {"Pd": 29.7}, {"Pd": 0.3}, {"Pd": 2.3}, {"Pd": 4.7}, {"Pd": 9.6}, {"Pd": 8.0}, {"Pd": 10.2}, {"Pd": 25.1}, {"Pd": 20.1}, {"Pd": 25.2}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 1.4}, {"Pd": 0.6}, {"Pd": 0.8}, {"Pd": 2.4}, {"Pd": 1.2}, {"Pd": 2.6}, {"Pd": 5.8}, {"Pd": 7.5}, {"Pd": 9.4}, {"Pd": 39.7}, {"Pd": 42.7}, {"Pd": 40.2}, {"Pd": 9.7}, {"Pd": 9.8}, {"Pd": 9.1}, {"Pd": 8.6}, {"Pd": 3.1}, {"Pd": 2.9}, {"Pd": 3.3}, {"Pd": 3.3}, {"Pd": 2.6}, {"Pd": 4.3}, {"Pd": 2.3}, {"Pd": 2.0}, {"Pd": 1.1}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 5.2}, {"Pd": 5.0}, {"Pd": 9.8}, {"Pd": 47.1}, {"Pd": 46.9}, {"Pd": 49.8}, {"Pd": 15.8}, {"Pd": 17.8}, {"Pd": 16.8}, {"Pd": 4.3}, {"Pd": 7.0}, {"Pd": 5.0}, {"Pd": 34.9}, {"Pd": 39.2}, {"Pd": 35.1}, {"Pd": 72.8}, {"Pd": 72.0}, {"Pd": 70.7}, {"Pd": 10.2}, {"Pd": 9.6}, {"Pd": 10.2}, {"Pd": 3.4}, {"Pd": 4.0}, {"Pd": 2.4}, {"Pd": 10.2}, {"Pd": 10.2}, {"Pd": 8.0}, {"Pd": 29.2}, {"Pd": 32.1}, {"Pd": 28.2}, {"Pd": 3.1}, {"Pd": 0.0}, {"Pd": 1.9}, {"Pd": 13.2}, {"Pd": 17.6}, {"Pd": 15.3}, {"Pd": 5.7}, {"Pd": 1.3}, {"Pd": 0.6}, {"Pd": 15.3}, {"Pd": 10.7}, {"Pd": 10.2}, {"Pd": 72.8}, {"Pd": 73.5}, {"Pd": 75.3}, {"Pd": 1.6}, {"Pd": 1.9}, {"Pd": 3.0}, {"Pd": 53.9}, {"Pd": 52.9}, {"Pd": 54.2}, {"Pd": 5.4}, {"Pd": 4.3}, {"Pd": 2.1}, {"Pd": 8.1}, {"Pd": 0.0}, {"Pd": 3.1}, {"Pd": 5.8}, {"Pd": 7.5}, {"Pd": 9.1}, {"Pd": 4.1}, {"Pd": 1.7}, {"Pd": 3.3}, {"Pd": 97.9}, {"Pd": 97.7}, {"Pd": 98.1}, {"Pd": 3.1}, {"Pd": 4.0}, {"Pd": 3.4}, {"Pd": 26.2}, {"Pd": 26.4}, {"Pd": 30.0}, {"Pd": 43.8}, {"Pd": 45.9}, {"Pd": 47.3}, {"Pd": 3.3}, {"Pd": 2.6}, {"Pd": 1.7}, {"Pd": 9.4}, {"Pd": 5.8}, {"Pd": 9.1}, {"Pd": 21.9}, {"Pd": 28.7}, {"Pd": 25.8}, {"Pd": 41.7}, {"Pd": 43.3}, {"Pd": 42.1}, {"Pd": 23.4}, {"Pd": 23.1}, {"Pd": 23.8}, {"Pd": 42.5}, {"Pd": 42.5}, {"Pd": 11.5}, {"Pd": 5.8}, {"Pd": 14.0}, {"Pd": 0.3}, {"Pd": 0.5}, {"Pd": 0.0}, {"Pd": 10.9}, {"Pd": 9.1}, {"Pd": 8.3}, {"Pd": 17.6}, {"Pd": 23.0}, {"Pd": 15.3}, {"Pd": 25.0}, {"Pd": 26.3}, {"Pd": 26.7}, {"Pd": 46.6}, {"Pd": 44.7}, {"Pd": 44.6}, {"Pd": 5.4}, {"Pd": 2.1}, {"Pd": 4.9}, {"Pd": 37.3}, {"Pd": 41.6}, {"Pd": 43.9}, {"Pd": 2.9}, {"Pd": 2.9}, {"Pd": 8.6}, {"Pd": 49.8}, {"Pd": 46.9}, {"Pd": 48.2}, {"Pd": 1.4}, {"Pd": 2.9}, {"Pd": 0.8}, {"Pd": 8.0}, {"Pd": 9.6}, {"Pd": 10.2}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 29.7}, {"Pd": 26.6}, {"Pd": 27.9}, {"Pd": 26.3}, {"Pd": 25.0}, {"Pd": 30.0}, {"Pd": 40.5}, {"Pd": 45.4}, {"Pd": 47.2}, {"Pd": 46.6}, {"Pd": 45.4}, {"Pd": 40.5}, {"Pd": 54.2}, {"Pd": 52.9}, {"Pd": 47.0}, {"Pd": 53.9}, {"Pd": 47.0}, {"Pd": 54.2}, {"Pd": 2.4}, {"Pd": 2.1}, {"Pd": 1.2}, {"Pd": 19.3}, {"Pd": 23.3}, {"Pd": 12.9}, {"Pd": 30.0}, {"Pd": 28.7}, {"Pd": 26.2}, {"Pd": 44.6}, {"Pd": 46.6}, {"Pd": 45.4}, {"Pd": 5.7}, {"Pd": 1.3}, {"Pd": 0.0}, {"Pd": 48.9}, {"Pd": 39.3}, {"Pd": 38.6}, {"Pd": 1.7}, {"Pd": 4.1}, {"Pd": 2.2}, {"Pd": 15.2}, {"Pd": 17.8}, {"Pd": 15.8}, {"Pd": 0.8}, {"Pd": 0.6}, {"Pd": 2.9}, {"Pd": 43.8}, {"Pd": 42.5}, {"Pd": 45.9}, {"Pd": 41.7}, {"Pd": 43.2}, {"Pd": 42.1}, {"Pd": 10.2}, {"Pd": 15.3}, {"Pd": 13.1}, {"Pd": 42.5}, {"Pd": 47.3}, {"Pd": 45.9}, {"Pd": 29.2}, {"Pd": 28.2}, {"Pd": 26.8}, {"Pd": 22.3}, {"Pd": 27.3}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 98.1}, {"Pd": 98.8}, {"Pd": 97.9}, {"Pd": 22.1}, {"Pd": 23.9}, {"Pd": 24.6}, {"Pd": 25.2}, {"Pd": 20.1}, {"Pd": 25.2}, {"Pd": 29.2}, {"Pd": 26.8}, {"Pd": 32.1}, {"Pd": 45.4}, {"Pd": 46.6}, {"Pd": 44.7}, {"Pd": 30.0}, {"Pd": 26.7}, {"Pd": 26.3}, {"Pd": 27.3}, {"Pd": 24.5}, {"Pd": 27.3}, {"Pd": 24.5}, {"Pd": 22.3}, {"Pd": 39.0}, {"Pd": 28.0}, {"Pd": 35.6}, {"Pd": 35.2}, {"Pd": 4.8}, {"Pd": 6.0}, {"Pd": 7.6}, {"Pd": 61.6}, {"Pd": 64.9}, {"Pd": 68.4}, {"Pd": 11.2}, {"Pd": 14.0}, {"Pd": 5.8}, {"Pd": 0.0}, {"Pd": 0.5}, {"Pd": 0.2}, {"Pd": 20.0}, {"Pd": 24.0}, {"Pd": 22.1}, {"Pd": 61.6}, {"Pd": 68.4}, {"Pd": 69.6}, {"Pd": 98.1}, {"Pd": 97.7}, {"Pd": 98.8}, {"Pd": 20.0}, {"Pd": 24.0}, {"Pd": 17.8}, {"Pd": 72.8}, {"Pd": 73.5}, {"Pd": 75.3}, {"Pd": 12.6}, {"Pd": 9.1}, {"Pd": 8.3}, {"Pd": 4.6}, {"Pd": 5.6}, {"Pd": 2.9}, {"Pd": 35.4}, {"Pd": 73.5}, {"Pd": 75.3}, {"Pd": 75.3}, {"Pd": 28.2}, {"Pd": 32.1}, {"Pd": 26.8}, {"Pd": 48.2}, {"Pd": 47.1}, {"Pd": 49.8}, {"Pd": 14.0}, {"Pd": 11.5}, {"Pd": 11.2}, {"Pd": 4.6}, {"Pd": 6.5}, {"Pd": 3.0}, {"Pd": 9.8}, {"Pd": 11.9}, {"Pd": 5.0}, {"Pd": 37.3}, {"Pd": 43.1}, {"Pd": 43.9}, {"Pd": 0.2}, {"Pd": 0.3}, {"Pd": 0.0}, {"Pd": 2.5}, {"Pd": 4.4}, {"Pd": 4.3}, {"Pd": 43.2}, {"Pd": 43.3}, {"Pd": 41.7}, {"Pd": 42.5}, {"Pd": 36.1}, {"Pd": 44.7}, {"Pd": 44.6}, {"Pd": 45.4}, {"Pd": 19.3}, {"Pd": 12.9}, {"Pd": 16.5}, {"Pd": 25.2}, {"Pd": 25.2}, {"Pd": 25.1}, {"Pd": 3.1}, {"Pd": 4.0}, {"Pd": 2.4}, {"Pd": 23.0}, {"Pd": 13.2}, {"Pd": 17.6}, {"Pd": 69.6}, {"Pd": 68.4}, {"Pd": 64.9}, {"Pd": 75.8}, {"Pd": 70.7}, {"Pd": 72.0}, {"Pd": 1.4}, {"Pd": 0.6}, {"Pd": 2.9}, {"Pd": 8.1}, {"Pd": 3.1}, {"Pd": 1.9}, {"Pd": 0.0}, {"Pd": 1.1}, {"Pd": 0.0}, {"Pd": 20.5}, {"Pd": 17.3}, {"Pd": 18.2}, {"Pd": 39.0}, {"Pd": 97.9}, {"Pd": 97.7}, {"Pd": 98.8}, {"Pd": 1.6}, {"Pd": 3.0}, {"Pd": 5.6}, {"Pd": 42.1}, {"Pd": 43.2}, {"Pd": 43.3}, {"Pd": 5.0}, {"Pd": 4.2}, {"Pd": 5.5}, {"Pd": 23.9}, {"Pd": 22.9}, {"Pd": 22.1}, {"Pd": 5.0}, {"Pd": 11.9}, {"Pd": 5.2}, {"Pd": 34.8}, {"Pd": 35.9}, {"Pd": 30.2}, {"Pd": 1.9}, {"Pd": 3.0}, {"Pd": 5.6}, {"Pd": 7.0}, {"Pd": 7.9}, {"Pd": 5.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 21.2}, {"Pd": 20.5}, {"Pd": 17.3}, {"Pd": 53.9}, {"Pd": 52.9}, {"Pd": 47.0}, {"Pd": 9.7}, {"Pd": 9.1}, {"Pd": 10.7}, {"Pd": 40.2}, {"Pd": 43.1}, {"Pd": 39.7}, {"Pd": 69.6}, {"Pd": 64.9}, {"Pd": 61.6}, {"Pd": 7.7}, {"Pd": 5.6}, {"Pd": 5.0}, {"Pd": 10.7}, {"Pd": 13.1}, {"Pd": 10.2}, {"Pd": 8.1}, {"Pd": 12.8}, {"Pd": 7.6}, {"Pd": 4.2}, {"Pd": 5.0}, {"Pd": 4.9}, {"Pd": 4.3}, {"Pd": 4.4}, {"Pd": 6.2}, {"Pd": 9.8}, {"Pd": 11.9}, {"Pd": 5.2}, {"Pd": 32.5}, {"Pd": 35.9}, {"Pd": 30.2}, {"Pd": 7.7}, {"Pd": 5.6}, {"Pd": 6.5}, {"Pd": 32.1}, {"Pd": 35.2}, {"Pd": 28.0}, {"Pd": 1.7}, {"Pd": 2.2}, {"Pd": 3.3}, {"Pd": 4.6}, {"Pd": 0.6}, {"Pd": 3.0}, {"Pd": 6.4}, {"Pd": 5.6}, {"Pd": 4.6}, {"Pd": 5.5}, {"Pd": 4.9}, {"Pd": 5.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 7.0}, {"Pd": 4.3}, {"Pd": 7.9}, {"Pd": 3.2}, {"Pd": 4.1}, {"Pd": 3.2}, {"Pd": 6.5}, {"Pd": 5.0}, {"Pd": 5.6}, {"Pd": 8.2}, {"Pd": 3.2}, {"Pd": 4.1}, {"Pd": 34.9}, {"Pd": 39.2}, {"Pd": 38.8}, {"Pd": 75.3}, {"Pd": 75.3}, {"Pd": 72.8}, {"Pd": 2.4}, {"Pd": 3.4}, {"Pd": 3.1}, {"Pd": 4.2}, {"Pd": 5.5}, {"Pd": 4.9}, {"Pd": 5.7}, {"Pd": 0.0}, {"Pd": 0.6}, {"Pd": 19.2}, {"Pd": 20.6}, {"Pd": 18.2}, {"Pd": 16.4}, {"Pd": 16.8}, {"Pd": 18.2}, {"Pd": 1.2}, {"Pd": 2.6}, {"Pd": 2.1}, {"Pd": 11.2}, {"Pd": 5.8}, {"Pd": 11.5}, {"Pd": 9.1}, {"Pd": 10.7}, {"Pd": 9.8}, {"Pd": 28.0}, {"Pd": 28.7}, {"Pd": 25.8}, {"Pd": 34.8}, {"Pd": 32.5}, {"Pd": 35.9}, {"Pd": 2.6}, {"Pd": 1.7}, {"Pd": 3.3}, {"Pd": 9.8}, {"Pd": 10.7}, {"Pd": 9.7}, {"Pd": 35.6}, {"Pd": 32.1}, {"Pd": 35.2}, {"Pd": 48.2}, {"Pd": 46.9}, {"Pd": 47.1}, {"Pd": 9.2}, {"Pd": 9.4}, {"Pd": 8.7}, {"Pd": 41.6}, {"Pd": 43.1}, {"Pd": 37.3}, {"Pd": 2.3}, {"Pd": 4.3}, {"Pd": 3.0}, {"Pd": 13.2}, {"Pd": 15.3}, {"Pd": 23.0}, {"Pd": 2.7}, {"Pd": 4.7}, {"Pd": 0.3}, {"Pd": 16.5}, {"Pd": 23.3}, {"Pd": 12.9}, {"Pd": 43.1}, {"Pd": 42.7}, {"Pd": 40.2}, {"Pd": 17.8}, {"Pd": 15.2}, {"Pd": 16.8}, {"Pd": 16.8}, {"Pd": 18.2}, {"Pd": 18.4}, {"Pd": 2.3}, {"Pd": 2.0}, {"Pd": 3.0}, {"Pd": 2.9}, {"Pd": 2.9}, {"Pd": 3.1}, {"Pd": 2.7}, {"Pd": 0.3}, {"Pd": 2.3}, {"Pd": 2.3}, {"Pd": 2.7}, {"Pd": 4.7}, {"Pd": 4.6}, {"Pd": 6.4}, {"Pd": 2.9}, {"Pd": 21.2}, {"Pd": 20.5}, {"Pd": 18.2}, {"Pd": 23.4}, {"Pd": 23.8}, {"Pd": 25.0}, {"Pd": 40.5}, {"Pd": 46.6}, {"Pd": 47.2}, {"Pd": 20.6}, {"Pd": 19.2}, {"Pd": 16.0}, {"Pd": 21.9}, {"Pd": 25.8}, {"Pd": 28.0}, {"Pd": 38.8}, {"Pd": 35.1}, {"Pd": 34.9}, {"Pd": 6.5}, {"Pd": 5.0}, {"Pd": 7.7}, {"Pd": 4.3}, {"Pd": 2.1}, {"Pd": 4.9}, {"Pd": 8.2}, {"Pd": 3.2}, {"Pd": 3.2}, {"Pd": 42.5}, {"Pd": 42.5}, {"Pd": 36.1}, {"Pd": 47.3}, {"Pd": 42.5}, {"Pd": 43.8}, {"Pd": 21.2}, {"Pd": 18.2}, {"Pd": 17.3}, {"Pd": 70.7}, {"Pd": 72.8}, {"Pd": 75.8}, {"Pd": 8.7}, {"Pd": 8.1}, {"Pd": 12.8}, {"Pd": 47.0}, {"Pd": 48.9}, {"Pd": 38.6}, {"Pd": 3.3}, {"Pd": 3.3}, {"Pd": 1.7}, {"Pd": 7.5}, {"Pd": 9.1}, {"Pd": 9.4}, {"Pd": 4.8}, {"Pd": 7.6}, {"Pd": 7.0}, {"Pd": 23.8}, {"Pd": 25.0}, {"Pd": 23.1}, {"Pd": 2.0}, {"Pd": 3.0}, {"Pd": 4.3}, {"Pd": 39.7}, {"Pd": 42.7}, {"Pd": 43.1}, {"Pd": 7.0}, {"Pd": 7.6}, {"Pd": 6.0}, {"Pd": 0.6}, {"Pd": 4.6}, {"Pd": 6.5}, {"Pd": 9.0}, {"Pd": 8.7}, {"Pd": 9.2}, {"Pd": 42.5}, {"Pd": 36.1}, {"Pd": 16.4}, {"Pd": 18.2}, {"Pd": 18.4}, {"Pd": 25.1}, {"Pd": 25.2}, {"Pd": 20.1}, {"Pd": 39.2}, {"Pd": 38.8}, {"Pd": 35.1}, {"Pd": 2.6}, {"Pd": 2.4}, {"Pd": 2.1}, {"Pd": 39.0}, {"Pd": 26.2}, {"Pd": 26.4}, {"Pd": 28.7}, {"Pd": 20.6}, {"Pd": 18.2}, {"Pd": 16.0}, {"Pd": 24.6}, {"Pd": 22.9}, {"Pd": 23.9}, {"Pd": 3.3}, {"Pd": 4.1}, {"Pd": 2.2}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 5.4}, {"Pd": 4.9}, {"Pd": 4.3}, {"Pd": 0.6}, {"Pd": 1.3}, {"Pd": 0.0}, {"Pd": 32.5}, {"Pd": 34.8}, {"Pd": 30.2}, {"Pd": 6.2}, {"Pd": 2.5}, {"Pd": 4.3}, {"Pd": 35.6}, {"Pd": 28.0}, {"Pd": 32.1}, {"Pd": 30.0}, {"Pd": 25.0}, {"Pd": 26.7}, {"Pd": 19.2}, {"Pd": 16.0}, {"Pd": 18.2}, {"Pd": 9.4}, {"Pd": 9.2}, {"Pd": 9.0}, {"Pd": 28.7}, {"Pd": 30.0}, {"Pd": 26.4}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 35.4}, {"Pd": 16.8}, {"Pd": 16.4}, {"Pd": 18.4}, {"Pd": 17.8}, {"Pd": 22.1}, {"Pd": 20.0}, {"Pd": 35.4}, {"Pd": 8.2}, {"Pd": 4.1}, {"Pd": 3.2}, {"Pd": 9.4}, {"Pd": 9.0}, {"Pd": 8.7}, {"Pd": 72.8}, {"Pd": 72.0}, {"Pd": 75.8}, {"Pd": 46.6}, {"Pd": 45.4}, {"Pd": 47.2}, {"Pd": 26.6}, {"Pd": 29.7}, {"Pd": 29.7}, {"Pd": 23.3}, {"Pd": 16.5}, {"Pd": 19.3}, {"Pd": 6.5}, {"Pd": 0.6}, {"Pd": 3.0}, {"Pd": 47.0}, {"Pd": 48.9}, {"Pd": 39.3}, {"Pd": 38.6}, {"Pd": 39.3}, {"Pd": 47.0}, {"Pd": 25.0}, {"Pd": 23.1}, {"Pd": 23.4}, {"Pd": 7.9}, {"Pd": 5.0}, {"Pd": 4.3}, {"Pd": 8.1}, {"Pd": 0.0}, {"Pd": 1.9}, {"Pd": 8.7}, {"Pd": 7.6}, {"Pd": 8.1}, {"Pd": 5.6}, {"Pd": 6.4}, {"Pd": 2.9}, {"Pd": 2.9}, {"Pd": 8.6}, {"Pd": 3.1}, {"Pd": 5.6}, {"Pd": 1.9}, {"Pd": 1.6}, {"Pd": 10.9}, {"Pd": 12.6}, {"Pd": 8.3}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 1.1}, {"Pd": 22.1}, {"Pd": 22.9}, {"Pd": 24.6}, {"Pd": 12.6}, {"Pd": 9.1}, {"Pd": 10.9}, {"Pd": 24.0}, {"Pd": 17.8}, {"Pd": 22.1}, {"Pd": 0.3}, {"Pd": 0.5}, {"Pd": 0.2}, {"Pd": 43.9}, {"Pd": 43.1}, {"Pd": 41.6}, {"Pd": 28.7}, {"Pd": 21.9}, {"Pd": 28.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 2.5}, {"Pd": 6.2}, {"Pd": 4.4}, {"Pd": 15.3}, {"Pd": 13.1}, {"Pd": 10.7}, {"Pd": 26.6}, {"Pd": 27.9}, {"Pd": 29.7}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median Palladium percentage for alloys where Gold percentage is under {}%."}
{"question": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds -7.298093795776367, internal energy at 0K (U0) is below -26.75823402404785, and Gibbs free energy (G) equals -25.05537414550781?", "refer_dataset": "table60", "column names": ["homo", "U0", "G", "Cv"], "condition_column": {"homo": ">", "U0": "<", "G": "="}, "answer_column": {"Cv": "min"}, "condition": {"homo": ">-7.298093795776367", "U0": "<-26.75823402404785", "G": "=='-25.05537414550781'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds {}, internal energy at 0K (U0) is below {}, and Gibbs free energy (G) equals {}?"}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 8.302193641662598?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='8.302193641662598'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "How many organic compounds (OC) have pH values equal to 10.6?", "refer_dataset": "table9", "column names": ["OC", "pH"], "condition_column": {"pH": "="}, "answer_column": {"OC": "count"}, "condition": {"pH": "=='10.6'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many organic compounds (OC) have pH values equal to {}?"}
{"question": "How many atoms do structures with a final energy greater than -21.51970663570347 typically have?", "refer_dataset": "table59", "column names": ["final_energy", "natoms"], "condition_column": {"final_energy": ">"}, "answer_column": {"natoms": "count"}, "condition": {"final_energy": ">-21.51970663570347"}, "tool": "calculate_data", "answer": 740, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many atoms do structures with a final energy greater than {} typically have?"}
{"question": "For source_id mp-30033, what is the maximum total magnetization observed?", "refer_dataset": "table67", "column names": ["source_id", "total_magnetization"], "condition_column": {"source_id": "="}, "answer_column": {"total_magnetization": "max"}, "condition": {"source_id": "=='mp-30033'"}, "tool": "calculate_data", "answer": 2.9997479, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For source_id {}, what is the maximum total magnetization observed?"}
{"question": "What is the highest reaction energy recorded for element Au?", "refer_dataset": "table18", "column names": ["AA", "reaction_energy"], "condition_column": {"AA": "="}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Au'"}, "tool": "calculate_data", "answer": 6.77, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy recorded for element {}?"}
{"question": "What is the maximum final energy (final_energy) where surface valence band maximum (surf_vbm) is below 1.728?", "refer_dataset": "table66", "column names": ["surf_vbm", "final_energy"], "condition_column": {"surf_vbm": "<"}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<1.728"}, "tool": "calculate_data", "answer": 485.35742061, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum final energy (final_energy) where surface valence band maximum (surf_vbm) is below {}?"}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is Tb, Support is BaO, and CH4/O2 ratio is 2?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='Tb'", "Support": "=='BaO'", "CH4/O2 (mol/mol)": "=='2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "Determine the minimum CT needed for molecular formulas containing SrTiO3 when aged longer than 10 hours.", "refer_dataset": "table11", "column names": ["Molecular formulas", "AH (h)", "CT (℃)"], "condition_column": {"Molecular formulas": "=", "AH (h)": ">"}, "answer_column": {"CT (℃)": "min"}, "condition": {"Molecular formulas": "=='SrTiO3'", "AH (h)": ">10"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum CT needed for molecular formulas containing {} when aged longer than {} hours."}
{"question": "Calculate the average SBET (m²/g) for entries with Bandgap less than 2.83 eV and irradiation time over 2.0 hours.", "refer_dataset": "table10", "column names": ["Eg(eV)", "irradiation time(h)", "SBET (m2 /g)"], "condition_column": {"Eg(eV)": "<", "irradiation time(h)": ">"}, "answer_column": {"SBET (m2 /g)": "avg"}, "condition": {"Eg(eV)": "<2.83", "irradiation time(h)": ">2.0"}, "tool": "calculate_data", "answer": 30.864717171717167, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average SBET (m²/g) for entries with Bandgap less than {} eV and irradiation time over {} hours."}
{"question": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the Milling assistant method method?", "refer_dataset": "table1", "column names": ["Preparation method", "RH2(µmol h-1 g-1)"], "condition_column": {"Preparation method": "="}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Preparation method": "=='Milling assistant method'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the {} method?"}
{"question": "What is the average number of citations for studies indexed in 2019-06-18 00:00:00?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Cited_Time"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Cited_Time": "avg"}, "condition": {"Indexed_Date": "=='2019-06-18 00:00:00'"}, "tool": "calculate_data", "answer": 25.692307692307693, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of citations for studies indexed in {}?"}
{"question": "What is the average reaction rate (-log(k)) when pH is 3.8?", "refer_dataset": "table9", "column names": ["pH", "-log(k), min-1"], "condition_column": {"pH": "="}, "answer_column": {"-log(k), min-1": "avg"}, "condition": {"pH": "=='3.8'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction rate (-log(k)) when pH is {}?"}
{"question": "What is the average pH for catalysts where Year is 1999.0?", "refer_dataset": "table12", "column names": ["Year", "pH"], "condition_column": {"Year": "="}, "answer_column": {"pH": "avg"}, "condition": {"Year": "=='1999.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average pH for catalysts where Year is {}?"}
{"question": "Calculate the average Band_gap_GGA for Space_group_rlx 194, SOC False, and Magnetic_ordering \"NM\".", "refer_dataset": "table63", "column names": ["Space_group_rlx", "SOC", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "=", "SOC": "=", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "avg"}, "condition": {"Space_group_rlx": "=='194'", "SOC": "=='False'", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA for Space_group_rlx {}, SOC {}, and Magnetic_ordering \"{}\"."}
{"question": "What is the average Power(W) for materials where BandGap(eV) is less than 2.95?", "refer_dataset": "table4", "column names": ["BandGap(eV)", "Power(W)"], "condition_column": {"BandGap(eV)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"BandGap(eV)": "<2.95"}, "tool": "calculate_data", "answer": 347.30434782608694, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where BandGap(eV) is less than {}?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 100.0?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">100.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "Find the median Fe concentration when La > 0.3, Ni = 0.0, and J.uAcm2_0.63_secondCA > 3612.357?", "refer_dataset": "table16", "column names": ["La", "Ni", "J.uAcm2_0.63_secondCA", "Fe"], "condition_column": {"La": ">", "Ni": "=", "J.uAcm2_0.63_secondCA": ">"}, "answer_column": {"Fe": "median"}, "condition": {"La": ">0.3", "Ni": "=='0.0'", "J.uAcm2_0.63_secondCA": ">3612.357"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Fe concentration when La > {}, Ni = {}, and J.uAcm2_0.63_secondCA > {}?"}
{"question": "Find the median ProdRate(μmol/g) when B1 is nan, CatW(g/L) equals 0.66, and Surface Area(m2/g) exceeds 124.8.", "refer_dataset": "table4", "column names": ["B1", "CatW(g/L)", "Surface Area(m2/g)", "ProdRate(μmol/g)"], "condition_column": {"B1": "=", "CatW(g/L)": "=", "Surface Area(m2/g)": ">"}, "answer_column": {"ProdRate(μmol/g)": "median"}, "condition": {"B1": "=='nan'", "CatW(g/L)": "=='0.66'", "Surface Area(m2/g)": ">124.8"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median ProdRate(μmol/g) when B1 is {}, CatW(g/L) equals {}, and Surface Area(m2/g) exceeds {}."}
{"question": "What is the average net magnetic moment for materials referenced under DOI nan?", "refer_dataset": "table62", "column names": ["doi", "net_magmom"], "condition_column": {"doi": "="}, "answer_column": {"net_magmom": "avg"}, "condition": {"doi": "=='nan'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average net magnetic moment for materials referenced under DOI {}?"}
{"question": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than 238.31 g/mol.", "refer_dataset": "table3", "column names": ["M", "χpa"], "condition_column": {"M": ">"}, "answer_column": {"χpa": "max"}, "condition": {"M": ">238.31"}, "tool": "calculate_data", "answer": 1.49, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than {} g/mol."}
{"question": "How many entries have SBET greater than 6.4 m²/g and produce CO as the Main product?", "refer_dataset": "table10", "column names": ["SBET (m2 /g)", "Main product"], "condition_column": {"SBET (m2 /g)": ">"}, "answer_column": {"Main product": "count"}, "condition": {"SBET (m2 /g)": ">6.4"}, "tool": "calculate_data", "answer": 116, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have SBET greater than {} m²/g and produce CO as the Main product?"}
{"question": "Calculate the average SBET (m²/g) for entries with Bandgap less than 3.2 eV and irradiation time over 3.0 hours.", "refer_dataset": "table10", "column names": ["Eg(eV)", "irradiation time(h)", "SBET (m2 /g)"], "condition_column": {"Eg(eV)": "<", "irradiation time(h)": ">"}, "answer_column": {"SBET (m2 /g)": "avg"}, "condition": {"Eg(eV)": "<3.2", "irradiation time(h)": ">3.0"}, "tool": "calculate_data", "answer": 27.308172131147536, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average SBET (m²/g) for entries with Bandgap less than {} eV and irradiation time over {} hours."}
{"question": "What is the total sum of optb88vdw_cbm values where offset equals -0.5775227899807884?", "refer_dataset": "table52", "column names": ["optb88vdw_cbm", "offset"], "condition_column": {"offset": "="}, "answer_column": {"optb88vdw_cbm": "sum"}, "condition": {"offset": "=='-0.5775227899807884'"}, "tool": "calculate_data", "answer": 8.6359, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total sum of optb88vdw_cbm values where offset equals {}?"}
{"question": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than 6.113, I1b is greater than 6.828, and ρa exceeds 1.54?", "refer_dataset": "table2", "column names": ["I1a", "I1b", "ρa", "EAa"], "condition_column": {"I1a": "<", "I1b": ">", "ρa": ">"}, "answer_column": {"EAa": "avg"}, "condition": {"I1a": "<6.113", "I1b": ">6.828", "ρa": ">1.54"}, "tool": "calculate_data", "answer": 21.64431818181819, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than {}, I1b is greater than {}, and ρa exceeds {}?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is 0.54135950548886.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='0.54135950548886'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Identify materials where the ionization energy of element B (I1b) exceeds 6.833 eV, the atomic radius of element B (Rb) is below 67.04 Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than 51.8 kJ/mol. What is their average hydrogen production rate (RH2)?", "refer_dataset": "table3", "column names": ["I1b", "Rb", "ΔfusHa", "RH2(µmol h-1 g-1)"], "condition_column": {"I1b": ">", "Rb": "<", "ΔfusHa": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "avg"}, "condition": {"I1b": ">6.833", "Rb": "<67.04", "ΔfusHa": ">51.8"}, "tool": "calculate_data", "answer": 92.75384615384615, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where the ionization energy of element B (I1b) exceeds {} eV, the atomic radius of element B (Rb) is below {} Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than {} kJ/mol. What is their average hydrogen production rate (RH2)?"}
{"question": "What is the highest Lattice Parameter observed when A_AtomN is 8.0, B_AtomN > 13.0, and Volume < 50.3189895597?", "refer_dataset": "table22", "column names": ["A_AtomN", "B_AtomN", "Volume", "Lattice"], "condition_column": {"A_AtomN": "=", "B_AtomN": ">", "Volume": "<"}, "answer_column": {"Lattice": "max"}, "condition": {"A_AtomN": "=='8.0'", "B_AtomN": ">13.0", "Volume": "<50.3189895597"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Lattice Parameter observed when A_AtomN is {}, B_AtomN > {}, and Volume < {}?"}
{"question": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above 16.84398644935951?", "refer_dataset": "table54", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"elastic anisotropy": ">"}, "answer_column": {"gap pbe": "min"}, "condition": {"elastic anisotropy": ">16.84398644935951"}, "tool": "calculate_data", "answer": 4.634, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above {}?"}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 1.137620939%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">1.137620939"}, "tool": "calculate_data", "answer": 48.26126007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "What is the total number of articles indexed on 2017-10-18 00:00:00 that used the electrochemical deposition method?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Judge_Electrochemical_Deposition"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Judge_Electrochemical_Deposition": "count"}, "condition": {"Indexed_Date": "=='2017-10-18 00:00:00'"}, "tool": "calculate_data", "answer": 1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total number of articles indexed on {} that used the electrochemical deposition method?"}
{"question": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above 923.1423?", "refer_dataset": "table16", "column names": ["Ca", "J.uAcm2_0.80_fromCV"], "condition_column": {"J.uAcm2_0.80_fromCV": ">"}, "answer_column": {"Ca": "avg"}, "condition": {"J.uAcm2_0.80_fromCV": ">923.1423"}, "tool": "calculate_data", "answer": 0.11666666666666663, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above {}?"}
{"question": "What is the average total yield for experiments with photocatalyst(s) UiO-66/CNNS, Liquid phase, and sacrificial agent percentage above 20.0%?", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Phase", "SacrAgentPercent", "total"], "condition_column": {"Photocatalyst(s)": "=", "Phase": "=", "SacrAgentPercent": ">"}, "answer_column": {"total": "avg"}, "condition": {"Photocatalyst(s)": "=='UiO-66/CNNS'", "Phase": "=='Liquid'", "SacrAgentPercent": ">20.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average total yield for experiments with photocatalyst(s) {}, {} phase, and sacrificial agent percentage above {}%?"}
{"question": "What is the minimum Tc recorded for materials where formula contains Nb1Re3?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "min"}, "condition": {"formula": "=='Nb1Re3'"}, "tool": "calculate_data", "answer": 5.27, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Tc recorded for materials where formula contains {}?"}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.8322.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.8322"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "What is the minimum Tc recorded for materials where formula contains B2Th1?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "min"}, "condition": {"formula": "=='B2Th1'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Tc recorded for materials where formula contains {}?"}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) CCO?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='CCO'"}, "tool": "calculate_data", "answer": -3.55201652975306, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 10.329442024230955?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='10.329442024230955'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the maximum PLD observed in compounds with a topology of rtl and synthesized status True?", "refer_dataset": "table62", "column names": ["topology", "synthesized", "pld"], "condition_column": {"topology": "=", "synthesized": "="}, "answer_column": {"pld": "max"}, "condition": {"topology": "=='rtl'", "synthesized": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD observed in compounds with a topology of {} and synthesized status {}?"}
{"question": "What is the highest C.E. % for Material Au when Surface Strain is 0.0?", "refer_dataset": "table12", "column names": ["Material", "Surface Strain", "C.E. %"], "condition_column": {"Material": "=", "Surface Strain": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"Material": "=='Au'", "Surface Strain": "=='0.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C.E. % for Material {} when Surface Strain is {}?"}
{"question": "What is the highest density for materials with pretty_formula equal to B24N4O?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='B24N4O'"}, "tool": "calculate_data", "answer": 2.488890724387206, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than -1.77757499937717?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">-1.77757499937717"}, "tool": "calculate_data", "answer": -0.07076795596453227, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "How many times has research from Shenzhen Univ Shenzhen institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='Shenzhen Univ Shenzhen'"}, "tool": "calculate_data", "answer": 5, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "For surfaces with Miller indices -532, what is the maximum activation energy?", "refer_dataset": "table18", "column names": ["surfaces", "activation_energy"], "condition_column": {"surfaces": "="}, "answer_column": {"activation_energy": "max"}, "condition": {"surfaces": "=='-532'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For surfaces with Miller indices {}, what is the maximum activation energy?"}
{"question": "Determine the average H2 selectivity when Cation1 is V, Cation3Amount > 0%, and O2 conv < 3.6%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='V'", "Cation3Amount": ">0", "O2 conv": "<3.6"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals 4.319?", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_delta_e"], "condition_column": {"_oqmd_band_gap": "="}, "answer_column": {"_oqmd_delta_e": "max"}, "condition": {"_oqmd_band_gap": "=='4.319'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals {}?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -1.77757499937717.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-1.77757499937717'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "How many preparation methods resulted in SSA > 5.91 m²/g and AH < 4.0 hours?", "refer_dataset": "table11", "column names": ["SSA (m2 g -1 )", "AH (h)", "PM"], "condition_column": {"SSA (m2 g -1 )": ">", "AH (h)": "<"}, "answer_column": {"PM": "count"}, "condition": {"SSA (m2 g -1 )": ">5.91", "AH (h)": "<4.0"}, "tool": "calculate_data", "answer": 27, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many preparation methods resulted in SSA > {} m²/g and AH < {} hours?"}
{"question": "What is the average Onset potential for alloys where Platinum percentage exceeds 18.1%?", "refer_dataset": "table15", "column names": ["Pt", "Onset"], "condition_column": {"Pt": ">"}, "answer_column": {"Onset": "avg"}, "condition": {"Pt": ">18.1"}, "tool": "calculate_data", "answer": 0.5091519333333331, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Onset potential for alloys where Platinum percentage exceeds {}%?"}
{"question": "What is the average methane conversion rate when Cation1 is Cu?", "refer_dataset": "table19", "column names": ["Cation1", "Temp CH4 conv"], "condition_column": {"Cation1": "="}, "answer_column": {"Temp CH4 conv": "avg"}, "condition": {"Cation1": "=='Cu'"}, "tool": "calculate_data", "answer": 750.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average methane conversion rate when Cation1 is {}?"}
{"question": "What is the average reaction time for Liquid phase, VIS light irradiation, and noble metal present?", "refer_dataset": "table7", "column names": ["Phase", "Light", "Noble_Metal", "Rxn_Time"], "condition_column": {"Phase": "=", "Light": "=", "Noble_Metal": "="}, "answer_column": {"Rxn_Time": "avg"}, "condition": {"Phase": "=='Liquid'", "Light": "=='VIS'", "Noble_Metal": "=='present'"}, "tool": "calculate_data", "answer": 4.491525423728813, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction time for {} phase, {} light irradiation, and noble metal {}?"}
{"question": "What is the average bulk_energy for bulk_formula Pm?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Pm'"}, "tool": "calculate_data", "answer": -76.05575999999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "Find the median ProdRate(μmol/g) when B1 is nan, CatW(g/L) equals 1.0, and Surface Area(m2/g) exceeds 1.3.", "refer_dataset": "table4", "column names": ["B1", "CatW(g/L)", "Surface Area(m2/g)", "ProdRate(μmol/g)"], "condition_column": {"B1": "=", "CatW(g/L)": "=", "Surface Area(m2/g)": ">"}, "answer_column": {"ProdRate(μmol/g)": "median"}, "condition": {"B1": "=='nan'", "CatW(g/L)": "=='1.0'", "Surface Area(m2/g)": ">1.3"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median ProdRate(μmol/g) when B1 is {}, CatW(g/L) equals {}, and Surface Area(m2/g) exceeds {}."}
{"question": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is FeCl3?", "refer_dataset": "table4", "column names": ["Sac. Agent1", "Surface Area(m2/g)"], "condition_column": {"Sac. Agent1": "="}, "answer_column": {"Surface Area(m2/g)": "max"}, "condition": {"Sac. Agent1": "=='FeCl3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is {}?"}
{"question": "What is the minimum loading (g/l) required when light source is UV–VIS and Reaction medium is gas-solid to achieve Yield > 1.125 μmol/g/h?", "refer_dataset": "table10", "column names": ["light source", "Reaction medium", "Yield (μmol/g/h)", "loading (g/l)"], "condition_column": {"light source": "=", "Reaction medium": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"loading (g/l)": "min"}, "condition": {"light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'", "Yield (μmol/g/h)": ">1.125"}, "tool": "calculate_data", "answer": 0.25, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum loading (g/l) required when light source is {} and Reaction medium is {} to achieve Yield > {} μmol/g/h?"}
{"question": "Identify materials where enthalpy (H) is greater than -15.710439682006836, energy gap (gap) is less than 6.1579365730285645, and R² spatial extent is above 59.98910140991211. What is their maximum internal energy (U)?", "refer_dataset": "table60", "column names": ["H", "gap", "r2", "U"], "condition_column": {"H": ">", "gap": "<", "r2": ">"}, "answer_column": {"U": "max"}, "condition": {"H": ">-15.710439682006836", "gap": "<6.1579365730285645", "r2": ">59.98910140991211"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where enthalpy (H) is greater than {}, energy gap (gap) is less than {}, and R² spatial extent is above {}. What is their maximum internal energy (U)?"}
{"question": "What is the average degradation rate for experiments using Dopant C with a Calcination Temperature above 400°C?", "refer_dataset": "table8", "column names": ["Dopant", "Calcination temperature(°C)", "Degradation rate(%)"], "condition_column": {"Dopant": "=", "Calcination temperature(°C)": ">"}, "answer_column": {"Degradation rate(%)": "avg"}, "condition": {"Dopant": "=='C'", "Calcination temperature(°C)": ">400"}, "tool": "calculate_data", "answer": 83.96078431372548, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average degradation rate for experiments using Dopant {} with a Calcination Temperature above {}°C?"}
{"question": "Calculate the maximum formation energy per atom for materials with space group number 123.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "max"}, "condition": {"spacegroup_number": "=='123'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum formation energy per atom for materials with space group number {}."}
{"question": "How many materials have a bandgap less than 0.3806000000000002?", "refer_dataset": "table67", "column names": ["bandgap", "material_id"], "condition_column": {"bandgap": "<"}, "answer_column": {"material_id": "count"}, "condition": {"bandgap": "<0.3806000000000002"}, "tool": "calculate_data", "answer": 2669, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many materials have a bandgap less than {}?"}
{"question": "What is the average total yield for experiments with photocatalyst(s) UiO-67 Mn (bpy) (CO)3Br, Liquid phase, and sacrificial agent percentage above 100.0%?", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Phase", "SacrAgentPercent", "total"], "condition_column": {"Photocatalyst(s)": "=", "Phase": "=", "SacrAgentPercent": ">"}, "answer_column": {"total": "avg"}, "condition": {"Photocatalyst(s)": "=='UiO-67 Mn (bpy) (CO)3Br'", "Phase": "=='Liquid'", "SacrAgentPercent": ">100.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average total yield for experiments with photocatalyst(s) {}, {} phase, and sacrificial agent percentage above {}%?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -4.86371312724729.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-4.86371312724729"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the average Degradation efficiency (%) when Surface area (m2/g) > 252.59, Pore Volume (cm3/g) < 0.86, and pH is 8.0?", "refer_dataset": "table6", "column names": ["Surface area (m2/g)", "Pore Volume (cm3/g)", "pH", "Degradation efficiency (%)"], "condition_column": {"Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<", "pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Surface area (m2/g)": ">252.59", "Pore Volume (cm3/g)": "<0.86", "pH": "=='8.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when Surface area (m2/g) > {}, Pore Volume (cm3/g) < {}, and pH is {}?"}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 4.68878917065024?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">4.68878917065024"}, "tool": "calculate_data", "answer": -3.6893663418253, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "What is the highest Yield (μmol/g/h) for Bi type BiOCl, Reaction medium gas-solid, and light source UV–VIS?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Reaction medium", "light source", "Yield (μmol/g/h)"], "condition_column": {"Bi type in photocatalyst": "=", "Reaction medium": "=", "light source": "="}, "answer_column": {"Yield (μmol/g/h)": "max"}, "condition": {"Bi type in photocatalyst": "=='BiOCl'", "Reaction medium": "=='gas-solid'", "light source": "=='UV–VIS'"}, "tool": "calculate_data", "answer": 14.25, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Yield (μmol/g/h) for Bi type {}, Reaction medium {}, and light source {}?"}
{"question": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to 279.86792654654926?", "refer_dataset": "table54", "column names": ["bulk modulus", "gap pbe"], "condition_column": {"bulk modulus": "="}, "answer_column": {"gap pbe": "avg"}, "condition": {"bulk modulus": "=='279.86792654654926'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to {}?"}
{"question": "Identify materials where the ionization energy of element B (I1b) exceeds 6.828 eV, the atomic radius of element B (Rb) is below 67.0 Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than 210.33 kJ/mol. What is their average hydrogen production rate (RH2)?", "refer_dataset": "table3", "column names": ["I1b", "Rb", "ΔfusHa", "RH2(µmol h-1 g-1)"], "condition_column": {"I1b": ">", "Rb": "<", "ΔfusHa": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "avg"}, "condition": {"I1b": ">6.828", "Rb": "<67.0", "ΔfusHa": ">210.33"}, "tool": "calculate_data", "answer": 12.325000000000001, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where the ionization energy of element B (I1b) exceeds {} eV, the atomic radius of element B (Rb) is below {} Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than {} kJ/mol. What is their average hydrogen production rate (RH2)?"}
{"question": "What is the maximum pH observed where Degradation efficiency (%) is greater than 10.2?", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "pH"], "condition_column": {"pH": ">"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"pH": ">10.2"}, "tool": "calculate_data", "answer": 62.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH observed where Degradation efficiency (%) is greater than {}?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Null\", Band_gap_HSE_optical < 1.386369, and Magnetic_ordering \"NM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Null'", "Band_gap_HSE_optical": "<1.386369", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is 30?", "refer_dataset": "table6", "column names": ["Illumination time (min)", "Antibiotic dosage (mg/L)"], "condition_column": {"Illumination time (min)": "="}, "answer_column": {"Antibiotic dosage (mg/L)": "min"}, "condition": {"Illumination time (min)": "=='30'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is {}?"}
{"question": "What is the median atomic number of elements with activation energy below 1.87?", "refer_dataset": "table18", "column names": ["activation_energy", "A_AtimicN"], "condition_column": {"activation_energy": "<"}, "answer_column": {"A_AtimicN": "median"}, "condition": {"activation_energy": "<1.87"}, "tool": "calculate_data", "answer": [{"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 26}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 79}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 42}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 25}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 79}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 27}, {"A_AtimicN": 78}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 42}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 42}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 26}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 42}, {"A_AtimicN": 28}, {"A_AtimicN": 47}, {"A_AtimicN": 26}, {"A_AtimicN": 26}, {"A_AtimicN": 23}, {"A_AtimicN": 47}, 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{"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 26}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 47}, {"A_AtimicN": 45}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median atomic number of elements with activation energy below {}?"}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.9662127395833328, gap pbe > 1.6671, and mu_b > 2.84e-05?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.9662127395833328", "gap pbe": ">1.6671", "mu_b": ">2.84e-05"}, "tool": "calculate_data", "answer": 257.91818120439063, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than 0.3796833635?", "refer_dataset": "table51", "column names": ["b3lyp_homo", "b3lyp_scharber_voc"], "condition_column": {"b3lyp_scharber_voc": ">"}, "answer_column": {"b3lyp_homo": "avg"}, "condition": {"b3lyp_scharber_voc": ">0.3796833635"}, "tool": "calculate_data", "answer": -0.19162535940195455, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than {}?"}
{"question": "What is the highest C.E. % for Material Re when Surface Strain is 0.0?", "refer_dataset": "table12", "column names": ["Material", "Surface Strain", "C.E. %"], "condition_column": {"Material": "=", "Surface Strain": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"Material": "=='Re'", "Surface Strain": "=='0.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C.E. % for Material {} when Surface Strain is {}?"}
{"question": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than -25.838844299316406?", "refer_dataset": "table60", "column names": ["H", "U0"], "condition_column": {"H": ">"}, "answer_column": {"U0": "max"}, "condition": {"H": ">-25.838844299316406"}, "tool": "calculate_data", "answer": -9.240361213684082, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than {}?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is 0.64099706538702.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='0.64099706538702'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the minimum M1 atom number required to achieve C2s greater than 27.62?", "refer_dataset": "table17", "column names": ["M1_atom_number", "C2s"], "condition_column": {"C2s": ">"}, "answer_column": {"M1_atom_number": "min"}, "condition": {"C2s": ">27.62"}, "tool": "calculate_data", "answer": 25, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum M1 atom number required to achieve C2s greater than {}?"}
{"question": "How many Preparations have Contact-times shorter than 17.8 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<17.8"}, "tool": "calculate_data", "answer": 1832, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below 1418.4 K.", "refer_dataset": "table3", "column names": ["A_Tb", "Rb"], "condition_column": {"A_Tb": "<"}, "answer_column": {"Rb": "median"}, "condition": {"A_Tb": "<1418.4"}, "tool": "calculate_data", "answer": [{"Rb": 67.0}, {"Rb": 65.8}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 67.0}, {"Rb": 72.0}, {"Rb": 72.0}, {"Rb": 66.86}, {"Rb": 74.17}, {"Rb": 74.17}, {"Rb": 74.48}, {"Rb": 73.24}, {"Rb": 73.86}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 74.48}, {"Rb": 75.1}, {"Rb": 67.0}, {"Rb": 72.62}, {"Rb": 74.17}, {"Rb": 67.0}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median atomic radius of element B (Rb) for materials where the boiling temperature of element A (A_Tb) is below {} K."}
{"question": "What is the maximum PLD observed in compounds with a topology of pts and synthesized status True?", "refer_dataset": "table62", "column names": ["topology", "synthesized", "pld"], "condition_column": {"topology": "=", "synthesized": "="}, "answer_column": {"pld": "max"}, "condition": {"topology": "=='pts'", "synthesized": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD observed in compounds with a topology of {} and synthesized status {}?"}
{"question": "Find the median Fe concentration when La > 0.3, Ni = 0.0, and J.uAcm2_0.63_secondCA > 4024.771?", "refer_dataset": "table16", "column names": ["La", "Ni", "J.uAcm2_0.63_secondCA", "Fe"], "condition_column": {"La": ">", "Ni": "=", "J.uAcm2_0.63_secondCA": ">"}, "answer_column": {"Fe": "median"}, "condition": {"La": ">0.3", "Ni": "=='0.0'", "J.uAcm2_0.63_secondCA": ">4024.771"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Fe concentration when La > {}, Ni = {}, and J.uAcm2_0.63_secondCA > {}?"}
{"question": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above 38.47690602825742.", "refer_dataset": "table66", "column names": ["avg_max", "surf_cbm"], "condition_column": {"avg_max": ">"}, "answer_column": {"surf_cbm": "min"}, "condition": {"avg_max": ">38.47690602825742"}, "tool": "calculate_data", "answer": -6.3023, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above {}."}
{"question": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above 1.4681387435.", "refer_dataset": "table51", "column names": ["m06_lumo", "m06_scharber_voc"], "condition_column": {"m06_scharber_voc": ">"}, "answer_column": {"m06_lumo": "min"}, "condition": {"m06_scharber_voc": ">1.4681387435"}, "tool": "calculate_data", "answer": 0.024, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above {}."}
{"question": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than 0.1811112450000003.", "refer_dataset": "table56", "column names": ["gap pbe", "e_hull"], "condition_column": {"e_hull": "<"}, "answer_column": {"gap pbe": "max"}, "condition": {"e_hull": "<0.1811112450000003"}, "tool": "calculate_data", "answer": 7.7947, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than {}."}
{"question": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above 843.96 K.", "refer_dataset": "table3", "column names": ["A_Tm", "RH2(µmol h-1 g-1)"], "condition_column": {"A_Tm": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "min"}, "condition": {"A_Tm": ">843.96"}, "tool": "calculate_data", "answer": 8600.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above {} K."}
{"question": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is Formic acid, temperature (T) is 40°C, and initial concentration (C0) is below 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "C0, mg/L", "-log(k), min-1"], "condition_column": {"OC": "=", "T, oC": "=", "C0, mg/L": "<"}, "answer_column": {"-log(k), min-1": "max"}, "condition": {"OC": "=='Formic acid'", "T, oC": "=='40'", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is {}, temperature (T) is {}°C, and initial concentration (C0) is below {} mg/L."}
{"question": "Calculate the average SBET (m²/g) for entries with Bandgap less than 2.23 eV and irradiation time over 4.0 hours.", "refer_dataset": "table10", "column names": ["Eg(eV)", "irradiation time(h)", "SBET (m2 /g)"], "condition_column": {"Eg(eV)": "<", "irradiation time(h)": ">"}, "answer_column": {"SBET (m2 /g)": "avg"}, "condition": {"Eg(eV)": "<2.23", "irradiation time(h)": ">4.0"}, "tool": "calculate_data", "answer": 51.79230769230768, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average SBET (m²/g) for entries with Bandgap less than {} eV and irradiation time over {} hours."}
{"question": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above 1.7946753575.", "refer_dataset": "table51", "column names": ["m06_lumo", "m06_scharber_voc"], "condition_column": {"m06_scharber_voc": ">"}, "answer_column": {"m06_lumo": "min"}, "condition": {"m06_scharber_voc": ">1.7946753575"}, "tool": "calculate_data", "answer": 0.024, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above {}."}
{"question": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to 187.8441005752244?", "refer_dataset": "table54", "column names": ["bulk modulus", "gap pbe"], "condition_column": {"bulk modulus": "="}, "answer_column": {"gap pbe": "avg"}, "condition": {"bulk modulus": "=='187.8441005752244'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to {}?"}
{"question": "What is the minimum total energy for materials with an LCD of 2.15494?", "refer_dataset": "table62", "column names": ["lcd", "energy_total"], "condition_column": {"lcd": "="}, "answer_column": {"energy_total": "min"}, "condition": {"lcd": "=='2.15494'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum total energy for materials with an LCD of {}?"}
{"question": "What is the maximum shear modulus recorded for materials with the chemical formula GaTe?", "refer_dataset": "table56", "column names": ["shear modulus", "formula"], "condition_column": {"formula": "="}, "answer_column": {"shear modulus": "max"}, "condition": {"formula": "=='GaTe'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus recorded for materials with the chemical formula {}?"}
{"question": "What is the maximum light intensity (I) recorded for organic compound Sucrose with nanoparticle dose (D) ≥ 1.875 g/L and reaction rate (-log(k)) > 0.6508?", "refer_dataset": "table9", "column names": ["OC", "D, g/L", "-log(k), min-1", "I, mW/cm2"], "condition_column": {"OC": "=", "D, g/L": ">=", "-log(k), min-1": ">"}, "answer_column": {"I, mW/cm2": "max"}, "condition": {"OC": "=='Sucrose'", "D, g/L": ">=1.875", "-log(k), min-1": ">0.6508"}, "tool": "calculate_data", "answer": 0.176, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum light intensity (I) recorded for organic compound {} with nanoparticle dose (D) ≥ {} g/L and reaction rate (-log(k)) > {}?"}
{"question": "What is the maximum ethane selectivity when O2 conv exceeds 20.8%?", "refer_dataset": "table19", "column names": ["O2 conv", "C2H6 sel"], "condition_column": {"O2 conv": ">"}, "answer_column": {"C2H6 sel": "max"}, "condition": {"O2 conv": ">20.8"}, "tool": "calculate_data", "answer": 55.8, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum ethane selectivity when O2 conv exceeds {}%?"}
{"question": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than 4.09366693757?", "refer_dataset": "table51", "column names": ["pbe0_homo", "pbe0_scharber_pce"], "condition_column": {"pbe0_scharber_pce": "<"}, "answer_column": {"pbe0_homo": "max"}, "condition": {"pbe0_scharber_pce": "<4.09366693757"}, "tool": "calculate_data", "answer": -0.173, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than {}?"}
{"question": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above 0.8491?", "refer_dataset": "table9", "column names": ["T, oC", "-log(k), min-1"], "condition_column": {"-log(k), min-1": ">"}, "answer_column": {"T, oC": "avg"}, "condition": {"-log(k), min-1": ">0.8491"}, "tool": "calculate_data", "answer": 27.395061728395063, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above {}?"}
{"question": "Calculate the average formula_energy for all materials with ID starting with 1759?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "avg"}, "condition": {"id": "=='1759'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average formula_energy for all materials with ID starting with {}?"}
{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 1.0, Indirect Bandgap < 0.0, and Lattice Parameter 3.9365220765?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='1.0'", "Indirect_Band": "<0.0", "Lattice": "=='3.9365220765'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
{"question": "What is the minimum Tc recorded for materials where formula contains Nb0.6Ti0.3Zr0.1?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "min"}, "condition": {"formula": "=='Nb0.6Ti0.3Zr0.1'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Tc recorded for materials where formula contains {}?"}
{"question": "Calculate the average atomic number of elements in surface -211.0 where carbon species is 3.0 and reaction energy exceeds -0.019.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-211.0'", "b_key": "=='3.0'", "reaction_energy": ">-0.019"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of 0.15, Illumination time (min) > 5.0, and Antibiotic dosage (mg/L) < 50.0.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Illumination time (min)", "Antibiotic dosage (mg/L)", "Degradation efficiency (%)"], "condition_column": {"Catalyst dosage (g/L)": "=", "Illumination time (min)": ">", "Antibiotic dosage (mg/L)": "<"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"Catalyst dosage (g/L)": "=='0.15'", "Illumination time (min)": ">5.0", "Antibiotic dosage (mg/L)": "<50.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of {}, Illumination time (min) > {}, and Antibiotic dosage (mg/L) < {}."}
{"question": "What is the average number of citations for studies indexed in 2020-08-04 00:00:00?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Cited_Time"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Cited_Time": "avg"}, "condition": {"Indexed_Date": "=='2020-08-04 00:00:00'"}, "tool": "calculate_data", "answer": 15.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of citations for studies indexed in {}?"}
{"question": "What is the maximum initial concentration (C0) recorded for reference number 22?", "refer_dataset": "table9", "column names": ["C0, mg/L", "Ref"], "condition_column": {"Ref": "="}, "answer_column": {"C0, mg/L": "max"}, "condition": {"Ref": "=='22'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum initial concentration (C0) recorded for reference number {}?"}
{"question": "What is the highest light intensity used with the co-catalyst 'Pt(3 wt％)'?", "refer_dataset": "table1", "column names": ["Co-catalyst", "Light intensity(W)"], "condition_column": {"Co-catalyst": "="}, "answer_column": {"Light intensity(W)": "max"}, "condition": {"Co-catalyst": "=='Pt(3 wt％)'"}, "tool": "calculate_data", "answer": "Xe lamp(500W),346 nm±8.6 nm", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest light intensity used with the co-catalyst '{}'?"}
{"question": "What is the maximum Tc for materials with formula containing Re0.1W0.9?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "max"}, "condition": {"formula": "=='Re0.1W0.9'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Tc for materials with formula containing {}?"}
{"question": "What is the average energy per atom for compounds in the formula MgF2 with an indirect gap below 5.328?", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "energy_per_atom"], "condition_column": {"formula": "=", "indir_gap": "<"}, "answer_column": {"energy_per_atom": "avg"}, "condition": {"formula": "=='MgF2'", "indir_gap": "<5.328"}, "tool": "calculate_data", "answer": -1007.0236030303032, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average energy per atom for compounds in the formula {} with an indirect gap below {}?"}
{"question": "What is the average Light Wavelength used for Calcination Temperatures above 500°C when Pollutant is MB?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Calcination temperature(°C)", "Pollutant"], "condition_column": {"Calcination temperature(°C)": ">", "Pollutant": "="}, "answer_column": {"Light wavelength(nm)": "avg"}, "condition": {"Calcination temperature(°C)": ">500", "Pollutant": "=='MB'"}, "tool": "calculate_data", "answer": 378.27433628318585, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Light Wavelength used for Calcination Temperatures above {}°C when Pollutant is {}?"}
{"question": "Calculate the average formula_energy for all materials with ID starting with 1476?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "avg"}, "condition": {"id": "=='1476'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average formula_energy for all materials with ID starting with {}?"}
{"question": "How many materials have a bandgap less than 8.4202?", "refer_dataset": "table67", "column names": ["bandgap", "material_id"], "condition_column": {"bandgap": "<"}, "answer_column": {"material_id": "count"}, "condition": {"bandgap": "<8.4202"}, "tool": "calculate_data", "answer": 4995, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many materials have a bandgap less than {}?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -8.05350499818663.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-8.05350499818663"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the highest methane conversion rate when Cation1 is Cr, Cation2Amount > 70%, and Support is SiO2?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='Cr'", "Cation2Amount": ">70", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than 0.93, Element B's Electronegativity (χpb) is less than 1.55, and the Tolerance Factor (t) is 0.931?", "refer_dataset": "table2", "column names": ["χpa", "χpb", "t", "Eg(eV)"], "condition_column": {"χpa": ">", "χpb": "<", "t": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"χpa": ">0.93", "χpb": "<1.55", "t": "=='0.931'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than {}, Element B's Electronegativity (χpb) is less than {}, and the Tolerance Factor (t) is {}?"}
{"question": "How many atoms do structures with a final energy greater than -28.73269271488434 typically have?", "refer_dataset": "table59", "column names": ["final_energy", "natoms"], "condition_column": {"final_energy": ">"}, "answer_column": {"natoms": "count"}, "condition": {"final_energy": ">-28.73269271488434"}, "tool": "calculate_data", "answer": 1051, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many atoms do structures with a final energy greater than {} typically have?"}
{"question": "Determine the average H2 selectivity when Cation1 is Fe, Cation3Amount > 0%, and O2 conv < 20.9%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='Fe'", "Cation3Amount": ">0", "O2 conv": "<20.9"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "Calculate the minimum Alcohol% for composites with A1 substitution nan, X1 equal to nan, and Surface Area(m2/g) above 0.68.", "refer_dataset": "table4", "column names": ["A1", "X1", "Surface Area(m2/g)", "Alcohol%"], "condition_column": {"A1": "=", "X1": "=", "Surface Area(m2/g)": ">"}, "answer_column": {"Alcohol%": "min"}, "condition": {"A1": "=='nan'", "X1": "=='nan'", "Surface Area(m2/g)": ">0.68"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum Alcohol% for composites with A1 substitution {}, X1 equal to {}, and Surface Area(m2/g) above {}."}
{"question": "What is the maximum pH observed where Degradation efficiency (%) is greater than 3.45?", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "pH"], "condition_column": {"pH": ">"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"pH": ">3.45"}, "tool": "calculate_data", "answer": 99.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH observed where Degradation efficiency (%) is greater than {}?"}
{"question": "Determine the minimum Calcination Temperature required for 86.0% Degradation Rate when pH is 7.0 and Catalyst/Pollutant mass ratio is 50.0.", "refer_dataset": "table8", "column names": ["Calcination temperature(°C)", "Degradation rate(%)", "pH", "Catalyst/Pollutant mass ratio"], "condition_column": {"Degradation rate(%)": "=", "pH": "=", "Catalyst/Pollutant mass ratio": "="}, "answer_column": {"Calcination temperature(°C)": "min"}, "condition": {"Degradation rate(%)": "=='86.0'", "pH": "=='7.0'", "Catalyst/Pollutant mass ratio": "=='50.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Calcination Temperature required for {}% Degradation Rate when pH is {} and Catalyst/Pollutant mass ratio is {}."}
{"question": "What is the average Onset potential for alloys where Platinum percentage exceeds 18.7%?", "refer_dataset": "table15", "column names": ["Pt", "Onset"], "condition_column": {"Pt": ">"}, "answer_column": {"Onset": "avg"}, "condition": {"Pt": ">18.7"}, "tool": "calculate_data", "answer": 0.5099554039215682, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Onset potential for alloys where Platinum percentage exceeds {}%?"}
{"question": "What is the maximum C.E. % observed for pH level 8.0?", "refer_dataset": "table12", "column names": ["pH", "C.E. %"], "condition_column": {"pH": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"pH": "=='8.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum C.E. % observed for pH level {}?"}
{"question": "Calculate the average overpotential in alkaline conditions for articles from Israel country.", "refer_dataset": "table13", "column names": ["Country", "Alkaline_OVP"], "condition_column": {"Country": "="}, "answer_column": {"Alkaline_OVP": "avg"}, "condition": {"Country": "=='Israel'"}, "tool": "calculate_data", "answer": 157.66666666666666, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average overpotential in alkaline conditions for articles from {} country."}
{"question": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of 0.15, Illumination time (min) > 20.0, and Antibiotic dosage (mg/L) < 50.0.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Illumination time (min)", "Antibiotic dosage (mg/L)", "Degradation efficiency (%)"], "condition_column": {"Catalyst dosage (g/L)": "=", "Illumination time (min)": ">", "Antibiotic dosage (mg/L)": "<"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"Catalyst dosage (g/L)": "=='0.15'", "Illumination time (min)": ">20.0", "Antibiotic dosage (mg/L)": "<50.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of {}, Illumination time (min) > {}, and Antibiotic dosage (mg/L) < {}."}
{"question": "What is the average Onset potential for alloys where Platinum percentage exceeds 25.2%?", "refer_dataset": "table15", "column names": ["Pt", "Onset"], "condition_column": {"Pt": ">"}, "answer_column": {"Onset": "avg"}, "condition": {"Pt": ">25.2"}, "tool": "calculate_data", "answer": 0.509482022222222, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Onset potential for alloys where Platinum percentage exceeds {}%?"}
{"question": "What is the minimum pH recorded for Degradation Rate > 70.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">70.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "What is the average Power(W) for materials where BandGap(eV) is less than 2.8?", "refer_dataset": "table4", "column names": ["BandGap(eV)", "Power(W)"], "condition_column": {"BandGap(eV)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"BandGap(eV)": "<2.8"}, "tool": "calculate_data", "answer": 350.5145631067961, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where BandGap(eV) is less than {}?"}
{"question": "What is the minimum journal impact factor for studies using the China Univ Petr East China method?", "refer_dataset": "table13", "column names": ["Facility", "IF"], "condition_column": {"Facility": "="}, "answer_column": {"IF": "min"}, "condition": {"Facility": "=='China Univ Petr East China'"}, "tool": "calculate_data", "answer": 24.319, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum journal impact factor for studies using the {} method?"}
{"question": "Find the median Band_gap_GGA where Band_gap_HSE_optical < 1.386369.", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": "<"}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Band_gap_HSE_optical": "<1.386369"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.684651}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.812729}, {"Band_gap_GGA": 0.121138}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.451375}, {"Band_gap_GGA": 0.041666}, {"Band_gap_GGA": 0.116559}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.636041}, {"Band_gap_GGA": 0.611795}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.2437109999999998}, {"Band_gap_GGA": 0.227571}, {"Band_gap_GGA": 0.235177}, {"Band_gap_GGA": 0.287844}, {"Band_gap_GGA": 0.018415}, {"Band_gap_GGA": 0.059662}, {"Band_gap_GGA": 0.284829}, {"Band_gap_GGA": 0.473079}, {"Band_gap_GGA": 0.178726}, {"Band_gap_GGA": 1.085179}, {"Band_gap_GGA": 0.1042529999999999}, {"Band_gap_GGA": 0.521741}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.432429}, {"Band_gap_GGA": 0.113063}, {"Band_gap_GGA": 0.6606369999999995}, {"Band_gap_GGA": 0.480542}, {"Band_gap_GGA": 0.371746}, {"Band_gap_GGA": 0.436652}, {"Band_gap_GGA": 0.021041}, {"Band_gap_GGA": 0.207128}, {"Band_gap_GGA": 0.436412}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.240682}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.302014}, {"Band_gap_GGA": 0.03858}, {"Band_gap_GGA": 0.152983}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.219952}, {"Band_gap_GGA": 0.567158}, {"Band_gap_GGA": 0.058523}, {"Band_gap_GGA": 0.232809}, {"Band_gap_GGA": 0.106556}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.138406}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.010467}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.020501}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.7083599999999999}, {"Band_gap_GGA": 0.464569}, {"Band_gap_GGA": 0.458572}, {"Band_gap_GGA": 0.2903539999999998}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.648889}, {"Band_gap_GGA": 0.379631}, {"Band_gap_GGA": 0.288977}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.533118}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.135669}, {"Band_gap_GGA": 0.659608}, {"Band_gap_GGA": 0.242306}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.455467}, {"Band_gap_GGA": 0.5743109999999998}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.185916}, {"Band_gap_GGA": 0.301394}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.086606}, {"Band_gap_GGA": 0.087526}, {"Band_gap_GGA": 0.240142}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.183234}, {"Band_gap_GGA": 0.1812}, {"Band_gap_GGA": 0.132596}, {"Band_gap_GGA": 0.124343}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.723736}, {"Band_gap_GGA": 0.525212}, {"Band_gap_GGA": 0.664029}, {"Band_gap_GGA": 0.717893}, {"Band_gap_GGA": 0.1012110000000001}, {"Band_gap_GGA": 0.1377410000000001}, {"Band_gap_GGA": 0.605876}, {"Band_gap_GGA": 0.45603}, {"Band_gap_GGA": 0.304606}, {"Band_gap_GGA": 0.348583}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.7109800000000002}, {"Band_gap_GGA": 0.11566}, {"Band_gap_GGA": 0.163075}, {"Band_gap_GGA": 0.095012}, {"Band_gap_GGA": 0.576212}, {"Band_gap_GGA": 0.0501729999999991}, {"Band_gap_GGA": 0.035107}, {"Band_gap_GGA": 0.680086}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.1281699999999999}, {"Band_gap_GGA": 0.0224219999999997}, {"Band_gap_GGA": 0.3171189999999999}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.365428}, {"Band_gap_GGA": 0.3831039999999999}, {"Band_gap_GGA": 0.5003120000000001}, {"Band_gap_GGA": 0.456402}, {"Band_gap_GGA": 0.617981}, {"Band_gap_GGA": 0.203862}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.712168}, {"Band_gap_GGA": 0.670807}, {"Band_gap_GGA": 0.035018}, {"Band_gap_GGA": 0.471341}, {"Band_gap_GGA": 0.343373}, {"Band_gap_GGA": 0.036726}, {"Band_gap_GGA": 0.525407}, {"Band_gap_GGA": 0.1007060000000001}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.101692}, {"Band_gap_GGA": 0.541491}, {"Band_gap_GGA": 0.1350280000000001}, {"Band_gap_GGA": 0.525745}, {"Band_gap_GGA": 0.335461}, {"Band_gap_GGA": 0.202096}, {"Band_gap_GGA": 0.394183}, {"Band_gap_GGA": 0.363669}, {"Band_gap_GGA": 0.285212}, {"Band_gap_GGA": 0.198114}, {"Band_gap_GGA": 0.604702}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.485755}, {"Band_gap_GGA": 0.0156169999999997}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.432838}, {"Band_gap_GGA": 0.310543}, {"Band_gap_GGA": 0.22685}, {"Band_gap_GGA": 0.249523}, {"Band_gap_GGA": 0.296561}, {"Band_gap_GGA": 0.131433}, {"Band_gap_GGA": 0.168947}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.53058}, {"Band_gap_GGA": 0.367797}, {"Band_gap_GGA": 0.175978}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.067083}, {"Band_gap_GGA": 0.50262}, {"Band_gap_GGA": 0.107833}, {"Band_gap_GGA": 0.583805}, {"Band_gap_GGA": 0.516517}, {"Band_gap_GGA": 0.1634989999999998}, {"Band_gap_GGA": 0.274882}, {"Band_gap_GGA": 0.412032}, {"Band_gap_GGA": 0.162911}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0978689999999997}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.1764369999999999}, {"Band_gap_GGA": 0.023816}, {"Band_gap_GGA": 0.522287}, {"Band_gap_GGA": 0.441558}, {"Band_gap_GGA": 0.384028}, {"Band_gap_GGA": 0.299666}, {"Band_gap_GGA": 0.098536}, {"Band_gap_GGA": 0.418106}, {"Band_gap_GGA": 0.230252}, {"Band_gap_GGA": 0.366982}, {"Band_gap_GGA": 0.0673470000000002}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.685931}, {"Band_gap_GGA": 0.220214}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.406297}, {"Band_gap_GGA": 0.040562}, {"Band_gap_GGA": 0.021943}, {"Band_gap_GGA": 0.246175}, {"Band_gap_GGA": 0.890754}, {"Band_gap_GGA": 0.390426}, {"Band_gap_GGA": 0.2038489999999999}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.1617000000000001}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.048536}, {"Band_gap_GGA": 0.2272}, {"Band_gap_GGA": 0.038092}, {"Band_gap_GGA": 0.2496929999999997}, {"Band_gap_GGA": 0.238472}, {"Band_gap_GGA": 0.276941}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.055628}, {"Band_gap_GGA": 0.5459970000000007}, {"Band_gap_GGA": 0.8194119999999998}, {"Band_gap_GGA": 0.096644}, {"Band_gap_GGA": 0.281613}, {"Band_gap_GGA": 0.974428}, {"Band_gap_GGA": 0.0966629999999999}, {"Band_gap_GGA": 0.14024}, {"Band_gap_GGA": 0.3041240000000007}, {"Band_gap_GGA": 0.615239}, {"Band_gap_GGA": 0.678898}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.233227}, {"Band_gap_GGA": 0.208564}, {"Band_gap_GGA": 0.249433}, {"Band_gap_GGA": 0.016113}, {"Band_gap_GGA": 0.025665}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.23993}, {"Band_gap_GGA": 0.1369470000000001}, {"Band_gap_GGA": 0.2276450000000003}, {"Band_gap_GGA": 0.1179449999999997}, {"Band_gap_GGA": 0.0237560000000005}, {"Band_gap_GGA": 0.4508980000000004}, {"Band_gap_GGA": 0.724936}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.640508}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.176768}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.426338}, {"Band_gap_GGA": 0.559358}, {"Band_gap_GGA": 0.076361}, {"Band_gap_GGA": 0.1761590000000001}, {"Band_gap_GGA": 0.684893}, {"Band_gap_GGA": 0.0880399999999999}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.046588}, {"Band_gap_GGA": 0.152212}, {"Band_gap_GGA": 0.052264}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.10789}, {"Band_gap_GGA": 0.6760039999999998}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.334149}, {"Band_gap_GGA": 0.2383199999999998}, {"Band_gap_GGA": 0.6758519999999999}, {"Band_gap_GGA": 0.1815999999999999}, {"Band_gap_GGA": 0.481597}, {"Band_gap_GGA": 0.3921559999999999}, {"Band_gap_GGA": 0.5060239999999996}, {"Band_gap_GGA": 0.406225}, {"Band_gap_GGA": 0.315372}, {"Band_gap_GGA": 0.445513}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.574063}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.1885470000000002}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.8748559999999999}, {"Band_gap_GGA": 0.531585}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.213682}, {"Band_gap_GGA": 0.143524}, {"Band_gap_GGA": 0.770421}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.984483}, {"Band_gap_GGA": 0.086018}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.5108030000000001}, {"Band_gap_GGA": 0.6085859999999998}, {"Band_gap_GGA": 0.3410599999999997}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.848794}, {"Band_gap_GGA": 0.679149}, {"Band_gap_GGA": 0.5201119999999999}, {"Band_gap_GGA": 0.23854}, {"Band_gap_GGA": 0.865236}, {"Band_gap_GGA": 0.713762}, {"Band_gap_GGA": 0.298167}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.224857}, {"Band_gap_GGA": 0.283995}, {"Band_gap_GGA": 0.159045}, {"Band_gap_GGA": 0.026395}, {"Band_gap_GGA": 0.177484}, {"Band_gap_GGA": 0.079467}, {"Band_gap_GGA": 0.323713}, {"Band_gap_GGA": 0.596343}, {"Band_gap_GGA": 0.446626}, {"Band_gap_GGA": 0.763741}, {"Band_gap_GGA": 0.024913}, {"Band_gap_GGA": 0.011479}, {"Band_gap_GGA": 0.639513}, {"Band_gap_GGA": 0.9474099999999996}, {"Band_gap_GGA": 0.687912}, {"Band_gap_GGA": 0.622552}, {"Band_gap_GGA": 0.191293}, {"Band_gap_GGA": 0.089123}, {"Band_gap_GGA": 0.288479}, {"Band_gap_GGA": 0.207136}, {"Band_gap_GGA": 0.08064}, {"Band_gap_GGA": 0.030189}, {"Band_gap_GGA": 0.035519}, {"Band_gap_GGA": 0.053101}, {"Band_gap_GGA": 0.2885100000000005}, {"Band_gap_GGA": 0.3287279999999999}, {"Band_gap_GGA": 0.139055}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.69167}, {"Band_gap_GGA": 0.688163}, {"Band_gap_GGA": 0.701328}, {"Band_gap_GGA": 0.260284}, {"Band_gap_GGA": 0.1390220000000002}, {"Band_gap_GGA": 0.2889679999999996}, {"Band_gap_GGA": 0.3703910000000001}, {"Band_gap_GGA": 0.289231}, {"Band_gap_GGA": 0.1680600000000001}, {"Band_gap_GGA": 0.0537489999999998}, {"Band_gap_GGA": 0.229379}, {"Band_gap_GGA": 0.076168}, {"Band_gap_GGA": 0.058314}, {"Band_gap_GGA": 0.053609}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.222214}, {"Band_gap_GGA": 0.7076389999999999}, {"Band_gap_GGA": 0.566589}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.813971}, {"Band_gap_GGA": 0.068756}, {"Band_gap_GGA": 0.030669}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.784554}, {"Band_gap_GGA": 0.118526}, {"Band_gap_GGA": 0.892954}, {"Band_gap_GGA": 0.598213}, {"Band_gap_GGA": 0.2807140000000006}, {"Band_gap_GGA": 0.2043889999999999}, {"Band_gap_GGA": 0.297649}, {"Band_gap_GGA": 0.019617}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.323051}, {"Band_gap_GGA": 0.451066}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0226440000000001}, {"Band_gap_GGA": 0.600714}, {"Band_gap_GGA": 0.060513}, {"Band_gap_GGA": 0.516672}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.079423}, {"Band_gap_GGA": 0.518778}, {"Band_gap_GGA": 0.557067}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.3214700000000001}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.023344}, {"Band_gap_GGA": 0.137577}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.419048}, {"Band_gap_GGA": 0.304036}, {"Band_gap_GGA": 0.427611}, {"Band_gap_GGA": 0.066141}, {"Band_gap_GGA": 0.307293}, {"Band_gap_GGA": 0.715366}, {"Band_gap_GGA": 0.478955}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.337935}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.160178}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.229184}, {"Band_gap_GGA": 0.062749}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.107766}, {"Band_gap_GGA": 0.0562809999999998}, {"Band_gap_GGA": 0.234652}, {"Band_gap_GGA": 0.088268}, {"Band_gap_GGA": 0.067216}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.150814}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.139867}, {"Band_gap_GGA": 0.019902}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.314184}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.486282}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.584094}, {"Band_gap_GGA": 0.093158}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.234348}, {"Band_gap_GGA": 0.233836}, {"Band_gap_GGA": 0.407743}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.115481}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.16959}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.064657}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.3010500000000005}, {"Band_gap_GGA": 0.010004}, {"Band_gap_GGA": 0.0510400000000004}, {"Band_gap_GGA": 0.4122590000000006}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.593264}, {"Band_gap_GGA": 0.1285660000000001}, {"Band_gap_GGA": 0.114593}, {"Band_gap_GGA": 0.07145}, {"Band_gap_GGA": 0.013837}, {"Band_gap_GGA": 0.611021}, {"Band_gap_GGA": 0.138691}, {"Band_gap_GGA": 0.357758}, {"Band_gap_GGA": 0.077827}, {"Band_gap_GGA": 0.208789}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.606807}, {"Band_gap_GGA": 0.188778}, {"Band_gap_GGA": 0.275451}, {"Band_gap_GGA": 0.174608}, {"Band_gap_GGA": 0.3737000000000003}, {"Band_gap_GGA": 0.129031}, {"Band_gap_GGA": 0.140697}, {"Band_gap_GGA": 0.892895}, {"Band_gap_GGA": 0.477598}, {"Band_gap_GGA": 1.015622}, {"Band_gap_GGA": 0.1090209999999999}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Band_gap_GGA where Band_gap_HSE_optical < {}."}
{"question": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than 234.62 g/mol.", "refer_dataset": "table3", "column names": ["M", "χpa"], "condition_column": {"M": ">"}, "answer_column": {"χpa": "max"}, "condition": {"M": ">234.62"}, "tool": "calculate_data", "answer": 1.49, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than {} g/mol."}
{"question": "What is the median O2-pressure when Anion1 is 17?", "refer_dataset": "table20", "column names": ["O2-pressure", "Anion1"], "condition_column": {"Anion1": "="}, "answer_column": {"O2-pressure": "median"}, "condition": {"Anion1": "=='17'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median O2-pressure when Anion1 is {}?"}
{"question": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than -35.36873245239258?", "refer_dataset": "table60", "column names": ["H", "U0"], "condition_column": {"H": ">"}, "answer_column": {"U0": "max"}, "condition": {"H": ">-35.36873245239258"}, "tool": "calculate_data", "answer": -9.240361213684082, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than {}?"}
{"question": "For surfaces with Miller indices -111, what is the maximum activation energy?", "refer_dataset": "table18", "column names": ["surfaces", "activation_energy"], "condition_column": {"surfaces": "="}, "answer_column": {"activation_energy": "max"}, "condition": {"surfaces": "=='-111'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For surfaces with Miller indices {}, what is the maximum activation energy?"}
{"question": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than 8.554.", "refer_dataset": "table66", "column names": ["scf_vbm", "efermi"], "condition_column": {"scf_vbm": ">"}, "answer_column": {"efermi": "min"}, "condition": {"scf_vbm": ">8.554"}, "tool": "calculate_data", "answer": 7.27774779, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than {}."}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than 0.0420409726748?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">0.0420409726748"}, "tool": "calculate_data", "answer": -0.3452858546157117, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "What is the average net magnetic moment for materials referenced under DOI https://doi.org/10.1016/S1387-7003(00)00017-4?", "refer_dataset": "table62", "column names": ["doi", "net_magmom"], "condition_column": {"doi": "="}, "answer_column": {"net_magmom": "avg"}, "condition": {"doi": "=='https://doi.org/10.1016/S1387-7003(00)00017-4'"}, "tool": "calculate_data", "answer": 2.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average net magnetic moment for materials referenced under DOI {}?"}
{"question": "What is the maximum overpotential V for Material Family d-metal, Functionalization 0.0, and Year 2014.0?", "refer_dataset": "table12", "column names": ["Material Family", "Functionalization", "Year", "overpotential V"], "condition_column": {"Material Family": "=", "Functionalization": "=", "Year": "="}, "answer_column": {"overpotential V": "max"}, "condition": {"Material Family": "=='d-metal'", "Functionalization": "=='0.0'", "Year": "=='2014.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum overpotential V for Material Family {}, Functionalization {}, and Year {}?"}
{"question": "Calculate the lowest Illumination Time required to achieve at least 96.0% Degradation Rate with Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": "<", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": "min"}, "condition": {"Degradation rate(%)": "<96.0", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the lowest Illumination Time required to achieve at least {}% Degradation Rate with Dopant/Ti mole ratio {}."}
{"question": "What is the minimum Gold percentage in alloys where Ruthenium exceeds 27.5%?", "refer_dataset": "table15", "column names": ["Ru", "Au"], "condition_column": {"Ru": ">"}, "answer_column": {"Au": "min"}, "condition": {"Ru": ">27.5"}, "tool": "calculate_data", "answer": 36.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Gold percentage in alloys where Ruthenium exceeds {}%?"}
{"question": "What is the maximum initial concentration (C0) recorded for reference number 30?", "refer_dataset": "table9", "column names": ["C0, mg/L", "Ref"], "condition_column": {"Ref": "="}, "answer_column": {"C0, mg/L": "max"}, "condition": {"Ref": "=='30'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum initial concentration (C0) recorded for reference number {}?"}
{"question": "Identify compounds where crystal system is orthorhombic and formation energy per atom is less than 0.0573. What is their average final energy?", "refer_dataset": "table59", "column names": ["crystal_system", "f_enp", "final_energy"], "condition_column": {"crystal_system": "=", "f_enp": "<"}, "answer_column": {"final_energy": "avg"}, "condition": {"crystal_system": "=='orthorhombic'", "f_enp": "<0.0573"}, "tool": "calculate_data", "answer": -96.9133251189625, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify compounds where crystal system is {} and formation energy per atom is less than {}. What is their average final energy?"}
{"question": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than 0.5765000000000002?", "refer_dataset": "table54", "column names": ["gap pbe", "mu_b"], "condition_column": {"gap pbe": "<"}, "answer_column": {"mu_b": "max"}, "condition": {"gap pbe": "<0.5765000000000002"}, "tool": "calculate_data", "answer": 55.98974449999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than {}?"}
{"question": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above 842.0 K.", "refer_dataset": "table3", "column names": ["A_Tm", "RH2(µmol h-1 g-1)"], "condition_column": {"A_Tm": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "min"}, "condition": {"A_Tm": ">842.0"}, "tool": "calculate_data", "answer": 8600.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above {} K."}
{"question": "What is the median Onset potential for alloys with Ru > 1.8%, Rh > 34.6%, and Pd < 29.7%?", "refer_dataset": "table15", "column names": ["Ru", "Rh", "Pd", "Onset"], "condition_column": {"Ru": ">", "Rh": ">", "Pd": "<"}, "answer_column": {"Onset": "median"}, "condition": {"Ru": ">1.8", "Rh": ">34.6", "Pd": "<29.7"}, "tool": "calculate_data", "answer": [{"Onset": 0.476753}, {"Onset": 0.460036}, {"Onset": 0.460036}, {"Onset": 0.483696}, {"Onset": 0.483696}, {"Onset": 0.483696}, {"Onset": 0.478759}, {"Onset": 0.468678}, {"Onset": 0.468678}, {"Onset": 0.468678}, {"Onset": 0.490682}, {"Onset": 0.490682}, {"Onset": 0.515005}, {"Onset": 0.515005}, {"Onset": 0.515005}, {"Onset": 0.461025}, {"Onset": 0.461025}, {"Onset": 0.473747}, {"Onset": 0.489667}, {"Onset": 0.478759}, {"Onset": 0.470744}, {"Onset": 0.470744}, {"Onset": 0.489667}, {"Onset": 0.477714}, {"Onset": 0.477714}, {"Onset": 0.485664}, {"Onset": 0.490682}, {"Onset": 0.47975}, {"Onset": 0.480766}, {"Onset": 0.47975}, {"Onset": 0.473747}, {"Onset": 0.476753}, {"Onset": 0.455995}, {"Onset": 0.455995}, {"Onset": 0.455995}, {"Onset": 0.513953}, {"Onset": 0.513953}, {"Onset": 0.513953}, {"Onset": 0.51497}, {"Onset": 0.51497}, {"Onset": 0.513953}, {"Onset": 0.515005}, {"Onset": 0.51497}, {"Onset": 0.51497}, {"Onset": 0.485664}, {"Onset": 0.485664}, {"Onset": 0.460036}, {"Onset": 0.461025}, {"Onset": 0.47975}, {"Onset": 0.483696}, {"Onset": 0.47975}, {"Onset": 0.480766}, {"Onset": 0.480766}, {"Onset": 0.480766}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Onset potential for alloys with Ru > {}%, Rh > {}%, and Pd < {}%?"}
{"question": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds 1.0.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Pore Volume (cm3/g)"], "condition_column": {"Catalyst dosage (g/L)": ">"}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Catalyst dosage (g/L)": ">1.0"}, "tool": "calculate_data", "answer": 0.17720000000000005, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds {}."}
{"question": "Retrieve the ID with the highest Tc for materials where formula contains Er0.85Ca0.15Ba2Cu3O6.93 and Tc exceeds 79.5.", "refer_dataset": "table65", "column names": ["id", "formula", "Tc"], "condition_column": {"formula": "=", "Tc": ">"}, "answer_column": {"id": "max"}, "condition": {"formula": "=='Er0.85Ca0.15Ba2Cu3O6.93'", "Tc": ">79.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Retrieve the ID with the highest Tc for materials where formula contains {} and Tc exceeds {}."}
{"question": "What is the average Cation1-mol for Cation1 58?", "refer_dataset": "table20", "column names": ["Cation1", "Cation1-mol"], "condition_column": {"Cation1": "="}, "answer_column": {"Cation1-mol": "avg"}, "condition": {"Cation1": "=='58'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Cation1-mol for Cation1 {}?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than 0.14680008939016?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">0.14680008939016"}, "tool": "calculate_data", "answer": -0.35898777799741205, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than 0.896699669?", "refer_dataset": "table51", "column names": ["b3lyp_homo", "b3lyp_scharber_voc"], "condition_column": {"b3lyp_scharber_voc": ">"}, "answer_column": {"b3lyp_homo": "avg"}, "condition": {"b3lyp_scharber_voc": ">0.896699669"}, "tool": "calculate_data", "answer": -0.2172442396313367, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than {}?"}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 4.18676664622803?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='4.18676664622803'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "Identify materials where the ionization energy of element B (I1b) exceeds 6.829 eV, the atomic radius of element B (Rb) is below 67.0 Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than 51.8 kJ/mol. What is their average hydrogen production rate (RH2)?", "refer_dataset": "table3", "column names": ["I1b", "Rb", "ΔfusHa", "RH2(µmol h-1 g-1)"], "condition_column": {"I1b": ">", "Rb": "<", "ΔfusHa": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "avg"}, "condition": {"I1b": ">6.829", "Rb": "<67.0", "ΔfusHa": ">51.8"}, "tool": "calculate_data", "answer": 20.316666666666666, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where the ionization energy of element B (I1b) exceeds {} eV, the atomic radius of element B (Rb) is below {} Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than {} kJ/mol. What is their average hydrogen production rate (RH2)?"}
{"question": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above 0.6068?", "refer_dataset": "table9", "column names": ["T, oC", "-log(k), min-1"], "condition_column": {"-log(k), min-1": ">"}, "answer_column": {"T, oC": "avg"}, "condition": {"-log(k), min-1": ">0.6068"}, "tool": "calculate_data", "answer": 28.058047493403695, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above {}?"}
{"question": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx 15.", "refer_dataset": "table63", "column names": ["Space_group_rlx", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "="}, "answer_column": {"Band_gap_GGA": "max"}, "condition": {"Space_group_rlx": "=='15'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx {}."}
{"question": "How many entries have SBET greater than 13.7 m²/g and produce CO as the Main product?", "refer_dataset": "table10", "column names": ["SBET (m2 /g)", "Main product"], "condition_column": {"SBET (m2 /g)": ">"}, "answer_column": {"Main product": "count"}, "condition": {"SBET (m2 /g)": ">13.7"}, "tool": "calculate_data", "answer": 79, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have SBET greater than {} m²/g and produce CO as the Main product?"}
{"question": "List references (Ref) where initial concentration (C0) is greater than 30.0 mg/L.", "refer_dataset": "table9", "column names": ["Ref", "C0, mg/L"], "condition_column": {"C0, mg/L": ">"}, "answer_column": {"Ref": ""}, "condition": {"C0, mg/L": ">30.0"}, "tool": "calculate_data", "answer": [{"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 28}, {"Ref": 28}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 35}, {"Ref": 36}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 38}, {"Ref": 38}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List references (Ref) where initial concentration (C0) is greater than {} mg/L."}
{"question": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than 0.0281417668534489.", "refer_dataset": "table57", "column names": ["_oqmd_delta_e", "_oqmd_stability"], "condition_column": {"_oqmd_delta_e": ">"}, "answer_column": {"_oqmd_stability": "min"}, "condition": {"_oqmd_delta_e": ">0.0281417668534489"}, "tool": "calculate_data", "answer": 4.152984231249998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than {}."}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 1.68 eV, light source UV–VIS, and Reaction medium gas-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<1.68", "light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "What is the maximum PLD for materials sourced from CSD?", "refer_dataset": "table62", "column names": ["source", "pld"], "condition_column": {"source": "="}, "answer_column": {"pld": "max"}, "condition": {"source": "=='CSD'"}, "tool": "calculate_data", "answer": 14.91745, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD for materials sourced from {}?"}
{"question": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is Ethanol, temperature (T) is 40°C, and initial concentration (C0) is below 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "C0, mg/L", "-log(k), min-1"], "condition_column": {"OC": "=", "T, oC": "=", "C0, mg/L": "<"}, "answer_column": {"-log(k), min-1": "max"}, "condition": {"OC": "=='Ethanol'", "T, oC": "=='40'", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is {}, temperature (T) is {}°C, and initial concentration (C0) is below {} mg/L."}
{"question": "What is the average bulk_energy for bulk_formula Ir?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Ir'"}, "tool": "calculate_data", "answer": -664.97328, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "What is the minimum pH recorded for Degradation Rate > 65.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">65.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 3.45382711302438?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='3.45382711302438'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "How many entries have a wycoff position of b?", "refer_dataset": "table68", "column names": ["wycoff", "jid"], "condition_column": {"wycoff": "="}, "answer_column": {"jid": "count"}, "condition": {"wycoff": "=='b'"}, "tool": "calculate_data", "answer": 70, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have a wycoff position of {}?"}
{"question": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds 2.0.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Pore Volume (cm3/g)"], "condition_column": {"Catalyst dosage (g/L)": ">"}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Catalyst dosage (g/L)": ">2.0"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds {}."}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -0.62776168091502 and the HOMO-LUMO gap (gap) is less than -0.37816371587465?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-0.62776168091502", "gap": "<-0.37816371587465"}, "tool": "calculate_data", "answer": 1.28206843459506, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "What is the maximum final energy (final_energy) where surface valence band maximum (surf_vbm) is below -2.3172?", "refer_dataset": "table66", "column names": ["surf_vbm", "final_energy"], "condition_column": {"surf_vbm": "<"}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<-2.3172"}, "tool": "calculate_data", "answer": 38.08278524, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum final energy (final_energy) where surface valence band maximum (surf_vbm) is below {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A85]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A85]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "What Light Wavelength achieves Degradation Rate above 50.0% within 80 minutes of Illumination Time for Dopant C?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Degradation rate(%)", "Illumination time(min)", "Dopant"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "Dopant": "="}, "answer_column": {"Light wavelength(nm)": ""}, "condition": {"Degradation rate(%)": ">50.0", "Illumination time(min)": "<80", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": [{"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 575}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Light Wavelength achieves Degradation Rate above {}% within {} minutes of Illumination Time for Dopant {}?"}
{"question": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than 9.03 eV.", "refer_dataset": "table3", "column names": ["EAa", "Ra"], "condition_column": {"EAa": ">"}, "answer_column": {"Ra": "max"}, "condition": {"EAa": ">9.03"}, "tool": "calculate_data", "answer": 139.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than {} eV."}
{"question": "Find the median Fe concentration when La > 0.1, Ni = 0.2, and J.uAcm2_0.63_secondCA > 4786.048?", "refer_dataset": "table16", "column names": ["La", "Ni", "J.uAcm2_0.63_secondCA", "Fe"], "condition_column": {"La": ">", "Ni": "=", "J.uAcm2_0.63_secondCA": ">"}, "answer_column": {"Fe": "median"}, "condition": {"La": ">0.1", "Ni": "=='0.2'", "J.uAcm2_0.63_secondCA": ">4786.048"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Fe concentration when La > {}, Ni = {}, and J.uAcm2_0.63_secondCA > {}?"}
{"question": "What is the maximum shear modulus recorded for materials with the chemical formula U2IrC2?", "refer_dataset": "table56", "column names": ["shear modulus", "formula"], "condition_column": {"formula": "="}, "answer_column": {"shear modulus": "max"}, "condition": {"formula": "=='U2IrC2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus recorded for materials with the chemical formula {}?"}
{"question": "Calculate the maximum offset value where optb88vdw_vbm is below 6.1195.", "refer_dataset": "table52", "column names": ["offset", "optb88vdw_vbm"], "condition_column": {"optb88vdw_vbm": "<"}, "answer_column": {"offset": "max"}, "condition": {"optb88vdw_vbm": "<6.1195"}, "tool": "calculate_data", "answer": "{}", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum offset value where optb88vdw_vbm is below {}."}
{"question": "What is the highest C2 selectivity (C2s) for M1 = Ti, M2_mol < 0.37, and Support = SiO2?", "refer_dataset": "table17", "column names": ["M1", "M2_mol", "Support", "C2s"], "condition_column": {"M1": "=", "M2_mol": "<", "Support": "="}, "answer_column": {"C2s": "max"}, "condition": {"M1": "=='Ti'", "M2_mol": "<0.37", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C2 selectivity (C2s) for M1 = {}, M2_mol < {}, and Support = {}?"}
{"question": "Find the Illumination Time required to reach 65.0% Degradation Rate with pH = 7.0 and Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "pH", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": ">", "pH": "=", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": ""}, "condition": {"Degradation rate(%)": ">65.0", "pH": "=='7.0'", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the Illumination Time required to reach {}% Degradation Rate with pH = {} and Dopant/Ti mole ratio {}."}
{"question": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below 184.6 K, the electron affinity of element A (EAa) exceeds 72.1 eV, and the hydrogen production rate (RH2) is higher than 325.4 µmol h⁻¹ g⁻¹.", "refer_dataset": "table3", "column names": ["A_Tm", "EAa", "RH2(µmol h-1 g-1)", "χpb"], "condition_column": {"A_Tm": "<", "EAa": ">", "RH2(µmol h-1 g-1)": ">"}, "answer_column": {"χpb": "median"}, "condition": {"A_Tm": "<184.6", "EAa": ">72.1", "RH2(µmol h-1 g-1)": ">325.4"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below {} K, the electron affinity of element A (EAa) exceeds {} eV, and the hydrogen production rate (RH2) is higher than {} µmol h⁻¹ g⁻¹."}
{"question": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below -6.628693580627441 and heat capacity (Cv) exceeds 16.56100082397461?", "refer_dataset": "table60", "column names": ["homo", "Cv", "zpve"], "condition_column": {"homo": "<", "Cv": ">"}, "answer_column": {"zpve": "avg"}, "condition": {"homo": "<-6.628693580627441", "Cv": ">16.56100082397461"}, "tool": "calculate_data", "answer": 3.118939122039391, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below {} and heat capacity (Cv) exceeds {}?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 33.0?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">33.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "Determine the total Yield (μmol/g/h) for photocatalysts containing a Bi type of BiOIO3.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Yield (μmol/g/h)"], "condition_column": {"Bi type in photocatalyst": "="}, "answer_column": {"Yield (μmol/g/h)": "count"}, "condition": {"Bi type in photocatalyst": "=='BiOIO3'"}, "tool": "calculate_data", "answer": 12, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total Yield (μmol/g/h) for photocatalysts containing a Bi type of {}."}
{"question": "What is the maximum bandgap observed in materials from source_id mp-580941?", "refer_dataset": "table67", "column names": ["source_id", "bandgap"], "condition_column": {"source_id": "="}, "answer_column": {"bandgap": "max"}, "condition": {"source_id": "=='mp-580941'"}, "tool": "calculate_data", "answer": 2.0285, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bandgap observed in materials from source_id {}?"}
{"question": "List organic compounds (OC) with light intensity (I) greater than 1.4 mW/cm².", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2"], "condition_column": {"I, mW/cm2": ">"}, "answer_column": {"OC": ""}, "condition": {"I, mW/cm2": ">1.4"}, "tool": "calculate_data", "answer": [{"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Acetaminophen"}, {"OC": "beta-blocker atenolol"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfisoxazole"}, {"OC": "Sulfathiazole"}, {"OC": "Sulfamethizole"}, {"OC": "Sulfanilamide"}, {"OC": "Sulfacetamide natrium salt"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfadiazine natrium salt"}, {"OC": "Sulfathiazole natrium salt"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iopromide"}, {"OC": "Atrazine"}, {"OC": "Cyanazine"}, {"OC": "Irgarol"}, {"OC": "Prometryne"}, {"OC": "Propazine"}, {"OC": "Dichlofenthion"}, {"OC": "Bromophos ethyl"}, {"OC": "Bromophos methyl"}, {"OC": "Parathion ethyl"}, {"OC": "Parathion methyl"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "Phorate"}, {"OC": "Phorate"}, {"OC": "Phorate"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List organic compounds (OC) with light intensity (I) greater than {} mW/cm²."}
{"question": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than 22.02 eV.", "refer_dataset": "table3", "column names": ["EAa", "Ra"], "condition_column": {"EAa": ">"}, "answer_column": {"Ra": "max"}, "condition": {"EAa": ">22.02"}, "tool": "calculate_data", "answer": 139.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than {} eV."}
{"question": "What is the average Temperature for Preprations using Support2 6?", "refer_dataset": "table20", "column names": ["Temperature", "Support2"], "condition_column": {"Support2": "="}, "answer_column": {"Temperature": "avg"}, "condition": {"Support2": "=='6'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Temperature for Preprations using Support2 {}?"}
{"question": "Calculate the average A_AtomN for materials where Element B is H, Cn exceeds 1, and Formation Energy is below 1.22?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='H'", "Cn": ">1", "Formation_E": "<1.22"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A118]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A118]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > 0.4, Ni < 0.3, and Fe = 0.3?", "refer_dataset": "table16", "column names": ["Mn", "Ni", "Fe", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">", "Ni": "<", "Fe": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.4", "Ni": "<0.3", "Fe": "=='0.3'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > {}, Ni < {}, and Fe = {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A112]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A112]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "Determine the average H2 selectivity when Cation1 is Na, Cation3Amount > 0%, and O2 conv < 28.8%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='Na'", "Cation3Amount": ">0", "O2 conv": "<28.8"}, "tool": "calculate_data", "answer": 31.900000000000002, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "What is the average net magnetic moment for materials referenced under DOI https://doi.org/10.1039/C7DT04287F?", "refer_dataset": "table62", "column names": ["doi", "net_magmom"], "condition_column": {"doi": "="}, "answer_column": {"net_magmom": "avg"}, "condition": {"doi": "=='https://doi.org/10.1039/C7DT04287F'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average net magnetic moment for materials referenced under DOI {}?"}
{"question": "Retrieve the ID with the highest Tc for materials where formula contains Mg1.985Mn0.015B2 and Tc exceeds 37.4.", "refer_dataset": "table65", "column names": ["id", "formula", "Tc"], "condition_column": {"formula": "=", "Tc": ">"}, "answer_column": {"id": "max"}, "condition": {"formula": "=='Mg1.985Mn0.015B2'", "Tc": ">37.4"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Retrieve the ID with the highest Tc for materials where formula contains {} and Tc exceeds {}."}
{"question": "What is the average final_energy for materials where optb88vdw_bandgap exceeds -0.3079?", "refer_dataset": "table52", "column names": ["final_energy", "optb88vdw_bandgap"], "condition_column": {"optb88vdw_bandgap": ">"}, "answer_column": {"final_energy": "avg"}, "condition": {"optb88vdw_bandgap": ">-0.3079"}, "tool": "calculate_data", "answer": -270.3383577242284, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average final_energy for materials where optb88vdw_bandgap exceeds {}?"}
{"question": "What is the average total yield for experiments with photocatalyst(s) UiO-66-Cr CAT, Liquid phase, and sacrificial agent percentage above 20.0%?", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Phase", "SacrAgentPercent", "total"], "condition_column": {"Photocatalyst(s)": "=", "Phase": "=", "SacrAgentPercent": ">"}, "answer_column": {"total": "avg"}, "condition": {"Photocatalyst(s)": "=='UiO-66-Cr CAT'", "Phase": "=='Liquid'", "SacrAgentPercent": ">20.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average total yield for experiments with photocatalyst(s) {}, {} phase, and sacrificial agent percentage above {}%?"}
{"question": "What is the highest reaction energy for elements Pt with adsorbed species CH* and activation energy greater than 1.87?", "refer_dataset": "table18", "column names": ["AA", "ab", "activation_energy", "reaction_energy"], "condition_column": {"AA": "=", "ab": "=", "activation_energy": ">"}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Pt'", "ab": "=='CH*'", "activation_energy": ">1.87"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy for elements {} with adsorbed species {} and activation energy greater than {}?"}
{"question": "How many Preparations have Contact-times shorter than 7.2 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<7.2"}, "tool": "calculate_data", "answer": 1766, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Indirect\", Band_gap_HSE_optical < 5.348794, and Magnetic_ordering \"FM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Indirect'", "Band_gap_HSE_optical": "<5.348794", "Magnetic_ordering": "=='FM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.218723}, {"Band_gap_GGA": 0.616087}, {"Band_gap_GGA": 0.189223}, {"Band_gap_GGA": 1.632221}, {"Band_gap_GGA": 1.000199}, {"Band_gap_GGA": 0.58384}, {"Band_gap_GGA": 1.00246}, {"Band_gap_GGA": 0.2031569999999999}, {"Band_gap_GGA": 0.62853}, {"Band_gap_GGA": 0.551833}, {"Band_gap_GGA": 0.420153}, {"Band_gap_GGA": 0.172653}, {"Band_gap_GGA": 1.684858}, {"Band_gap_GGA": 1.274934}, {"Band_gap_GGA": 1.206962}, {"Band_gap_GGA": 0.107505}, {"Band_gap_GGA": 0.584586}, {"Band_gap_GGA": 1.803102}, {"Band_gap_GGA": 1.813109}, {"Band_gap_GGA": 1.818905}, {"Band_gap_GGA": 1.692419}, {"Band_gap_GGA": 1.018042}, {"Band_gap_GGA": 2.469453}, {"Band_gap_GGA": 0.565169}, {"Band_gap_GGA": 2.138669}, {"Band_gap_GGA": 2.178183}, {"Band_gap_GGA": 1.055572}, {"Band_gap_GGA": 1.728862}, {"Band_gap_GGA": 1.761256}, {"Band_gap_GGA": 1.655191}, {"Band_gap_GGA": 1.899865}, {"Band_gap_GGA": 0.027888}, {"Band_gap_GGA": 1.248019}, {"Band_gap_GGA": 0.159935}, {"Band_gap_GGA": 1.223917}, {"Band_gap_GGA": 1.380522}, {"Band_gap_GGA": 0.366784}, {"Band_gap_GGA": 1.410702}, {"Band_gap_GGA": 0.167521}, {"Band_gap_GGA": 1.35627}, {"Band_gap_GGA": 0.689469}, {"Band_gap_GGA": 0.368587}, {"Band_gap_GGA": 2.336546}, {"Band_gap_GGA": 1.123838}, {"Band_gap_GGA": 0.229387}, {"Band_gap_GGA": 2.568333}, {"Band_gap_GGA": 3.114368}, {"Band_gap_GGA": 0.2230219999999998}, {"Band_gap_GGA": 3.4038}, 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{"Band_gap_GGA": 1.425462}, {"Band_gap_GGA": 0.067811}, {"Band_gap_GGA": 1.539092}, {"Band_gap_GGA": 1.541274}, {"Band_gap_GGA": 1.761301}, {"Band_gap_GGA": 0.719501}, {"Band_gap_GGA": 0.889209}, {"Band_gap_GGA": 1.656346}, {"Band_gap_GGA": 1.311427}, {"Band_gap_GGA": 0.12722}, {"Band_gap_GGA": 0.942917}, {"Band_gap_GGA": 0.559758}, {"Band_gap_GGA": 0.461911}, {"Band_gap_GGA": 1.166901}, {"Band_gap_GGA": 1.020304}, {"Band_gap_GGA": 2.098716}, {"Band_gap_GGA": 2.138428}, {"Band_gap_GGA": 2.635879}, {"Band_gap_GGA": 1.654083}, {"Band_gap_GGA": 2.575923}, {"Band_gap_GGA": 2.013326}, {"Band_gap_GGA": 1.559269}, {"Band_gap_GGA": 1.508966}, {"Band_gap_GGA": 2.810311}, {"Band_gap_GGA": 2.959076}, {"Band_gap_GGA": 3.684417999999999}, {"Band_gap_GGA": 3.1482100000000006}, {"Band_gap_GGA": 1.056419}, {"Band_gap_GGA": 2.018804}, {"Band_gap_GGA": 2.064398}, {"Band_gap_GGA": 2.930157}, {"Band_gap_GGA": 1.14568}, {"Band_gap_GGA": 1.31464}, {"Band_gap_GGA": 0.039992}, {"Band_gap_GGA": 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{"Band_gap_GGA": 2.567729}, {"Band_gap_GGA": 1.928708}, {"Band_gap_GGA": 1.947498}, {"Band_gap_GGA": 0.2276450000000003}, {"Band_gap_GGA": 0.1179449999999997}, {"Band_gap_GGA": 1.14343}, {"Band_gap_GGA": 2.516141}, {"Band_gap_GGA": 2.458453}, {"Band_gap_GGA": 1.294818}, {"Band_gap_GGA": 2.900706}, {"Band_gap_GGA": 1.562008}, {"Band_gap_GGA": 1.458238}, {"Band_gap_GGA": 1.019942}, {"Band_gap_GGA": 0.237837}, {"Band_gap_GGA": 1.044903}, {"Band_gap_GGA": 1.4793820000000002}, {"Band_gap_GGA": 0.790899}, {"Band_gap_GGA": 1.820886}, {"Band_gap_GGA": 0.376016}, {"Band_gap_GGA": 1.628393}, {"Band_gap_GGA": 0.825015}, {"Band_gap_GGA": 1.690593}, {"Band_gap_GGA": 1.993364}, {"Band_gap_GGA": 0.041664}, {"Band_gap_GGA": 2.507406}, {"Band_gap_GGA": 2.407844}, {"Band_gap_GGA": 2.407606}, {"Band_gap_GGA": 1.242863}, {"Band_gap_GGA": 1.027752}, {"Band_gap_GGA": 1.856123}, {"Band_gap_GGA": 1.3815470000000003}, {"Band_gap_GGA": 0.8356299999999997}, {"Band_gap_GGA": 2.470192}, {"Band_gap_GGA": 2.586069}, {"Band_gap_GGA": 1.76734}, {"Band_gap_GGA": 0.511888}, {"Band_gap_GGA": 2.15181}, {"Band_gap_GGA": 0.104402}, {"Band_gap_GGA": 1.863955}, {"Band_gap_GGA": 2.891472}, {"Band_gap_GGA": 1.033327}, {"Band_gap_GGA": 1.850031}, {"Band_gap_GGA": 2.045653}, {"Band_gap_GGA": 1.2731599999999998}, {"Band_gap_GGA": 2.3982170000000003}, {"Band_gap_GGA": 1.027971}, {"Band_gap_GGA": 1.186004}, {"Band_gap_GGA": 2.768311}, {"Band_gap_GGA": 0.627201}, {"Band_gap_GGA": 0.717118}, {"Band_gap_GGA": 1.479085}, {"Band_gap_GGA": 0.951572}, {"Band_gap_GGA": 1.288038}, {"Band_gap_GGA": 0.410357}, {"Band_gap_GGA": 0.529325}, {"Band_gap_GGA": 0.1731699999999998}, {"Band_gap_GGA": 0.453842}, {"Band_gap_GGA": 0.337034}, {"Band_gap_GGA": 0.3481619999999994}, {"Band_gap_GGA": 2.140732}, {"Band_gap_GGA": 0.27682}, {"Band_gap_GGA": 2.284489}, {"Band_gap_GGA": 0.493741}, {"Band_gap_GGA": 1.579843}, {"Band_gap_GGA": 1.717011}, {"Band_gap_GGA": 0.762703}, {"Band_gap_GGA": 0.466268}, {"Band_gap_GGA": 0.134518}, 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{"Band_gap_GGA": 1.699339}, {"Band_gap_GGA": 2.189879}, {"Band_gap_GGA": 0.366153}, {"Band_gap_GGA": 1.746416}, {"Band_gap_GGA": 2.37563}, {"Band_gap_GGA": 3.064669}, {"Band_gap_GGA": 2.965554}, {"Band_gap_GGA": 1.070716}, {"Band_gap_GGA": 2.46993}, {"Band_gap_GGA": 1.646273}, {"Band_gap_GGA": 1.493485}, {"Band_gap_GGA": 1.098668}, {"Band_gap_GGA": 0.019617}, {"Band_gap_GGA": 2.297615}, {"Band_gap_GGA": 2.232036}, {"Band_gap_GGA": 3.997439}, {"Band_gap_GGA": 2.686189}, {"Band_gap_GGA": 2.427008}, {"Band_gap_GGA": 0.577121}, {"Band_gap_GGA": 3.844852}, {"Band_gap_GGA": 0.809299}, {"Band_gap_GGA": 2.232591}, {"Band_gap_GGA": 1.602759}, {"Band_gap_GGA": 1.691546}, {"Band_gap_GGA": 3.297233}, {"Band_gap_GGA": 1.394845}, {"Band_gap_GGA": 1.27742}, {"Band_gap_GGA": 1.893239}, {"Band_gap_GGA": 0.953213}, {"Band_gap_GGA": 2.498634}, {"Band_gap_GGA": 2.021395}, {"Band_gap_GGA": 1.773759}, {"Band_gap_GGA": 0.363093}, {"Band_gap_GGA": 1.809001}, {"Band_gap_GGA": 1.743217}, {"Band_gap_GGA": 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{"Band_gap_GGA": 1.468394}, {"Band_gap_GGA": 1.023027}, {"Band_gap_GGA": 3.959061}, {"Band_gap_GGA": 2.2752830000000004}, {"Band_gap_GGA": 2.040668}, {"Band_gap_GGA": 3.957539}, {"Band_gap_GGA": 0.619668}, {"Band_gap_GGA": 3.927397}, {"Band_gap_GGA": 0.6524320000000001}, {"Band_gap_GGA": 3.863573}, {"Band_gap_GGA": 3.091127}, {"Band_gap_GGA": 0.04091}, {"Band_gap_GGA": 0.046088}, {"Band_gap_GGA": 0.9551550000000002}, {"Band_gap_GGA": 0.8245889999999998}, {"Band_gap_GGA": 0.07145}, {"Band_gap_GGA": 0.813493}, {"Band_gap_GGA": 1.547968}, {"Band_gap_GGA": 1.918516}, {"Band_gap_GGA": 1.253559}, {"Band_gap_GGA": 0.141227}, {"Band_gap_GGA": 1.012492}, {"Band_gap_GGA": 1.858004}, {"Band_gap_GGA": 0.547927}, {"Band_gap_GGA": 2.000535}, {"Band_gap_GGA": 1.77977}, {"Band_gap_GGA": 0.731232}, {"Band_gap_GGA": 1.950131}, {"Band_gap_GGA": 0.429583}, {"Band_gap_GGA": 0.430945}, {"Band_gap_GGA": 2.510365}, {"Band_gap_GGA": 2.435589}, {"Band_gap_GGA": 2.406821}, {"Band_gap_GGA": 2.4285360000000003}, {"Band_gap_GGA": 2.02702}, {"Band_gap_GGA": 2.080842}, {"Band_gap_GGA": 1.447179}, {"Band_gap_GGA": 1.081574}, {"Band_gap_GGA": 1.31458}, {"Band_gap_GGA": 1.230844}, {"Band_gap_GGA": 1.4635170000000002}, {"Band_gap_GGA": 1.449345}, {"Band_gap_GGA": 1.3020410000000002}, {"Band_gap_GGA": 0.686362}, {"Band_gap_GGA": 0.925348}, {"Band_gap_GGA": 2.583301}, {"Band_gap_GGA": 3.224243}, {"Band_gap_GGA": 0.876747}, {"Band_gap_GGA": 1.356414}, {"Band_gap_GGA": 0.891529}, {"Band_gap_GGA": 0.821086}, {"Band_gap_GGA": 0.739782}, {"Band_gap_GGA": 1.739318}, {"Band_gap_GGA": 0.935334}, {"Band_gap_GGA": 2.149314}, {"Band_gap_GGA": 2.143126}, {"Band_gap_GGA": 2.252694}, {"Band_gap_GGA": 2.304683}, {"Band_gap_GGA": 3.760028}, {"Band_gap_GGA": 3.761058}, {"Band_gap_GGA": 0.96445}, {"Band_gap_GGA": 0.962134}, {"Band_gap_GGA": 1.860885}, {"Band_gap_GGA": 1.859588}, {"Band_gap_GGA": 1.975251}, {"Band_gap_GGA": 0.188778}, {"Band_gap_GGA": 1.12308}, {"Band_gap_GGA": 0.999406}, {"Band_gap_GGA": 1.560101}, {"Band_gap_GGA": 2.840373}, {"Band_gap_GGA": 2.840069}, {"Band_gap_GGA": 0.259208}, {"Band_gap_GGA": 0.166703}, {"Band_gap_GGA": 2.402334}, {"Band_gap_GGA": 1.546077}, {"Band_gap_GGA": 1.551212}, {"Band_gap_GGA": 1.034119}, {"Band_gap_GGA": 2.377135}, {"Band_gap_GGA": 2.296233}, {"Band_gap_GGA": 2.371874}, {"Band_gap_GGA": 0.174608}, {"Band_gap_GGA": 0.970382}, {"Band_gap_GGA": 0.93313}, {"Band_gap_GGA": 0.423326}, {"Band_gap_GGA": 1.109291}, {"Band_gap_GGA": 0.129031}, {"Band_gap_GGA": 2.908057}, {"Band_gap_GGA": 2.191562}, {"Band_gap_GGA": 2.408317}, {"Band_gap_GGA": 0.818666}, {"Band_gap_GGA": 2.163089}, {"Band_gap_GGA": 2.564413}, {"Band_gap_GGA": 1.612963}, {"Band_gap_GGA": 0.90871}, {"Band_gap_GGA": 0.140697}, {"Band_gap_GGA": 0.600486}, {"Band_gap_GGA": 0.13966}, {"Band_gap_GGA": 2.623988}, {"Band_gap_GGA": 2.245308}, {"Band_gap_GGA": 1.181219}, {"Band_gap_GGA": 3.057132}, {"Band_gap_GGA": 0.146883}, {"Band_gap_GGA": 1.544537}, {"Band_gap_GGA": 2.632534}, {"Band_gap_GGA": 0.456143}, {"Band_gap_GGA": 1.062661}, {"Band_gap_GGA": 0.568376}, {"Band_gap_GGA": 1.671224}, {"Band_gap_GGA": 1.420798}, {"Band_gap_GGA": 0.093388}, {"Band_gap_GGA": 1.783169}, {"Band_gap_GGA": 0.1090209999999999}, {"Band_gap_GGA": 3.066712}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "Determine the average bulk modulus for materials where formation energy (e_form) is less than -0.0411816112500003.", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.0411816112500003"}, "tool": "calculate_data", "answer": 151.72704217300725, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average bulk modulus for materials where formation energy (e_form) is less than {}."}
{"question": "Determine the maximum irradiation time (h) for Bi type Bi4O5Br2, Main product CH4, and loading > 0.428571429 g/l.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Main product", "loading (g/l)", "irradiation time(h)"], "condition_column": {"Bi type in photocatalyst": "=", "Main product": "=", "loading (g/l)": ">"}, "answer_column": {"irradiation time(h)": "max"}, "condition": {"Bi type in photocatalyst": "=='Bi4O5Br2'", "Main product": "=='CH4'", "loading (g/l)": ">0.428571429"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum irradiation time (h) for Bi type {}, Main product {}, and loading > {} g/l."}
{"question": "Calculate the average nanoparticle dose (D) for organic compound 2-Propanol under light intensity (I) > 0.176 mW/cm² and initial concentration (C0) < 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2", "C0, mg/L", "D, g/L"], "condition_column": {"OC": "=", "I, mW/cm2": ">", "C0, mg/L": "<"}, "answer_column": {"D, g/L": "avg"}, "condition": {"OC": "=='2-Propanol'", "I, mW/cm2": ">0.176", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average nanoparticle dose (D) for organic compound {} under light intensity (I) > {} mW/cm² and initial concentration (C0) < {} mg/L."}
{"question": "What is the median O2-pressure when Anion1 is 53?", "refer_dataset": "table20", "column names": ["O2-pressure", "Anion1"], "condition_column": {"Anion1": "="}, "answer_column": {"O2-pressure": "median"}, "condition": {"Anion1": "=='53'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median O2-pressure when Anion1 is {}?"}
{"question": "For materials with B_AtomN 13, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='13'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A127]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A127]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "What is the highest C.E. % for Material Cu-Sn when Surface Strain is 0.0?", "refer_dataset": "table12", "column names": ["Material", "Surface Strain", "C.E. %"], "condition_column": {"Material": "=", "Surface Strain": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"Material": "=='Cu-Sn'", "Surface Strain": "=='0.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C.E. % for Material {} when Surface Strain is {}?"}
{"question": "What is the highest Bandgap (Eg) observed in experiments where the Main product is ethanol?", "refer_dataset": "table10", "column names": ["Main product", "Eg(eV)"], "condition_column": {"Main product": "="}, "answer_column": {"Eg(eV)": "max"}, "condition": {"Main product": "=='ethanol'"}, "tool": "calculate_data", "answer": 2.84, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Bandgap (Eg) observed in experiments where the Main product is {}?"}
{"question": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN 4.0, Bn (count of B) 1.0, and Formation Energy ≤ 2.58?", "refer_dataset": "table22", "column names": ["C_AtomN", "Bn", "Formation_E", "Volume"], "condition_column": {"C_AtomN": "=", "Bn": "=", "Formation_E": "<="}, "answer_column": {"Volume": "min"}, "condition": {"C_AtomN": "=='4.0'", "Bn": "=='1.0'", "Formation_E": "<=2.58"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN {}, Bn (count of B) {}, and Formation Energy ≤ {}?"}
{"question": "Calculate the average A_AtomN for materials where Element B is H, Cn exceeds 1, and Formation Energy is below 1.14?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='H'", "Cn": ">1", "Formation_E": "<1.14"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "What is the highest Surface area (m2/g) observed when Material is MIL-101, Catalyst dosage (g/L) > 0.2, and Degradation efficiency (%) > 35.0?", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Degradation efficiency (%)", "Surface area (m2/g)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Degradation efficiency (%)": ">"}, "answer_column": {"Surface area (m2/g)": "max"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.2", "Degradation efficiency (%)": ">35.0"}, "tool": "calculate_data", "answer": 252.59, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Surface area (m2/g) observed when Material is {}, Catalyst dosage (g/L) > {}, and Degradation efficiency (%) > {}?"}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is W, Support is La2O3, and CH4/O2 ratio is 6?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='W'", "Support": "=='La2O3'", "CH4/O2 (mol/mol)": "=='6'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "What is the maximum initial concentration (C0) recorded for reference number 27?", "refer_dataset": "table9", "column names": ["C0, mg/L", "Ref"], "condition_column": {"Ref": "="}, "answer_column": {"C0, mg/L": "max"}, "condition": {"Ref": "=='27'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum initial concentration (C0) recorded for reference number {}?"}
{"question": "What is the minimum nanoparticle dose (D) used for organic compound Ethanol?", "refer_dataset": "table9", "column names": ["D, g/L", "OC"], "condition_column": {"OC": "="}, "answer_column": {"D, g/L": "min"}, "condition": {"OC": "=='Ethanol'"}, "tool": "calculate_data", "answer": 1.875, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum nanoparticle dose (D) used for organic compound {}?"}
{"question": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than 0.0159353074784487.", "refer_dataset": "table57", "column names": ["_oqmd_delta_e", "_oqmd_stability"], "condition_column": {"_oqmd_delta_e": ">"}, "answer_column": {"_oqmd_stability": "min"}, "condition": {"_oqmd_delta_e": ">0.0159353074784487"}, "tool": "calculate_data", "answer": 4.152984231249998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than {}."}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 9.352553367614746?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='9.352553367614746'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the average bandgap for materials with a topology classification of hcb?", "refer_dataset": "table62", "column names": ["topology", "bandgap"], "condition_column": {"topology": "="}, "answer_column": {"bandgap": "avg"}, "condition": {"topology": "=='hcb'"}, "tool": "calculate_data", "answer": 2.2480622522522515, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bandgap for materials with a topology classification of {}?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -0.37519962361434.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-0.37519962361434'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is Hf, Support is La2O3, and CH4/O2 ratio is 2?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='Hf'", "Support": "=='La2O3'", "CH4/O2 (mol/mol)": "=='2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds 0.15.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Pore Volume (cm3/g)"], "condition_column": {"Catalyst dosage (g/L)": ">"}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Catalyst dosage (g/L)": ">0.15"}, "tool": "calculate_data", "answer": 0.3504588607594924, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds {}."}
{"question": "What is the minimum Duration of cycles (h) when B site is In?", "refer_dataset": "table5", "column names": ["B site", "Duration of cycles (h)"], "condition_column": {"B site": "="}, "answer_column": {"Duration of cycles (h)": "min"}, "condition": {"B site": "=='In'"}, "tool": "calculate_data", "answer": 23.5, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Duration of cycles (h) when B site is {}?"}
{"question": "What is the maximum PLD observed in compounds with a topology of rob and synthesized status True?", "refer_dataset": "table62", "column names": ["topology", "synthesized", "pld"], "condition_column": {"topology": "=", "synthesized": "="}, "answer_column": {"pld": "max"}, "condition": {"topology": "=='rob'", "synthesized": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD observed in compounds with a topology of {} and synthesized status {}?"}
{"question": "What is the highest methane conversion rate when Cation1 is Na, Cation2Amount > 70%, and Support is SiO2?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='Na'", "Cation2Amount": ">70", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": 900, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is 3.9214237611?", "refer_dataset": "table22", "column names": ["Lattice", "D_AtomN"], "condition_column": {"Lattice": "="}, "answer_column": {"D_AtomN": "median"}, "condition": {"Lattice": "=='3.9214237611'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is {}?"}
{"question": "What is the average number of atoms per structure in materials with a crystal system of monoclinic and space group symbol C2/m?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='monoclinic'", "spacegroup_symbol": "=='C2/m'"}, "tool": "calculate_data", "answer": 2.9415204678362574, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "What is the maximum Tc for materials with formula containing Tb1Th3.4Ru0.6B4?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "max"}, "condition": {"formula": "=='Tb1Th3.4Ru0.6B4'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Tc for materials with formula containing {}?"}
{"question": "Determine the minimum pH where Material is In2S3-MIL-125-Ti, Surface area (m2/g) > 303.9, and Pore Volume (cm3/g) < 0.464.", "refer_dataset": "table6", "column names": ["Material", "Surface area (m2/g)", "Pore Volume (cm3/g)", "pH"], "condition_column": {"Material": "=", "Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<"}, "answer_column": {"pH": "min"}, "condition": {"Material": "=='In2S3-MIL-125-Ti'", "Surface area (m2/g)": ">303.9", "Pore Volume (cm3/g)": "<0.464"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum pH where Material is {}, Surface area (m2/g) > {}, and Pore Volume (cm3/g) < {}."}
{"question": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below 1.6671?", "refer_dataset": "table56", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"gap pbe": "<"}, "answer_column": {"elastic anisotropy": "max"}, "condition": {"gap pbe": "<1.6671"}, "tool": "calculate_data", "answer": 401.4952807290347, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below {}?"}
{"question": "Determine the average bulk modulus for materials where formation energy (e_form) is less than -0.5271720061899998.", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.5271720061899998"}, "tool": "calculate_data", "answer": 155.5271162934936, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average bulk modulus for materials where formation energy (e_form) is less than {}."}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.5616.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.5616"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "Determine the average H2 selectivity when Cation1 is V, Cation3Amount > 0%, and O2 conv < 20.4%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='V'", "Cation3Amount": ">0", "O2 conv": "<20.4"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "Calculate the average chem_pot for symbol Kr?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Kr'"}, "tool": "calculate_data", "answer": 1.92220345, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "What is the average journal impact factor for research institutions located in CA 92182 USA?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='CA 92182 USA'"}, "tool": "calculate_data", "answer": 10.0445, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "How many references document perovskite oxides with a calcination temperature (CT) above 1000°C?", "refer_dataset": "table11", "column names": ["CT (℃)", "Ref."], "condition_column": {"CT (℃)": ">"}, "answer_column": {"Ref.": "count"}, "condition": {"CT (℃)": ">1000"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document perovskite oxides with a calcination temperature (CT) above {}°C?"}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 6.1579365730285645?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='6.1579365730285645'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the highest methane conversion rate when Cation1 is Ni, Cation2Amount > 70%, and Support is SiO2?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='Ni'", "Cation2Amount": ">70", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "What is the highest C2 selectivity (C2s) for M1 = Mn, M2_mol < 0.37, and Support = TiO2?", "refer_dataset": "table17", "column names": ["M1", "M2_mol", "Support", "C2s"], "condition_column": {"M1": "=", "M2_mol": "<", "Support": "="}, "answer_column": {"C2s": "max"}, "condition": {"M1": "=='Mn'", "M2_mol": "<0.37", "Support": "=='TiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C2 selectivity (C2s) for M1 = {}, M2_mol < {}, and Support = {}?"}
{"question": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals 0.9991762?", "refer_dataset": "table67", "column names": ["exfoliation_energy_per_atom", "total_magnetization"], "condition_column": {"total_magnetization": "="}, "answer_column": {"exfoliation_energy_per_atom": "max"}, "condition": {"total_magnetization": "=='0.9991762'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals {}?"}
{"question": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is 60?", "refer_dataset": "table6", "column names": ["Illumination time (min)", "Antibiotic dosage (mg/L)"], "condition_column": {"Illumination time (min)": "="}, "answer_column": {"Antibiotic dosage (mg/L)": "min"}, "condition": {"Illumination time (min)": "=='60'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is {}?"}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 60 minutes, pH > 7.0, and Dopant C?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<60", "pH": ">7.0", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": 100.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "What is the highest Rhodium percentage observed in alloys with Onset potential below 0.462739V?", "refer_dataset": "table15", "column names": ["Rh", "Onset"], "condition_column": {"Onset": "<"}, "answer_column": {"Rh": "max"}, "condition": {"Onset": "<0.462739"}, "tool": "calculate_data", "answer": 41.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Rhodium percentage observed in alloys with Onset potential below {}V?"}
{"question": "How many synthesized compounds have a net magnetic moment above 12.0?", "refer_dataset": "table62", "column names": ["synthesized", "net_magmom"], "condition_column": {"net_magmom": ">"}, "answer_column": {"synthesized": "count"}, "condition": {"net_magmom": ">12.0"}, "tool": "calculate_data", "answer": 129, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many synthesized compounds have a net magnetic moment above {}?"}
{"question": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than 4.5?", "refer_dataset": "table2", "column names": ["ρb", "t"], "condition_column": {"ρb": "<"}, "answer_column": {"t": "avg"}, "condition": {"ρb": "<4.5"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than {}?"}
{"question": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below -7.219180583953857 and heat capacity (Cv) exceeds 8.75100040435791?", "refer_dataset": "table60", "column names": ["homo", "Cv", "zpve"], "condition_column": {"homo": "<", "Cv": ">"}, "answer_column": {"zpve": "avg"}, "condition": {"homo": "<-7.219180583953857", "Cv": ">8.75100040435791"}, "tool": "calculate_data", "answer": 2.613191034529627, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below {} and heat capacity (Cv) exceeds {}?"}
{"question": "Calculate the average A_AtomN for materials where Element B is H, Cn exceeds 1, and Formation Energy is below 1.24?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='H'", "Cn": ">1", "Formation_E": "<1.24"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "What is the maximum CH4 conversion (%) recorded when M1 is Zn, temperature exceeds 800°C, and total flow is below 20 mL/min?", "refer_dataset": "table21", "column names": ["M1", "Temp. (°C)", "Total flow(mL/min)", "CH4 conversion (%)"], "condition_column": {"M1": "=", "Temp. (°C)": ">", "Total flow(mL/min)": "<"}, "answer_column": {"CH4 conversion (%)": "max"}, "condition": {"M1": "=='Zn'", "Temp. (°C)": ">800", "Total flow(mL/min)": "<20"}, "tool": "calculate_data", "answer": 47.66825996, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum CH4 conversion (%) recorded when M1 is {}, temperature exceeds {}°C, and total flow is below {} mL/min?"}
{"question": "Calculate the average Band_gap_GGA for Space_group_rlx 166, SOC False, and Magnetic_ordering \"NM\".", "refer_dataset": "table63", "column names": ["Space_group_rlx", "SOC", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "=", "SOC": "=", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "avg"}, "condition": {"Space_group_rlx": "=='166'", "SOC": "=='False'", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA for Space_group_rlx {}, SOC {}, and Magnetic_ordering \"{}\"."}
{"question": "What is the maximum overpotential V for Material Family p-metal/(hydro)oxide, Functionalization 0.0, and Year 2017.0?", "refer_dataset": "table12", "column names": ["Material Family", "Functionalization", "Year", "overpotential V"], "condition_column": {"Material Family": "=", "Functionalization": "=", "Year": "="}, "answer_column": {"overpotential V": "max"}, "condition": {"Material Family": "=='p-metal/(hydro)oxide'", "Functionalization": "=='0.0'", "Year": "=='2017.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum overpotential V for Material Family {}, Functionalization {}, and Year {}?"}
{"question": "Calculate the highest aging time (AH) for perovskite oxides synthesized at a calcination temperature of 1000°C.", "refer_dataset": "table11", "column names": ["CT (℃)", "AH (h)"], "condition_column": {"CT (℃)": "="}, "answer_column": {"AH (h)": "max"}, "condition": {"CT (℃)": "=='1000'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the highest aging time (AH) for perovskite oxides synthesized at a calcination temperature of {}°C."}
{"question": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than -27.096471786499023?", "refer_dataset": "table60", "column names": ["H", "U0"], "condition_column": {"H": ">"}, "answer_column": {"U0": "max"}, "condition": {"H": ">-27.096471786499023"}, "tool": "calculate_data", "answer": -9.240361213684082, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than {}?"}
{"question": "Find the average Eg(eV) for samples calcined at exactly 1423.0 K.", "refer_dataset": "table1", "column names": ["Calcination temperature(K)", "Eg(eV)"], "condition_column": {"Calcination temperature(K)": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Calcination temperature(K)": "=='1423.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Eg(eV) for samples calcined at exactly {} K."}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 180 minutes, pH > 7.0, and Dopant Fe?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<180", "pH": ">7.0", "Dopant": "=='Fe'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "What is the average Degradation efficiency (%) when pH is 6.3?", "refer_dataset": "table6", "column names": ["pH", "Degradation efficiency (%)"], "condition_column": {"pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"pH": "=='6.3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when pH is {}?"}
{"question": "Calculate the average C2 yield (%) for catalysts with primary metal Mg, secondary metal Ca, and support material BaO–La2O3.", "refer_dataset": "table21", "column names": ["M1", "M2", "Support", "C2 yield (%)"], "condition_column": {"M1": "=", "M2": "=", "Support": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='Mg'", "M2": "=='Ca'", "Support": "=='BaO–La2O3'"}, "tool": "calculate_data", "answer": 12.159222369778629, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average C2 yield (%) for catalysts with primary metal {}, secondary metal {}, and support material {}."}
{"question": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than 55?", "refer_dataset": "table22", "column names": ["B_AtomN", "Direct_Band"], "condition_column": {"B_AtomN": ">"}, "answer_column": {"Direct_Band": "max"}, "condition": {"B_AtomN": ">55"}, "tool": "calculate_data", "answer": 4.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than {}?"}
{"question": "What Light Wavelength achieves Degradation Rate above 42.0% within 20 minutes of Illumination Time for Dopant C?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Degradation rate(%)", "Illumination time(min)", "Dopant"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "Dopant": "="}, "answer_column": {"Light wavelength(nm)": ""}, "condition": {"Degradation rate(%)": ">42.0", "Illumination time(min)": "<20", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Light Wavelength achieves Degradation Rate above {}% within {} minutes of Illumination Time for Dopant {}?"}
{"question": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is 180?", "refer_dataset": "table6", "column names": ["Illumination time (min)", "Antibiotic dosage (mg/L)"], "condition_column": {"Illumination time (min)": "="}, "answer_column": {"Antibiotic dosage (mg/L)": "min"}, "condition": {"Illumination time (min)": "=='180'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is {}?"}
{"question": "What is the highest Bandgap (Eg) observed in experiments where the Main product is methyl formate?", "refer_dataset": "table10", "column names": ["Main product", "Eg(eV)"], "condition_column": {"Main product": "="}, "answer_column": {"Eg(eV)": "max"}, "condition": {"Main product": "=='methyl formate'"}, "tool": "calculate_data", "answer": 1.95, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Bandgap (Eg) observed in experiments where the Main product is {}?"}
{"question": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds 8.0 hours.", "refer_dataset": "table10", "column names": ["irradiation time(h)", "CB edge(V)"], "condition_column": {"irradiation time(h)": ">"}, "answer_column": {"CB edge(V)": "min"}, "condition": {"irradiation time(h)": ">8.0"}, "tool": "calculate_data", "answer": "− 0.56", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds {} hours."}
{"question": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > 15.0, pH < 8.2, and Antibiotic dosage (mg/L) = 50.0.", "refer_dataset": "table6", "column names": ["Illumination time (min)", "pH", "Antibiotic dosage (mg/L)", "Pore Volume (cm3/g)"], "condition_column": {"Illumination time (min)": ">", "pH": "<", "Antibiotic dosage (mg/L)": "="}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Illumination time (min)": ">15.0", "pH": "<8.2", "Antibiotic dosage (mg/L)": "=='50.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > {}, pH < {}, and Antibiotic dosage (mg/L) = {}."}
{"question": "What is the maximum PLD observed in compounds with a topology of kgd and synthesized status True?", "refer_dataset": "table62", "column names": ["topology", "synthesized", "pld"], "condition_column": {"topology": "=", "synthesized": "="}, "answer_column": {"pld": "max"}, "condition": {"topology": "=='kgd'", "synthesized": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD observed in compounds with a topology of {} and synthesized status {}?"}
{"question": "Determine the minimum CT needed for molecular formulas containing La0.01Sr0.99TiO3 when aged longer than 10 hours.", "refer_dataset": "table11", "column names": ["Molecular formulas", "AH (h)", "CT (℃)"], "condition_column": {"Molecular formulas": "=", "AH (h)": ">"}, "answer_column": {"CT (℃)": "min"}, "condition": {"Molecular formulas": "=='La0.01Sr0.99TiO3'", "AH (h)": ">10"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum CT needed for molecular formulas containing {} when aged longer than {} hours."}
{"question": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above 184.6 K.", "refer_dataset": "table3", "column names": ["A_Tm", "RH2(µmol h-1 g-1)"], "condition_column": {"A_Tm": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "min"}, "condition": {"A_Tm": ">184.6"}, "tool": "calculate_data", "answer": 8600.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above {} K."}
{"question": "How many times has research from Sch Mat Sci & Engn institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='Sch Mat Sci & Engn'"}, "tool": "calculate_data", "answer": 61, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "List organic compounds (OC) with light intensity (I) greater than 1.9 mW/cm².", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2"], "condition_column": {"I, mW/cm2": ">"}, "answer_column": {"OC": ""}, "condition": {"I, mW/cm2": ">1.9"}, "tool": "calculate_data", "answer": [{"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Acetaminophen"}, {"OC": "beta-blocker atenolol"}, {"OC": "Sulfanilamide"}, {"OC": "Sulfacetamide natrium salt"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfadiazine natrium salt"}, {"OC": "Sulfathiazole natrium salt"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iopromide"}, {"OC": "Atrazine"}, {"OC": "Cyanazine"}, {"OC": "Irgarol"}, {"OC": "Prometryne"}, {"OC": "Propazine"}, {"OC": "Dichlofenthion"}, {"OC": "Bromophos ethyl"}, {"OC": "Bromophos methyl"}, {"OC": "Parathion ethyl"}, {"OC": "Parathion methyl"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List organic compounds (OC) with light intensity (I) greater than {} mW/cm²."}
{"question": "How many atoms do structures with a final energy greater than -28.73550159582665 typically have?", "refer_dataset": "table59", "column names": ["final_energy", "natoms"], "condition_column": {"final_energy": ">"}, "answer_column": {"natoms": "count"}, "condition": {"final_energy": ">-28.73550159582665"}, "tool": "calculate_data", "answer": 1057, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many atoms do structures with a final energy greater than {} typically have?"}
{"question": "What is the average methane conversion rate when Cation1 is Ba?", "refer_dataset": "table19", "column names": ["Cation1", "Temp CH4 conv"], "condition_column": {"Cation1": "="}, "answer_column": {"Temp CH4 conv": "avg"}, "condition": {"Cation1": "=='Ba'"}, "tool": "calculate_data", "answer": 750.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average methane conversion rate when Cation1 is {}?"}
{"question": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds 6.0 hours.", "refer_dataset": "table10", "column names": ["irradiation time(h)", "CB edge(V)"], "condition_column": {"irradiation time(h)": ">"}, "answer_column": {"CB edge(V)": "min"}, "condition": {"irradiation time(h)": ">6.0"}, "tool": "calculate_data", "answer": "− 1.1", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds {} hours."}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'AlAs'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='AlAs'"}, "tool": "calculate_data", "answer": 5.399, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "What is the minimum reaction solution volume used when the preparation method is 'Ionic-Liquid-Assisted Microwave'?", "refer_dataset": "table1", "column names": ["Preparation method", "Reaction solution"], "condition_column": {"Preparation method": "="}, "answer_column": {"Reaction solution": "min"}, "condition": {"Preparation method": "=='Ionic-Liquid-Assisted Microwave'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reaction solution volume used when the preparation method is '{}'?"}
{"question": "What is the highest density for materials with pretty_formula equal to PrInPd2?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='PrInPd2'"}, "tool": "calculate_data", "answer": 9.181514861238291, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "What is the median Anion2-mol when CH4-pressure is 0.26?", "refer_dataset": "table20", "column names": ["Anion2-mol", "CH4-pressure"], "condition_column": {"CH4-pressure": "="}, "answer_column": {"Anion2-mol": "median"}, "condition": {"CH4-pressure": "=='0.26'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Anion2-mol when CH4-pressure is {}?"}
{"question": "What is the average number of citations for studies indexed in 2021-08-10 00:00:00?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Cited_Time"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Cited_Time": "avg"}, "condition": {"Indexed_Date": "=='2021-08-10 00:00:00'"}, "tool": "calculate_data", "answer": 5.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of citations for studies indexed in {}?"}
{"question": "Calculate the minimum COx when Cation3-mol < 0.0%, Anion2 = 0.0, and CH4-pressure > 0.67.", "refer_dataset": "table20", "column names": ["Cation3-mol", "Anion2", "CH4-pressure", "COx"], "condition_column": {"Cation3-mol": "<", "Anion2": "=", "CH4-pressure": ">"}, "answer_column": {"COx": "min"}, "condition": {"Cation3-mol": "<0.0", "Anion2": "=='0.0'", "CH4-pressure": ">0.67"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum COx when Cation3-mol < {}%, Anion2 = {}, and CH4-pressure > {}."}
{"question": "What is the maximum bandgap observed in materials from source_id mp-20826?", "refer_dataset": "table67", "column names": ["source_id", "bandgap"], "condition_column": {"source_id": "="}, "answer_column": {"bandgap": "max"}, "condition": {"source_id": "=='mp-20826'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bandgap observed in materials from source_id {}?"}
{"question": "What is the highest Illumination time (min) recorded when Antibiotic dosage (mg/L) equals 200?", "refer_dataset": "table6", "column names": ["Antibiotic dosage (mg/L)", "Illumination time (min)"], "condition_column": {"Antibiotic dosage (mg/L)": "="}, "answer_column": {"Illumination time (min)": "max"}, "condition": {"Antibiotic dosage (mg/L)": "=='200'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Illumination time (min) recorded when Antibiotic dosage (mg/L) equals {}?"}
{"question": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below -27.758493782833494.", "refer_dataset": "table56", "column names": ["mu_b", "shear modulus"], "condition_column": {"shear modulus": "<"}, "answer_column": {"mu_b": "avg"}, "condition": {"shear modulus": "<-27.758493782833494"}, "tool": "calculate_data", "answer": 0.0005919818181818091, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below {}."}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 2.6 eV, light source UV–VIS, and Reaction medium gas-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<2.6", "light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'"}, "tool": "calculate_data", "answer": 3.0171875000000004, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 150°C and references in study [26]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">150", "Ref.": "=='[26]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) greater than -0.3431781066666677?", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": ">"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": ">-0.3431781066666677"}, "tool": "calculate_data", "answer": 163.69975451110025, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) greater than {}?"}
{"question": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > 0.3, Ni < 0.0, and Fe = 0.1?", "refer_dataset": "table16", "column names": ["Mn", "Ni", "Fe", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">", "Ni": "<", "Fe": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.3", "Ni": "<0.0", "Fe": "=='0.1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > {}, Ni < {}, and Fe = {}?"}
{"question": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above 1408.001?", "refer_dataset": "table16", "column names": ["Ca", "J.uAcm2_0.80_fromCV"], "condition_column": {"J.uAcm2_0.80_fromCV": ">"}, "answer_column": {"Ca": "avg"}, "condition": {"J.uAcm2_0.80_fromCV": ">1408.001"}, "tool": "calculate_data", "answer": 0.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above {}?"}
{"question": "What is the highest indirect band gap among materials with energy per atom below -1009.0561 and space group number 187.0?", "refer_dataset": "table59", "column names": ["energy_per_atom", "spacegroup_number", "indir_gap"], "condition_column": {"energy_per_atom": "<", "spacegroup_number": "="}, "answer_column": {"indir_gap": "max"}, "condition": {"energy_per_atom": "<-1009.0561", "spacegroup_number": "=='187.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest indirect band gap among materials with energy per atom below {} and space group number {}?"}
{"question": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than 11.04 eV.", "refer_dataset": "table3", "column names": ["EAa", "Ra"], "condition_column": {"EAa": ">"}, "answer_column": {"Ra": "max"}, "condition": {"EAa": ">11.04"}, "tool": "calculate_data", "answer": 139.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than {} eV."}
{"question": "What is the total formula_energy for materials where ID contains the substring 218?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "sum"}, "condition": {"id": "=='218'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total formula_energy for materials where ID contains the substring {}?"}
{"question": "Calculate the average nanoparticle dose (D) for organic compound Ethyl acetate under light intensity (I) > 0.176 mW/cm² and initial concentration (C0) < 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2", "C0, mg/L", "D, g/L"], "condition_column": {"OC": "=", "I, mW/cm2": ">", "C0, mg/L": "<"}, "answer_column": {"D, g/L": "avg"}, "condition": {"OC": "=='Ethyl acetate'", "I, mW/cm2": ">0.176", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average nanoparticle dose (D) for organic compound {} under light intensity (I) > {} mW/cm² and initial concentration (C0) < {} mg/L."}
{"question": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below 1.83?", "refer_dataset": "table3", "column names": ["χpb", "ρb"], "condition_column": {"χpb": "<"}, "answer_column": {"ρb": "avg"}, "condition": {"χpb": "<1.83"}, "tool": "calculate_data", "answer": 7.124374999999996, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below {}?"}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.51453497060345?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.51453497060345"}, "tool": "calculate_data", "answer": 0.0017980117487573426, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below 1.6287445098492337?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<1.6287445098492337"}, "tool": "calculate_data", "answer": 20.232, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds -0.109?", "refer_dataset": "table51", "column names": ["b3lyp_lumo", "b3lyp_scharber_pce"], "condition_column": {"b3lyp_lumo": ">"}, "answer_column": {"b3lyp_scharber_pce": "sum"}, "condition": {"b3lyp_lumo": ">-0.109"}, "tool": "calculate_data", "answer": 4732.507667191348, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds {}?"}
{"question": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds 104.87 Å, the electronegativity of element B (χpb) is below 1.82, and the molar mass (M) is less than 236.68 g/mol?", "refer_dataset": "table3", "column names": ["Ra", "χpb", "M", "RH2(µmol h-1 g-1)"], "condition_column": {"Ra": ">", "χpb": "<", "M": "<"}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Ra": ">104.87", "χpb": "<1.82", "M": "<236.68"}, "tool": "calculate_data", "answer": 962.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds {} Å, the electronegativity of element B (χpb) is below {}, and the molar mass (M) is less than {} g/mol?"}
{"question": "Determine the average bulk modulus for materials where formation energy (e_form) is less than -0.3431781066666677.", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.3431781066666677"}, "tool": "calculate_data", "answer": 149.34719381300374, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average bulk modulus for materials where formation energy (e_form) is less than {}."}
{"question": "What is the average vol for entries where method is USPEX?", "refer_dataset": "table58", "column names": ["method", "vol"], "condition_column": {"method": "="}, "answer_column": {"vol": "avg"}, "condition": {"method": "=='USPEX'"}, "tool": "calculate_data", "answer": 555.2073333333334, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average vol for entries where method is {}?"}
{"question": "How many times has research from Daegu Gyeongbuk Inst Sci & Technol DGIST institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='Daegu Gyeongbuk Inst Sci & Technol DGIST'"}, "tool": "calculate_data", "answer": 6, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 3.48322964138198?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">3.48322964138198"}, "tool": "calculate_data", "answer": -2.49551034790607, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "What is the average bulk_energy for bulk_formula Kr?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Kr'"}, "tool": "calculate_data", "answer": 69.19919999999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > 2.987947?", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": ">"}, "answer_column": {"Band_gap_GGA": "min"}, "condition": {"Band_gap_HSE_optical": ">2.987947"}, "tool": "calculate_data", "answer": 9.123469, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > {}?"}
{"question": "What is the total sum of optb88vdw_cbm values where offset equals -1.0591856588034192?", "refer_dataset": "table52", "column names": ["optb88vdw_cbm", "offset"], "condition_column": {"offset": "="}, "answer_column": {"optb88vdw_cbm": "sum"}, "condition": {"offset": "=='-1.0591856588034192'"}, "tool": "calculate_data", "answer": 3.6149, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total sum of optb88vdw_cbm values where offset equals {}?"}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 2.45 eV, light source UV–VIS, and Reaction medium liquid-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<2.45", "light source": "=='UV–VIS'", "Reaction medium": "=='liquid-solid'"}, "tool": "calculate_data", "answer": 4.0905, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "What is the average reaction time for Gas phase, VIS light irradiation, and noble metal none?", "refer_dataset": "table7", "column names": ["Phase", "Light", "Noble_Metal", "Rxn_Time"], "condition_column": {"Phase": "=", "Light": "=", "Noble_Metal": "="}, "answer_column": {"Rxn_Time": "avg"}, "condition": {"Phase": "=='Gas'", "Light": "=='VIS'", "Noble_Metal": "=='none'"}, "tool": "calculate_data", "answer": 5.716666666666667, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction time for {} phase, {} light irradiation, and noble metal {}?"}
{"question": "What is the total number of articles indexed on 2019-10-04 00:00:00 that used the electrochemical deposition method?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Judge_Electrochemical_Deposition"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Judge_Electrochemical_Deposition": "count"}, "condition": {"Indexed_Date": "=='2019-10-04 00:00:00'"}, "tool": "calculate_data", "answer": 13, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total number of articles indexed on {} that used the electrochemical deposition method?"}
{"question": "What is the minimum elastic anisotropy for materials with energy above convex hull (e_hull) greater than 0.0039722183333381?", "refer_dataset": "table54", "column names": ["e_hull", "elastic anisotropy"], "condition_column": {"e_hull": ">"}, "answer_column": {"elastic anisotropy": "min"}, "condition": {"e_hull": ">0.0039722183333381"}, "tool": "calculate_data", "answer": 401.4952807290347, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum elastic anisotropy for materials with energy above convex hull (e_hull) greater than {}?"}
{"question": "What is the minimum Tc recorded for materials where formula contains La1.85Ca0.989Sr0.161Cu2O5.93?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "min"}, "condition": {"formula": "=='La1.85Ca0.989Sr0.161Cu2O5.93'"}, "tool": "calculate_data", "answer": 13.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Tc recorded for materials where formula contains {}?"}
{"question": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above 4, support material BaO, and argon pressure 0.15 atm.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Support", "PAr (atm)", "C2 selectivity(%)"], "condition_column": {"CH4/O2 (mol/mol)": ">", "Support": "=", "PAr (atm)": "="}, "answer_column": {"C2 selectivity(%)": "min"}, "condition": {"CH4/O2 (mol/mol)": ">4", "Support": "=='BaO'", "PAr (atm)": "=='0.15'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above {}, support material {}, and argon pressure {} atm."}
{"question": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than 1.3799177251?", "refer_dataset": "table51", "column names": ["pbe0_homo", "pbe0_scharber_pce"], "condition_column": {"pbe0_scharber_pce": "<"}, "answer_column": {"pbe0_homo": "max"}, "condition": {"pbe0_scharber_pce": "<1.3799177251"}, "tool": "calculate_data", "answer": -0.173, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than {}?"}
{"question": "Calculate the average nanoparticle dose (D) for organic compound Chlorobenzene under light intensity (I) > 0.176 mW/cm² and initial concentration (C0) < 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2", "C0, mg/L", "D, g/L"], "condition_column": {"OC": "=", "I, mW/cm2": ">", "C0, mg/L": "<"}, "answer_column": {"D, g/L": "avg"}, "condition": {"OC": "=='Chlorobenzene'", "I, mW/cm2": ">0.176", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average nanoparticle dose (D) for organic compound {} under light intensity (I) > {} mW/cm² and initial concentration (C0) < {} mg/L."}
{"question": "Find the median Band_gap_GGA where Band_gap_HSE_optical < 2.827071.", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": "<"}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Band_gap_HSE_optical": "<2.827071"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.137147}, {"Band_gap_GGA": 1.07639}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.726702}, {"Band_gap_GGA": 0.684651}, {"Band_gap_GGA": 1.173072}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.846528}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.29665}, {"Band_gap_GGA": 0.812729}, {"Band_gap_GGA": 1.253241}, {"Band_gap_GGA": 1.521543}, {"Band_gap_GGA": 0.121138}, {"Band_gap_GGA": 1.327256}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.763006}, {"Band_gap_GGA": 1.6843169999999996}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.080963}, {"Band_gap_GGA": 1.472881}, {"Band_gap_GGA": 0.736109}, {"Band_gap_GGA": 1.199719}, {"Band_gap_GGA": 0.476453}, {"Band_gap_GGA": 0.049785}, {"Band_gap_GGA": 0.796627}, {"Band_gap_GGA": 0.517763}, {"Band_gap_GGA": 0.451375}, {"Band_gap_GGA": 0.041666}, {"Band_gap_GGA": 1.3973739999999997}, {"Band_gap_GGA": 1.20222}, {"Band_gap_GGA": 0.116559}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.015877}, {"Band_gap_GGA": 0.522174}, {"Band_gap_GGA": 0.189223}, {"Band_gap_GGA": 1.000199}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.484641}, {"Band_gap_GGA": 1.00246}, {"Band_gap_GGA": 1.465159}, {"Band_gap_GGA": 1.460508}, {"Band_gap_GGA": 1.461365}, {"Band_gap_GGA": 1.2176}, {"Band_gap_GGA": 0.2031569999999999}, {"Band_gap_GGA": 1.446497}, {"Band_gap_GGA": 1.58958}, {"Band_gap_GGA": 0.585286}, {"Band_gap_GGA": 0.937776}, {"Band_gap_GGA": 0.636041}, {"Band_gap_GGA": 0.611795}, {"Band_gap_GGA": 0.803879}, {"Band_gap_GGA": 1.104735}, {"Band_gap_GGA": 1.254096}, {"Band_gap_GGA": 1.0671210000000002}, {"Band_gap_GGA": 1.321603}, {"Band_gap_GGA": 0.241175}, {"Band_gap_GGA": 0.061293}, {"Band_gap_GGA": 1.413167}, {"Band_gap_GGA": 1.278177}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.20687}, {"Band_gap_GGA": 0.548871}, {"Band_gap_GGA": 0.905913}, {"Band_gap_GGA": 0.908602}, {"Band_gap_GGA": 0.2437109999999998}, {"Band_gap_GGA": 0.227571}, {"Band_gap_GGA": 1.243615}, {"Band_gap_GGA": 0.235177}, {"Band_gap_GGA": 1.265602}, {"Band_gap_GGA": 1.200399}, {"Band_gap_GGA": 0.673361}, {"Band_gap_GGA": 1.322154}, {"Band_gap_GGA": 0.925883}, {"Band_gap_GGA": 1.338733}, {"Band_gap_GGA": 1.352438}, {"Band_gap_GGA": 1.398201}, {"Band_gap_GGA": 1.366053}, {"Band_gap_GGA": 1.562408}, {"Band_gap_GGA": 1.031397}, {"Band_gap_GGA": 0.792268}, {"Band_gap_GGA": 0.538007}, {"Band_gap_GGA": 0.287844}, {"Band_gap_GGA": 0.421518}, {"Band_gap_GGA": 0.018415}, {"Band_gap_GGA": 0.059662}, {"Band_gap_GGA": 0.230802}, {"Band_gap_GGA": 0.284829}, {"Band_gap_GGA": 0.473079}, {"Band_gap_GGA": 1.069901}, {"Band_gap_GGA": 1.525048}, {"Band_gap_GGA": 1.1726}, {"Band_gap_GGA": 1.189953}, {"Band_gap_GGA": 1.107226}, {"Band_gap_GGA": 1.378346}, {"Band_gap_GGA": 0.178726}, {"Band_gap_GGA": 1.246136}, {"Band_gap_GGA": 1.2108659999999998}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.085179}, {"Band_gap_GGA": 1.547412}, {"Band_gap_GGA": 1.557226}, {"Band_gap_GGA": 0.607131}, {"Band_gap_GGA": 0.825042}, {"Band_gap_GGA": 0.086185}, {"Band_gap_GGA": 0.107505}, {"Band_gap_GGA": 1.3517859999999997}, {"Band_gap_GGA": 1.454109}, {"Band_gap_GGA": 0.88018}, {"Band_gap_GGA": 1.104804}, {"Band_gap_GGA": 0.1042529999999999}, {"Band_gap_GGA": 1.551414}, {"Band_gap_GGA": 0.521741}, {"Band_gap_GGA": 0.750842}, {"Band_gap_GGA": 1.051429}, {"Band_gap_GGA": 1.124579}, {"Band_gap_GGA": 1.372531}, {"Band_gap_GGA": 1.553317}, {"Band_gap_GGA": 1.236178}, {"Band_gap_GGA": 1.145202}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.622488}, {"Band_gap_GGA": 0.7822870000000002}, {"Band_gap_GGA": 1.2304019999999998}, {"Band_gap_GGA": 0.616888}, {"Band_gap_GGA": 0.432429}, {"Band_gap_GGA": 0.8573310000000003}, {"Band_gap_GGA": 1.668981}, {"Band_gap_GGA": 0.5023819999999999}, {"Band_gap_GGA": 0.113063}, {"Band_gap_GGA": 0.8669199999999999}, {"Band_gap_GGA": 0.085954}, {"Band_gap_GGA": 0.6606369999999995}, {"Band_gap_GGA": 1.001029}, {"Band_gap_GGA": 0.480542}, {"Band_gap_GGA": 0.505096}, {"Band_gap_GGA": 0.709231}, {"Band_gap_GGA": 1.102893}, {"Band_gap_GGA": 0.798446}, {"Band_gap_GGA": 1.4420350000000002}, {"Band_gap_GGA": 0.508781}, {"Band_gap_GGA": 0.73837}, {"Band_gap_GGA": 1.087724}, {"Band_gap_GGA": 1.218978}, {"Band_gap_GGA": 1.298976}, {"Band_gap_GGA": 1.525452}, {"Band_gap_GGA": 1.423772}, {"Band_gap_GGA": 0.966014}, {"Band_gap_GGA": 0.438332}, {"Band_gap_GGA": 0.867832}, {"Band_gap_GGA": 0.371746}, {"Band_gap_GGA": 1.616284}, {"Band_gap_GGA": 1.362426}, {"Band_gap_GGA": 0.662986}, {"Band_gap_GGA": 1.133092}, 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table data.", "refer_template": "Find the median Band_gap_GGA where Band_gap_HSE_optical < {}."}
{"question": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than 0.299683274361882.", "refer_dataset": "table57", "column names": ["_oqmd_delta_e", "_oqmd_stability"], "condition_column": {"_oqmd_delta_e": ">"}, "answer_column": {"_oqmd_stability": "min"}, "condition": {"_oqmd_delta_e": ">0.299683274361882"}, "tool": "calculate_data", "answer": 4.152984231249998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than {}."}
{"question": "What is the maximum overpotential V for Material Family d-metal, Functionalization 0.0, and Year 1987.0?", "refer_dataset": "table12", "column names": ["Material Family", "Functionalization", "Year", "overpotential V"], "condition_column": {"Material Family": "=", "Functionalization": "=", "Year": "="}, "answer_column": {"overpotential V": "max"}, "condition": {"Material Family": "=='d-metal'", "Functionalization": "=='0.0'", "Year": "=='1987.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum overpotential V for Material Family {}, Functionalization {}, and Year {}?"}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below -221.61416715?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<-221.61416715"}, "tool": "calculate_data", "answer": 21.744707196414268, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "Calculate the average formula_energy for all materials with ID starting with 218?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "avg"}, "condition": {"id": "=='218'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average formula_energy for all materials with ID starting with {}?"}
{"question": "For source_id mp-23229, what is the maximum total magnetization observed?", "refer_dataset": "table67", "column names": ["source_id", "total_magnetization"], "condition_column": {"source_id": "="}, "answer_column": {"total_magnetization": "max"}, "condition": {"source_id": "=='mp-23229'"}, "tool": "calculate_data", "answer": 3.9993176, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For source_id {}, what is the maximum total magnetization observed?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is 0.76730662896953.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='0.76730662896953'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over 0.76730662896953 and Gibbs free energy (G) under 4.91457211979801.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">0.76730662896953", "G": "<4.91457211979801"}, "tool": "calculate_data", "answer": -2.169230446576585, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "What is the minimum desorption temperature (DT) observed for samples aged over 15 hours?", "refer_dataset": "table11", "column names": ["AH (h)", "DT (℃)"], "condition_column": {"AH (h)": ">"}, "answer_column": {"DT (℃)": "min"}, "condition": {"AH (h)": ">15"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum desorption temperature (DT) observed for samples aged over {} hours?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than 0.54135950548886?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">0.54135950548886"}, "tool": "calculate_data", "answer": -0.45094406616084903, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding -7.829999999999999e-05?", "refer_dataset": "table54", "column names": ["mu_b", "shear modulus"], "condition_column": {"mu_b": ">"}, "answer_column": {"shear modulus": "max"}, "condition": {"mu_b": ">-7.829999999999999e-05"}, "tool": "calculate_data", "answer": 420.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding {}?"}
{"question": "What is the median atomic number of elements with activation energy below 2.8?", "refer_dataset": "table18", "column names": ["activation_energy", "A_AtimicN"], "condition_column": {"activation_energy": "<"}, "answer_column": {"A_AtimicN": "median"}, "condition": {"activation_energy": "<2.8"}, "tool": "calculate_data", "answer": [{"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 42}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 26}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 79}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 42}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 25}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 79}, 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{"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 26}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 47}, {"A_AtimicN": 45}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 79}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median atomic number of elements with activation energy below {}?"}
{"question": "Find the maximum Degradation efficiency (%) recorded for Material In2S3-MIL-125-Ti.", "refer_dataset": "table6", "column names": ["Material", "Degradation efficiency (%)"], "condition_column": {"Material": "="}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"Material": "=='In2S3-MIL-125-Ti'"}, "tool": "calculate_data", "answer": 64.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Degradation efficiency (%) recorded for Material {}."}
{"question": "What is the highest SSA observed when CT exceeds 750°C and preparation method is 3?", "refer_dataset": "table11", "column names": ["CT (℃)", "PM", "SSA (m2 g -1 )"], "condition_column": {"CT (℃)": ">", "PM": "="}, "answer_column": {"SSA (m2 g -1 )": "avg"}, "condition": {"CT (℃)": ">750", "PM": "=='3'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SSA observed when CT exceeds {}°C and preparation method is {}?"}
{"question": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds 118.0 Å, the electronegativity of element B (χpb) is below 1.54, and the molar mass (M) is less than 183.5 g/mol?", "refer_dataset": "table3", "column names": ["Ra", "χpb", "M", "RH2(µmol h-1 g-1)"], "condition_column": {"Ra": ">", "χpb": "<", "M": "<"}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Ra": ">118.0", "χpb": "<1.54", "M": "<183.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds {} Å, the electronegativity of element B (χpb) is below {}, and the molar mass (M) is less than {} g/mol?"}
{"question": "What is the minimum pH recorded for Degradation Rate > 94.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">94.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "Retrieve the ID with the highest Tc for materials where formula contains Rh0.005Ti0.995 and Tc exceeds 1.295.", "refer_dataset": "table65", "column names": ["id", "formula", "Tc"], "condition_column": {"formula": "=", "Tc": ">"}, "answer_column": {"id": "max"}, "condition": {"formula": "=='Rh0.005Ti0.995'", "Tc": ">1.295"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Retrieve the ID with the highest Tc for materials where formula contains {} and Tc exceeds {}."}
{"question": "What is the average Onset potential for alloys where Platinum percentage exceeds 0.7%?", "refer_dataset": "table15", "column names": ["Pt", "Onset"], "condition_column": {"Pt": ">"}, "answer_column": {"Onset": "avg"}, "condition": {"Pt": ">0.7"}, "tool": "calculate_data", "answer": 0.49732019102564207, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Onset potential for alloys where Platinum percentage exceeds {}%?"}
{"question": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below -8.789278030395508 and heat capacity (Cv) exceeds 14.84000015258789?", "refer_dataset": "table60", "column names": ["homo", "Cv", "zpve"], "condition_column": {"homo": "<", "Cv": ">"}, "answer_column": {"zpve": "avg"}, "condition": {"homo": "<-8.789278030395508", "Cv": ">14.84000015258789"}, "tool": "calculate_data", "answer": 1.6876399492224057, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the mean zero-point vibrational energy (zpve) when HOMO energy is below {} and heat capacity (Cv) exceeds {}?"}
{"question": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than 0.014698139.", "refer_dataset": "table56", "column names": ["gap pbe", "e_hull"], "condition_column": {"e_hull": "<"}, "answer_column": {"gap pbe": "max"}, "condition": {"e_hull": "<0.014698139"}, "tool": "calculate_data", "answer": 7.7947, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than {}."}
{"question": "What is the average synthesis time for experiments where the major gaseous product is HCOOH?", "refer_dataset": "table7", "column names": ["MAJORgas", "Synthesis_Time"], "condition_column": {"MAJORgas": "="}, "answer_column": {"Synthesis_Time": "avg"}, "condition": {"MAJORgas": "=='HCOOH'"}, "tool": "calculate_data", "answer": 46.46296296296296, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average synthesis time for experiments where the major gaseous product is {}?"}
{"question": "Calculate the average overpotential in alkaline conditions for articles from nan country.", "refer_dataset": "table13", "column names": ["Country", "Alkaline_OVP"], "condition_column": {"Country": "="}, "answer_column": {"Alkaline_OVP": "avg"}, "condition": {"Country": "=='nan'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average overpotential in alkaline conditions for articles from {} country."}
{"question": "Find the average Eg(eV) for samples calcined at exactly 1073.0 K.", "refer_dataset": "table1", "column names": ["Calcination temperature(K)", "Eg(eV)"], "condition_column": {"Calcination temperature(K)": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Calcination temperature(K)": "=='1073.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Eg(eV) for samples calcined at exactly {} K."}
{"question": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above 4, support material BaO–La2O3, and argon pressure 0.15 atm.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Support", "PAr (atm)", "C2 selectivity(%)"], "condition_column": {"CH4/O2 (mol/mol)": ">", "Support": "=", "PAr (atm)": "="}, "answer_column": {"C2 selectivity(%)": "min"}, "condition": {"CH4/O2 (mol/mol)": ">4", "Support": "=='BaO–La2O3'", "PAr (atm)": "=='0.15'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above {}, support material {}, and argon pressure {} atm."}
{"question": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above 24.41416615054893?", "refer_dataset": "table54", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"elastic anisotropy": ">"}, "answer_column": {"gap pbe": "min"}, "condition": {"elastic anisotropy": ">24.41416615054893"}, "tool": "calculate_data", "answer": 4.634, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above {}?"}
{"question": "What is the highest methane conversion rate when Cation1 is Sr, Cation2Amount > 70%, and Support is SiO2?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='Sr'", "Cation2Amount": ">70", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "What is the average degradation rate for experiments using Dopant S with a Calcination Temperature above 450°C?", "refer_dataset": "table8", "column names": ["Dopant", "Calcination temperature(°C)", "Degradation rate(%)"], "condition_column": {"Dopant": "=", "Calcination temperature(°C)": ">"}, "answer_column": {"Degradation rate(%)": "avg"}, "condition": {"Dopant": "=='S'", "Calcination temperature(°C)": ">450"}, "tool": "calculate_data", "answer": 58.612328767123294, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average degradation rate for experiments using Dopant {} with a Calcination Temperature above {}°C?"}
{"question": "How many references document samples calcined for over 10.0 hours?", "refer_dataset": "table1", "column names": ["Calcination time(h)", "Ref"], "condition_column": {"Calcination time(h)": ">"}, "answer_column": {"Ref": "count"}, "condition": {"Calcination time(h)": ">10.0"}, "tool": "calculate_data", "answer": 46, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document samples calcined for over {} hours?"}
{"question": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > 70.0% in under 40.0 minutes of illumination for pH = 7.0?", "refer_dataset": "table8", "column names": ["Catalyst/Pollutant mass ratio", "Degradation rate(%)", "Illumination time(min)", "pH"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "pH": "="}, "answer_column": {"Catalyst/Pollutant mass ratio": ""}, "condition": {"Degradation rate(%)": ">70.0", "Illumination time(min)": "<40.0", "pH": "=='7.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > {}% in under {} minutes of illumination for pH = {}?"}
{"question": "What is the maximum PLD observed in compounds with a topology of fes and synthesized status True?", "refer_dataset": "table62", "column names": ["topology", "synthesized", "pld"], "condition_column": {"topology": "=", "synthesized": "="}, "answer_column": {"pld": "max"}, "condition": {"topology": "=='fes'", "synthesized": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD observed in compounds with a topology of {} and synthesized status {}?"}
{"question": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < 0.4517, scf_vbm > 11.937, and formula is 'BN'.", "refer_dataset": "table66", "column names": ["surf_vbm", "scf_vbm", "formula", "final_energy"], "condition_column": {"surf_vbm": "<", "scf_vbm": ">", "formula": "="}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<0.4517", "scf_vbm": ">11.937", "formula": "=='BN'"}, "tool": "calculate_data", "answer": -210.76255106, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < {}, scf_vbm > {}, and formula is '{}'."}
{"question": "What is the total formula_energy for materials where ID contains the substring 1699?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "sum"}, "condition": {"id": "=='1699'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total formula_energy for materials where ID contains the substring {}?"}
{"question": "How many preparation methods resulted in SSA > 14.46 m²/g and AH < 5.0 hours?", "refer_dataset": "table11", "column names": ["SSA (m2 g -1 )", "AH (h)", "PM"], "condition_column": {"SSA (m2 g -1 )": ">", "AH (h)": "<"}, "answer_column": {"PM": "count"}, "condition": {"SSA (m2 g -1 )": ">14.46", "AH (h)": "<5.0"}, "tool": "calculate_data", "answer": 23, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many preparation methods resulted in SSA > {} m²/g and AH < {} hours?"}
{"question": "List organic compounds (OC) with light intensity (I) greater than 8.2 mW/cm².", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2"], "condition_column": {"I, mW/cm2": ">"}, "answer_column": {"OC": ""}, "condition": {"I, mW/cm2": ">8.2"}, "tool": "calculate_data", "answer": [{"OC": "Atrazine"}, {"OC": "Cyanazine"}, {"OC": "Irgarol"}, {"OC": "Prometryne"}, {"OC": "Propazine"}, {"OC": "Dichlofenthion"}, {"OC": "Bromophos ethyl"}, {"OC": "Bromophos methyl"}, {"OC": "Parathion ethyl"}, {"OC": "Parathion methyl"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List organic compounds (OC) with light intensity (I) greater than {} mW/cm²."}
{"question": "What is the maximum yield of C2 hydrocarbons for catalysts with Support material Al2O3?", "refer_dataset": "table19", "column names": ["Support", "C2 yield"], "condition_column": {"Support": "="}, "answer_column": {"C2 yield": "max"}, "condition": {"Support": "=='Al2O3'"}, "tool": "calculate_data", "answer": 100.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum yield of C2 hydrocarbons for catalysts with Support material {}?"}
{"question": "What is the average Degradation efficiency (%) when Surface area (m2/g) > 15.95, Pore Volume (cm3/g) < 0.11, and pH is 1.0?", "refer_dataset": "table6", "column names": ["Surface area (m2/g)", "Pore Volume (cm3/g)", "pH", "Degradation efficiency (%)"], "condition_column": {"Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<", "pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Surface area (m2/g)": ">15.95", "Pore Volume (cm3/g)": "<0.11", "pH": "=='1.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when Surface area (m2/g) > {}, Pore Volume (cm3/g) < {}, and pH is {}?"}
{"question": "What is the total number of articles indexed on 2019-10-18 00:00:00 that used the electrochemical deposition method?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Judge_Electrochemical_Deposition"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Judge_Electrochemical_Deposition": "count"}, "condition": {"Indexed_Date": "=='2019-10-18 00:00:00'"}, "tool": "calculate_data", "answer": 4, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total number of articles indexed on {} that used the electrochemical deposition method?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -6.71425764235072 and the HOMO-LUMO gap (gap) is less than 5.35591684810335?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-6.71425764235072", "gap": "<5.35591684810335"}, "tool": "calculate_data", "answer": 2.05689453649337, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above 0.67245591.", "refer_dataset": "table66", "column names": ["efermi", "final_energy"], "condition_column": {"efermi": ">"}, "answer_column": {"final_energy": "min"}, "condition": {"efermi": ">0.67245591"}, "tool": "calculate_data", "answer": 47.1431938, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above {}."}
{"question": "What is the highest Illumination time (min) recorded when Antibiotic dosage (mg/L) equals 20?", "refer_dataset": "table6", "column names": ["Antibiotic dosage (mg/L)", "Illumination time (min)"], "condition_column": {"Antibiotic dosage (mg/L)": "="}, "answer_column": {"Illumination time (min)": "max"}, "condition": {"Antibiotic dosage (mg/L)": "=='20'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Illumination time (min) recorded when Antibiotic dosage (mg/L) equals {}?"}
{"question": "How many synthesized compounds have a net magnetic moment above 60.0?", "refer_dataset": "table62", "column names": ["synthesized", "net_magmom"], "condition_column": {"net_magmom": ">"}, "answer_column": {"synthesized": "count"}, "condition": {"net_magmom": ">60.0"}, "tool": "calculate_data", "answer": 3, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many synthesized compounds have a net magnetic moment above {}?"}
{"question": "How many times has research from Tianjin Polytech Univ institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='Tianjin Polytech Univ'"}, "tool": "calculate_data", "answer": 97, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "What is the maximum pH recorded for Pollutant MB under Light Wavelength 345 nm?", "refer_dataset": "table8", "column names": ["Pollutant", "Light wavelength(nm)", "pH"], "condition_column": {"Pollutant": "=", "Light wavelength(nm)": "<"}, "answer_column": {"pH": "max"}, "condition": {"Pollutant": "=='MB'", "Light wavelength(nm)": "<345"}, "tool": "calculate_data", "answer": 13.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH recorded for Pollutant {} under Light Wavelength {} nm?"}
{"question": "What is the average Degradation efficiency (%) when pH is 2.5?", "refer_dataset": "table6", "column names": ["pH", "Degradation efficiency (%)"], "condition_column": {"pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"pH": "=='2.5'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when pH is {}?"}
{"question": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above 847.87 K.", "refer_dataset": "table3", "column names": ["A_Tm", "RH2(µmol h-1 g-1)"], "condition_column": {"A_Tm": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "min"}, "condition": {"A_Tm": ">847.87"}, "tool": "calculate_data", "answer": 8600.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above {} K."}
{"question": "What is the average number of atoms per structure in materials with a crystal system of tetragonal and space group symbol P4/nmm?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='tetragonal'", "spacegroup_symbol": "=='P4/nmm'"}, "tool": "calculate_data", "answer": 3.5330396475770924, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "How many synthesized compounds have a net magnetic moment above 9.0?", "refer_dataset": "table62", "column names": ["synthesized", "net_magmom"], "condition_column": {"net_magmom": ">"}, "answer_column": {"synthesized": "count"}, "condition": {"net_magmom": ">9.0"}, "tool": "calculate_data", "answer": 240, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many synthesized compounds have a net magnetic moment above {}?"}
{"question": "What is the maximum bandgap observed in materials from source_id mp-776922?", "refer_dataset": "table67", "column names": ["source_id", "bandgap"], "condition_column": {"source_id": "="}, "answer_column": {"bandgap": "max"}, "condition": {"source_id": "=='mp-776922'"}, "tool": "calculate_data", "answer": 1.9866, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bandgap observed in materials from source_id {}?"}
{"question": "What is the maximum shear modulus recorded for materials with the chemical formula Cs?", "refer_dataset": "table56", "column names": ["shear modulus", "formula"], "condition_column": {"formula": "="}, "answer_column": {"shear modulus": "max"}, "condition": {"formula": "=='Cs'"}, "tool": "calculate_data", "answer": 0.4398626224592421, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus recorded for materials with the chemical formula {}?"}
{"question": "What is the minimum total energy for materials with an LCD of 2.03948?", "refer_dataset": "table62", "column names": ["lcd", "energy_total"], "condition_column": {"lcd": "="}, "answer_column": {"energy_total": "min"}, "condition": {"lcd": "=='2.03948'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum total energy for materials with an LCD of {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than 0.1811112450000003?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<0.1811112450000003"}, "tool": "calculate_data", "answer": 124.1921915520488, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "How many references document perovskite oxides with a calcination temperature (CT) above 600°C?", "refer_dataset": "table11", "column names": ["CT (℃)", "Ref."], "condition_column": {"CT (℃)": ">"}, "answer_column": {"Ref.": "count"}, "condition": {"CT (℃)": ">600"}, "tool": "calculate_data", "answer": 75, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document perovskite oxides with a calcination temperature (CT) above {}°C?"}
{"question": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > 2.8125, scf_vbm < 8.554, and formula contains 'ThSbRh'?", "refer_dataset": "table66", "column names": ["surf_cbm", "scf_vbm", "formula", "efermi"], "condition_column": {"surf_cbm": ">", "scf_vbm": "<", "formula": "="}, "answer_column": {"efermi": "min"}, "condition": {"surf_cbm": ">2.8125", "scf_vbm": "<8.554", "formula": "=='ThSbRh'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > {}, scf_vbm < {}, and formula contains '{}'?"}
{"question": "What is the highest ethylene selectivity observed when Support is Al2O5?", "refer_dataset": "table19", "column names": ["Support", "C2H4 sel"], "condition_column": {"Support": "="}, "answer_column": {"C2H4 sel": "max"}, "condition": {"Support": "=='Al2O5'"}, "tool": "calculate_data", "answer": 10.3, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ethylene selectivity observed when Support is {}?"}
{"question": "Determine the maximum CH4 conversion (%) observed for experiments with a support material of BaO.", "refer_dataset": "table21", "column names": ["Support", "CH4 conversion (%)"], "condition_column": {"Support": "="}, "answer_column": {"CH4 conversion (%)": "max"}, "condition": {"Support": "=='BaO'"}, "tool": "calculate_data", "answer": 52.59805189, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum CH4 conversion (%) observed for experiments with a support material of {}."}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -4.12550730830239.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-4.12550730830239"}, "tool": "calculate_data", "answer": -2.9045414733165447, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 1.93 eV, light source UV–VIS, and Reaction medium gas-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<1.93", "light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'"}, "tool": "calculate_data", "answer": 2.8524999999999996, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "For entries where dipole moment (mu) is below 3.728600025177002, what is the average polarizability (alpha)?", "refer_dataset": "table60", "column names": ["mu", "alpha"], "condition_column": {"mu": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": "<3.728600025177002"}, "tool": "calculate_data", "answer": 59.93974943610248, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For entries where dipole moment (mu) is below {}, what is the average polarizability (alpha)?"}
{"question": "Identify materials where enthalpy (H) is greater than -17.3896541595459, energy gap (gap) is less than 13.736308097839355, and R² spatial extent is above 35.36410140991211. What is their maximum internal energy (U)?", "refer_dataset": "table60", "column names": ["H", "gap", "r2", "U"], "condition_column": {"H": ">", "gap": "<", "r2": ">"}, "answer_column": {"U": "max"}, "condition": {"H": ">-17.3896541595459", "gap": "<13.736308097839355", "r2": ">35.36410140991211"}, "tool": "calculate_data", "answer": -13.135290145874023, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where enthalpy (H) is greater than {}, energy gap (gap) is less than {}, and R² spatial extent is above {}. What is their maximum internal energy (U)?"}
{"question": "What is the number of articles from Australia country that triggered an OER data warning?", "refer_dataset": "table13", "column names": ["Country", "Warning_OER.1"], "condition_column": {"Country": "="}, "answer_column": {"Warning_OER.1": "count"}, "condition": {"Country": "=='Australia'"}, "tool": "calculate_data", "answer": 30, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the number of articles from {} country that triggered an OER data warning?"}
{"question": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below 1.33?", "refer_dataset": "table3", "column names": ["χpb", "ρb"], "condition_column": {"χpb": "<"}, "answer_column": {"ρb": "avg"}, "condition": {"χpb": "<1.33"}, "tool": "calculate_data", "answer": 6.779999999999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below {}?"}
{"question": "Find the Illumination Time required to reach 62.0% Degradation Rate with pH = 7.0 and Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "pH", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": ">", "pH": "=", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": ""}, "condition": {"Degradation rate(%)": ">62.0", "pH": "=='7.0'", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the Illumination Time required to reach {}% Degradation Rate with pH = {} and Dopant/Ti mole ratio {}."}
{"question": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than 2.477.", "refer_dataset": "table66", "column names": ["scf_vbm", "efermi"], "condition_column": {"scf_vbm": ">"}, "answer_column": {"efermi": "min"}, "condition": {"scf_vbm": ">2.477"}, "tool": "calculate_data", "answer": 7.27774779, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than {}."}
{"question": "Find the average CH4-conversion% for reactions where Cation1 = 82.0, Contact-times > 4.3, and O2-pressure < 0.033.", "refer_dataset": "table20", "column names": ["Cation1", "Contact-times", "O2-pressure", "CH4-conversion%"], "condition_column": {"Cation1": "=", "Contact-times": ">", "O2-pressure": "<"}, "answer_column": {"CH4-conversion%": "avg"}, "condition": {"Cation1": "=='82.0'", "Contact-times": ">4.3", "O2-pressure": "<0.033"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average CH4-conversion% for reactions where Cation1 = {}, Contact-times > {}, and O2-pressure < {}."}
{"question": "What is the average total yield for experiments with photocatalyst(s) 1 wt% Pt-Zn2GeO4/ZIF-8 nanorods, Liquid phase, and sacrificial agent percentage above 0.0%?", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Phase", "SacrAgentPercent", "total"], "condition_column": {"Photocatalyst(s)": "=", "Phase": "=", "SacrAgentPercent": ">"}, "answer_column": {"total": "avg"}, "condition": {"Photocatalyst(s)": "=='1 wt% Pt-Zn2GeO4/ZIF-8 nanorods'", "Phase": "=='Liquid'", "SacrAgentPercent": ">0.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average total yield for experiments with photocatalyst(s) {}, {} phase, and sacrificial agent percentage above {}%?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is Na2SO3 and Alcohol% exceeds 0.0?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='Na2SO3'", "Alcohol%": ">0.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "What is the average Degradation efficiency (%) when Surface area (m2/g) > 15.95, Pore Volume (cm3/g) < 0.11, and pH is 3.0?", "refer_dataset": "table6", "column names": ["Surface area (m2/g)", "Pore Volume (cm3/g)", "pH", "Degradation efficiency (%)"], "condition_column": {"Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<", "pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Surface area (m2/g)": ">15.95", "Pore Volume (cm3/g)": "<0.11", "pH": "=='3.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when Surface area (m2/g) > {}, Pore Volume (cm3/g) < {}, and pH is {}?"}
{"question": "What is the average Temperature when CH4-conversion% exceeds 5.0%?", "refer_dataset": "table20", "column names": ["Temperature", "CH4-conversion%"], "condition_column": {"CH4-conversion%": ">"}, "answer_column": {"Temperature": "avg"}, "condition": {"CH4-conversion%": ">5.0"}, "tool": "calculate_data", "answer": 1030.2332134292567, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Temperature when CH4-conversion% exceeds {}%?"}
{"question": "Determine the minimum CT needed for molecular formulas containing LaFeO3 when aged longer than 4 hours.", "refer_dataset": "table11", "column names": ["Molecular formulas", "AH (h)", "CT (℃)"], "condition_column": {"Molecular formulas": "=", "AH (h)": ">"}, "answer_column": {"CT (℃)": "min"}, "condition": {"Molecular formulas": "=='LaFeO3'", "AH (h)": ">4"}, "tool": "calculate_data", "answer": 750, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum CT needed for molecular formulas containing {} when aged longer than {} hours."}
{"question": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds -0.103?", "refer_dataset": "table51", "column names": ["b3lyp_lumo", "b3lyp_scharber_pce"], "condition_column": {"b3lyp_lumo": ">"}, "answer_column": {"b3lyp_scharber_pce": "sum"}, "condition": {"b3lyp_lumo": ">-0.103"}, "tool": "calculate_data", "answer": 2396.7959748314825, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of B3LYP Scharber efficiency values for entries where B3LYP LUMO level exceeds {}?"}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below -71.59924914?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<-71.59924914"}, "tool": "calculate_data", "answer": 26.95001607174691, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "What is the minimum Bandgap (Eg) observed at a loading of 1.363636364 g/l?", "refer_dataset": "table10", "column names": ["loading (g/l)", "Eg(eV)"], "condition_column": {"loading (g/l)": "="}, "answer_column": {"Eg(eV)": "min"}, "condition": {"loading (g/l)": "=='1.363636364'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Bandgap (Eg) observed at a loading of {} g/l?"}
{"question": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN 7.0, Bn (count of B) 1.0, and Formation Energy ≤ 0.52?", "refer_dataset": "table22", "column names": ["C_AtomN", "Bn", "Formation_E", "Volume"], "condition_column": {"C_AtomN": "=", "Bn": "=", "Formation_E": "<="}, "answer_column": {"Volume": "min"}, "condition": {"C_AtomN": "=='7.0'", "Bn": "=='1.0'", "Formation_E": "<=0.52"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN {}, Bn (count of B) {}, and Formation Energy ≤ {}?"}
{"question": "For entries where dipole moment (mu) is below 1.7675000429153442, what is the average polarizability (alpha)?", "refer_dataset": "table60", "column names": ["mu", "alpha"], "condition_column": {"mu": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": "<1.7675000429153442"}, "tool": "calculate_data", "answer": 62.123823329204505, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For entries where dipole moment (mu) is below {}, what is the average polarizability (alpha)?"}
{"question": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than 3.20172555102?", "refer_dataset": "table51", "column names": ["pbe0_homo", "pbe0_scharber_pce"], "condition_column": {"pbe0_scharber_pce": "<"}, "answer_column": {"pbe0_homo": "max"}, "condition": {"pbe0_scharber_pce": "<3.20172555102"}, "tool": "calculate_data", "answer": -0.173, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than {}?"}
{"question": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds 100.76 kJ/mol.", "refer_dataset": "table3", "column names": ["ΔfusHa", "B_Tm"], "condition_column": {"ΔfusHa": ">"}, "answer_column": {"B_Tm": "min"}, "condition": {"ΔfusHa": ">100.76"}, "tool": "calculate_data", "answer": 2952.29, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds {} kJ/mol."}
{"question": "What is the minimum Bandgap (Eg) observed at a loading of 0.142857143 g/l?", "refer_dataset": "table10", "column names": ["loading (g/l)", "Eg(eV)"], "condition_column": {"loading (g/l)": "="}, "answer_column": {"Eg(eV)": "min"}, "condition": {"loading (g/l)": "=='0.142857143'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Bandgap (Eg) observed at a loading of {} g/l?"}
{"question": "How many Preparations have Contact-times shorter than 1.03 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<1.03"}, "tool": "calculate_data", "answer": 1347, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 50.0?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">50.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than 5.577, I1b is greater than 7.741, and ρa exceeds 6.15?", "refer_dataset": "table2", "column names": ["I1a", "I1b", "ρa", "EAa"], "condition_column": {"I1a": "<", "I1b": ">", "ρa": ">"}, "answer_column": {"EAa": "avg"}, "condition": {"I1a": "<5.577", "I1b": ">7.741", "ρa": ">6.15"}, "tool": "calculate_data", "answer": 0.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Electron Affinity of A (EAa) for materials where I1a is less than {}, I1b is greater than {}, and ρa exceeds {}?"}
{"question": "What is the minimum SBET (m²/g) required for Bi type BiOCl, light source UV–VIS, and Yield > 0.175 μmol/g/h?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "light source", "Yield (μmol/g/h)", "SBET (m2 /g)"], "condition_column": {"Bi type in photocatalyst": "=", "light source": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"SBET (m2 /g)": "min"}, "condition": {"Bi type in photocatalyst": "=='BiOCl'", "light source": "=='UV–VIS'", "Yield (μmol/g/h)": ">0.175"}, "tool": "calculate_data", "answer": 97.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum SBET (m²/g) required for Bi type {}, light source {}, and Yield > {} μmol/g/h?"}
{"question": "What is the average Power(W) for materials where X is S, A mole is greater than 0.191, and Wave length(<nm) below 420.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='S'", "A mole": ">0.191", "Wave length(<nm)": "<420.0"}, "tool": "calculate_data", "answer": 300.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "What is the minimum M1 atom number required to achieve C2s greater than 28.59?", "refer_dataset": "table17", "column names": ["M1_atom_number", "C2s"], "condition_column": {"C2s": ">"}, "answer_column": {"M1_atom_number": "min"}, "condition": {"C2s": ">28.59"}, "tool": "calculate_data", "answer": 25, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum M1 atom number required to achieve C2s greater than {}?"}
{"question": "What is the average reaction energy for elements with atomic number greater than 75?", "refer_dataset": "table18", "column names": ["A_AtimicN", "reaction_energy"], "condition_column": {"A_AtimicN": ">"}, "answer_column": {"reaction_energy": "avg"}, "condition": {"A_AtimicN": ">75"}, "tool": "calculate_data", "answer": 0.6715521111111109, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction energy for elements with atomic number greater than {}?"}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.0, gap pbe > 1.0918, and mu_b > 0.0009920999999999?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.0", "gap pbe": ">1.0918", "mu_b": ">0.0009920999999999"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "Determine the minimum pH where Material is UiO-66-WO3/GO, Surface area (m2/g) > 379.51, and Pore Volume (cm3/g) < 0.2.", "refer_dataset": "table6", "column names": ["Material", "Surface area (m2/g)", "Pore Volume (cm3/g)", "pH"], "condition_column": {"Material": "=", "Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<"}, "answer_column": {"pH": "min"}, "condition": {"Material": "=='UiO-66-WO3/GO'", "Surface area (m2/g)": ">379.51", "Pore Volume (cm3/g)": "<0.2"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum pH where Material is {}, Surface area (m2/g) > {}, and Pore Volume (cm3/g) < {}."}
{"question": "What is the average argon partial pressure (atm) when reaction temperature is above 750°C?", "refer_dataset": "table21", "column names": ["Temp. (°C)", "PAr (atm)"], "condition_column": {"Temp. (°C)": ">"}, "answer_column": {"PAr (atm)": "avg"}, "condition": {"Temp. (°C)": ">750"}, "tool": "calculate_data", "answer": 0.4308339429407389, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average argon partial pressure (atm) when reaction temperature is above {}°C?"}
{"question": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than -9.330212593078612?", "refer_dataset": "table60", "column names": ["H", "U0"], "condition_column": {"H": ">"}, "answer_column": {"U0": "max"}, "condition": {"H": ">-9.330212593078612"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than {}?"}
{"question": "Find the average C2 selectivity(%) for catalysts where the tertiary metal component (M3) is Ce.", "refer_dataset": "table21", "column names": ["M3", "C2 selectivity(%)"], "condition_column": {"M3": "="}, "answer_column": {"C2 selectivity(%)": "avg"}, "condition": {"M3": "=='Ce'"}, "tool": "calculate_data", "answer": 51.287222678076915, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average C2 selectivity(%) for catalysts where the tertiary metal component (M3) is {}."}
{"question": "What is the average Ruthenium content in alloys where Onset potential is greater than 0.49997V?", "refer_dataset": "table15", "column names": ["Ru", "Onset"], "condition_column": {"Onset": ">"}, "answer_column": {"Ru": "avg"}, "condition": {"Onset": ">0.49997"}, "tool": "calculate_data", "answer": 11.073684210526316, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Ruthenium content in alloys where Onset potential is greater than {}V?"}
{"question": "Calculate the maximum formation energy per atom for materials with space group number 166.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "max"}, "condition": {"spacegroup_number": "=='166'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum formation energy per atom for materials with space group number {}."}
{"question": "Find the minimum formation energy per atom for compounds in the space group number 164.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "min"}, "condition": {"spacegroup_number": "=='164'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum formation energy per atom for compounds in the space group number {}."}
{"question": "How many preparation methods resulted in SSA > 42.8 m²/g and AH < 10.0 hours?", "refer_dataset": "table11", "column names": ["SSA (m2 g -1 )", "AH (h)", "PM"], "condition_column": {"SSA (m2 g -1 )": ">", "AH (h)": "<"}, "answer_column": {"PM": "count"}, "condition": {"SSA (m2 g -1 )": ">42.8", "AH (h)": "<10.0"}, "tool": "calculate_data", "answer": 1, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many preparation methods resulted in SSA > {} m²/g and AH < {} hours?"}
{"question": "Determine the average bulk modulus for materials where formation energy (e_form) is less than 0.1074050600000005.", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<0.1074050600000005"}, "tool": "calculate_data", "answer": 150.51709892114513, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average bulk modulus for materials where formation energy (e_form) is less than {}."}
{"question": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"NM\", Space_group_rlx 194, and Band_gap_HSE > 0.5201560000000001.", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Space_group_rlx", "Band_gap_HSE", "Band_gap_GGA_optical"], "condition_column": {"Magnetic_ordering": "=", "Space_group_rlx": "=", "Band_gap_HSE": ">"}, "answer_column": {"Band_gap_GGA_optical": "avg"}, "condition": {"Magnetic_ordering": "=='NM'", "Space_group_rlx": "=='194'", "Band_gap_HSE": ">0.5201560000000001"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"{}\", Space_group_rlx {}, and Band_gap_HSE > {}."}
{"question": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below 727.0 K, the electron affinity of element A (EAa) exceeds 14.0 eV, and the hydrogen production rate (RH2) is higher than 63.0 µmol h⁻¹ g⁻¹.", "refer_dataset": "table3", "column names": ["A_Tm", "EAa", "RH2(µmol h-1 g-1)", "χpb"], "condition_column": {"A_Tm": "<", "EAa": ">", "RH2(µmol h-1 g-1)": ">"}, "answer_column": {"χpb": "median"}, "condition": {"A_Tm": "<727.0", "EAa": ">14.0", "RH2(µmol h-1 g-1)": ">63.0"}, "tool": "calculate_data", "answer": [{"χpb": 1.54}, {"χpb": 1.6}, {"χpb": 1.6}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below {} K, the electron affinity of element A (EAa) exceeds {} eV, and the hydrogen production rate (RH2) is higher than {} µmol h⁻¹ g⁻¹."}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than 2.015?", "refer_dataset": "table2", "column names": ["Ra/Rb", "Eg(eV)"], "condition_column": {"Ra/Rb": ">"}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Ra/Rb": ">2.015"}, "tool": "calculate_data", "answer": 1.97, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than {}?"}
{"question": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above 2, support material La2O3, and argon pressure 0.7 atm.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Support", "PAr (atm)", "C2 selectivity(%)"], "condition_column": {"CH4/O2 (mol/mol)": ">", "Support": "=", "PAr (atm)": "="}, "answer_column": {"C2 selectivity(%)": "min"}, "condition": {"CH4/O2 (mol/mol)": ">2", "Support": "=='La2O3'", "PAr (atm)": "=='0.7'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above {}, support material {}, and argon pressure {} atm."}
{"question": "What is the highest Yield (μmol/g/h) for Bi type BiOI, Reaction medium gas-solid, and light source Visible?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Reaction medium", "light source", "Yield (μmol/g/h)"], "condition_column": {"Bi type in photocatalyst": "=", "Reaction medium": "=", "light source": "="}, "answer_column": {"Yield (μmol/g/h)": "max"}, "condition": {"Bi type in photocatalyst": "=='BiOI'", "Reaction medium": "=='gas-solid'", "light source": "=='Visible'"}, "tool": "calculate_data", "answer": 4.1, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Yield (μmol/g/h) for Bi type {}, Reaction medium {}, and light source {}?"}
{"question": "What is the highest Lattice Parameter observed when A_AtomN is 12.0, B_AtomN > 46.0, and Volume < 61.0011572512?", "refer_dataset": "table22", "column names": ["A_AtomN", "B_AtomN", "Volume", "Lattice"], "condition_column": {"A_AtomN": "=", "B_AtomN": ">", "Volume": "<"}, "answer_column": {"Lattice": "max"}, "condition": {"A_AtomN": "=='12.0'", "B_AtomN": ">46.0", "Volume": "<61.0011572512"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Lattice Parameter observed when A_AtomN is {}, B_AtomN > {}, and Volume < {}?"}
{"question": "What is the minimum Gold percentage in alloys where Ruthenium exceeds 1.8%?", "refer_dataset": "table15", "column names": ["Ru", "Au"], "condition_column": {"Ru": ">"}, "answer_column": {"Au": "min"}, "condition": {"Ru": ">1.8"}, "tool": "calculate_data", "answer": 36.3, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Gold percentage in alloys where Ruthenium exceeds {}%?"}
{"question": "What is the minimum hydrogen selectivity for Cation3 W?", "refer_dataset": "table19", "column names": ["Cation3", "H2 sel"], "condition_column": {"Cation3": "="}, "answer_column": {"H2 sel": "min"}, "condition": {"Cation3": "=='W'"}, "tool": "calculate_data", "answer": 62.8, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum hydrogen selectivity for Cation3 {}?"}
{"question": "What is the highest C2 selectivity (C2s) for M1 = Mn, M2_mol < 0.37, and Support = SiCnf?", "refer_dataset": "table17", "column names": ["M1", "M2_mol", "Support", "C2s"], "condition_column": {"M1": "=", "M2_mol": "<", "Support": "="}, "answer_column": {"C2s": "max"}, "condition": {"M1": "=='Mn'", "M2_mol": "<0.37", "Support": "=='SiCnf'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C2 selectivity (C2s) for M1 = {}, M2_mol < {}, and Support = {}?"}
{"question": "How many catalysts use M1 as Zn, M2 as Mo, and achieve CH4 conversion (%) above 35.12904098%?", "refer_dataset": "table21", "column names": ["M1", "M2", "CH4 conversion (%)", "Code"], "condition_column": {"M1": "=", "M2": "=", "CH4 conversion (%)": ">"}, "answer_column": {"Code": "count"}, "condition": {"M1": "=='Zn'", "M2": "=='Mo'", "CH4 conversion (%)": ">35.12904098"}, "tool": "calculate_data", "answer": 9, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many catalysts use M1 as {}, M2 as {}, and achieve CH4 conversion (%) above {}%?"}
{"question": "Determine the average temperature (°C) required to achieve C2 yield (%) over 2.739859053% with M2 as Mo and PAr below 0.4 atm.", "refer_dataset": "table21", "column names": ["C2 yield (%)", "M2", "PAr (atm)", "Temp. (°C)"], "condition_column": {"C2 yield (%)": ">", "M2": "=", "PAr (atm)": "<"}, "answer_column": {"Temp. (°C)": "avg"}, "condition": {"C2 yield (%)": ">2.739859053", "M2": "=='Mo'", "PAr (atm)": "<0.4"}, "tool": "calculate_data", "answer": 805.921052631579, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average temperature (°C) required to achieve C2 yield (%) over {}% with M2 as {} and PAr below {} atm."}
{"question": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above 6.834 eV, the density of element B (ρb) exceeds 4.59 g/cm³, and the tolerance factor (t) is less than 0.939.", "refer_dataset": "table3", "column names": ["I1b", "ρb", "t", "A_Tb"], "condition_column": {"I1b": ">", "ρb": ">", "t": "<"}, "answer_column": {"A_Tb": "max"}, "condition": {"I1b": ">6.834", "ρb": ">4.59", "t": "<0.939"}, "tool": "calculate_data", "answer": 3520.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above {} eV, the density of element B (ρb) exceeds {} g/cm³, and the tolerance factor (t) is less than {}."}
{"question": "What is the maximum pH observed where Degradation efficiency (%) is greater than 8.2?", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "pH"], "condition_column": {"pH": ">"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"pH": ">8.2"}, "tool": "calculate_data", "answer": 99.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH observed where Degradation efficiency (%) is greater than {}?"}
{"question": "What is the average C2 yield (%) for catalysts where the primary metal component (M1) is Mg?", "refer_dataset": "table21", "column names": ["M1", "C2 yield (%)"], "condition_column": {"M1": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='Mg'"}, "tool": "calculate_data", "answer": 12.940173790326922, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average C2 yield (%) for catalysts where the primary metal component (M1) is {}?"}
{"question": "Find the average C2 selectivity(%) for catalysts where the tertiary metal component (M3) is Hf.", "refer_dataset": "table21", "column names": ["M3", "C2 selectivity(%)"], "condition_column": {"M3": "="}, "answer_column": {"C2 selectivity(%)": "avg"}, "condition": {"M3": "=='Hf'"}, "tool": "calculate_data", "answer": 32.50849211547079, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average C2 selectivity(%) for catalysts where the tertiary metal component (M3) is {}."}
{"question": "What is the median atomic number of elements with activation energy below 1.65?", "refer_dataset": "table18", "column names": ["activation_energy", "A_AtimicN"], "condition_column": {"activation_energy": "<"}, "answer_column": {"A_AtimicN": "median"}, "condition": {"activation_energy": "<1.65"}, "tool": "calculate_data", "answer": [{"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 26}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 79}, {"A_AtimicN": 42}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 25}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 28}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 25}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 25}, {"A_AtimicN": 27}, {"A_AtimicN": 78}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 42}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 78}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 42}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 29}, {"A_AtimicN": 42}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 44}, {"A_AtimicN": 77}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 75}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 26}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 42}, {"A_AtimicN": 30}, {"A_AtimicN": 30}, {"A_AtimicN": 47}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 30}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 42}, {"A_AtimicN": 28}, {"A_AtimicN": 47}, {"A_AtimicN": 26}, {"A_AtimicN": 26}, {"A_AtimicN": 23}, {"A_AtimicN": 47}, {"A_AtimicN": 79}, {"A_AtimicN": 42}, {"A_AtimicN": 74}, {"A_AtimicN": 79}, {"A_AtimicN": 77}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 73}, {"A_AtimicN": 23}, {"A_AtimicN": 29}, {"A_AtimicN": 28}, {"A_AtimicN": 73}, {"A_AtimicN": 74}, {"A_AtimicN": 45}, {"A_AtimicN": 77}, {"A_AtimicN": 27}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 76}, 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{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 1.0, Indirect Bandgap < 0.0, and Lattice Parameter 4.1920602095?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='1.0'", "Indirect_Band": "<0.0", "Lattice": "=='4.1920602095'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
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{"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 75}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 75}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 27}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 45}, {"A_AtimicN": 46}, {"A_AtimicN": 45}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 30}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 26}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 75}, {"A_AtimicN": 44}, {"A_AtimicN": 26}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 77}, {"A_AtimicN": 44}, {"A_AtimicN": 45}, {"A_AtimicN": 27}, {"A_AtimicN": 44}, {"A_AtimicN": 28}, {"A_AtimicN": 27}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 28}, {"A_AtimicN": 45}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 78}, {"A_AtimicN": 46}, {"A_AtimicN": 46}, {"A_AtimicN": 28}, {"A_AtimicN": 29}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 45}, {"A_AtimicN": 78}, {"A_AtimicN": 44}, {"A_AtimicN": 29}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 47}, {"A_AtimicN": 46}, {"A_AtimicN": 47}, {"A_AtimicN": 78}, {"A_AtimicN": 78}, {"A_AtimicN": 47}, {"A_AtimicN": 30}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}, {"A_AtimicN": 29}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median atomic number of elements with activation energy below {}?"}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is Ba, Support is BaO, and CH4/O2 ratio is 2?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='Ba'", "Support": "=='BaO'", "CH4/O2 (mol/mol)": "=='2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "What is the average Surface Area(m2/g) for materials with A equal to Zn, B equal to In, and Wave length(<nm) below 420.0?", "refer_dataset": "table4", "column names": ["A", "B", "Wave length(<nm)", "Surface Area(m2/g)"], "condition_column": {"A": "=", "B": "=", "Wave length(<nm)": "<"}, "answer_column": {"Surface Area(m2/g)": "avg"}, "condition": {"A": "=='Zn'", "B": "=='In'", "Wave length(<nm)": "<420.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Area(m2/g) for materials with A equal to {}, B equal to {}, and Wave length(<nm) below {}?"}
{"question": "What is the average Power(W) for materials where X is O, A mole is greater than 0.475, and Wave length(<nm) below 420.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='O'", "A mole": ">0.475", "Wave length(<nm)": "<420.0"}, "tool": "calculate_data", "answer": 364.5, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than 2.665.", "refer_dataset": "table66", "column names": ["scf_vbm", "efermi"], "condition_column": {"scf_vbm": ">"}, "answer_column": {"efermi": "min"}, "condition": {"scf_vbm": ">2.665"}, "tool": "calculate_data", "answer": 7.27774779, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than {}."}
{"question": "How many unique surfaces are recorded for the element Zn?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='Zn'"}, "tool": "calculate_data", "answer": 15, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "Determine the highest overpotential in acidic conditions for articles published in CHEMCATCHEM journal.", "refer_dataset": "table13", "column names": ["Journal_Name", "Acid_OVP"], "condition_column": {"Journal_Name": "="}, "answer_column": {"Acid_OVP": "max"}, "condition": {"Journal_Name": "=='CHEMCATCHEM'"}, "tool": "calculate_data", "answer": 260.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the highest overpotential in acidic conditions for articles published in {} journal."}
{"question": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx 12.", "refer_dataset": "table63", "column names": ["Space_group_rlx", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "="}, "answer_column": {"Band_gap_GGA": "max"}, "condition": {"Space_group_rlx": "=='12'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx {}."}
{"question": "Calculate the average chem_pot for symbol Ni when ef is greater than 1.39051?", "refer_dataset": "table68", "column names": ["symbol", "ef", "chem_pot"], "condition_column": {"symbol": "=", "ef": ">"}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Ni'", "ef": ">1.39051"}, "tool": "calculate_data", "answer": -1.3801824000000003, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {} when ef is greater than {}?"}
{"question": "What is the maximum chem_pot where wycoff position is c and bulk_energy is above -215.68428?", "refer_dataset": "table68", "column names": ["wycoff", "bulk_energy", "chem_pot"], "condition_column": {"wycoff": "=", "bulk_energy": ">"}, "answer_column": {"chem_pot": "max"}, "condition": {"wycoff": "=='c'", "bulk_energy": ">-215.68428"}, "tool": "calculate_data", "answer": 2.31789515, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum chem_pot where wycoff position is {} and bulk_energy is above {}?"}
{"question": "Find the median ProdRate(μmol/g) when B1 is nan, CatW(g/L) equals 1.0, and Surface Area(m2/g) exceeds 9.5.", "refer_dataset": "table4", "column names": ["B1", "CatW(g/L)", "Surface Area(m2/g)", "ProdRate(μmol/g)"], "condition_column": {"B1": "=", "CatW(g/L)": "=", "Surface Area(m2/g)": ">"}, "answer_column": {"ProdRate(μmol/g)": "median"}, "condition": {"B1": "=='nan'", "CatW(g/L)": "=='1.0'", "Surface Area(m2/g)": ">9.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median ProdRate(μmol/g) when B1 is {}, CatW(g/L) equals {}, and Surface Area(m2/g) exceeds {}."}
{"question": "Retrieve the ID with the highest Tc for materials where formula contains Ba0.79K0.21Fe2As2 and Tc exceeds 18.0.", "refer_dataset": "table65", "column names": ["id", "formula", "Tc"], "condition_column": {"formula": "=", "Tc": ">"}, "answer_column": {"id": "max"}, "condition": {"formula": "=='Ba0.79K0.21Fe2As2'", "Tc": ">18.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Retrieve the ID with the highest Tc for materials where formula contains {} and Tc exceeds {}."}
{"question": "What is the average net magnetic moment for materials referenced under DOI https://doi.org/10.1039/c1cc13994k?", "refer_dataset": "table62", "column names": ["doi", "net_magmom"], "condition_column": {"doi": "="}, "answer_column": {"net_magmom": "avg"}, "condition": {"doi": "=='https://doi.org/10.1039/c1cc13994k'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average net magnetic moment for materials referenced under DOI {}?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than 0.97, Element B's Electronegativity (χpb) is less than 1.55, and the Tolerance Factor (t) is 0.879?", "refer_dataset": "table2", "column names": ["χpa", "χpb", "t", "Eg(eV)"], "condition_column": {"χpa": ">", "χpb": "<", "t": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"χpa": ">0.97", "χpb": "<1.55", "t": "=='0.879'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than {}, Element B's Electronegativity (χpb) is less than {}, and the Tolerance Factor (t) is {}?"}
{"question": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > 86.0% in under 40.0 minutes of illumination for pH = 7.0?", "refer_dataset": "table8", "column names": ["Catalyst/Pollutant mass ratio", "Degradation rate(%)", "Illumination time(min)", "pH"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "pH": "="}, "answer_column": {"Catalyst/Pollutant mass ratio": ""}, "condition": {"Degradation rate(%)": ">86.0", "Illumination time(min)": "<40.0", "pH": "=='7.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > {}% in under {} minutes of illumination for pH = {}?"}
{"question": "What is the average Cation1-mol for Cation1 82?", "refer_dataset": "table20", "column names": ["Cation1", "Cation1-mol"], "condition_column": {"Cation1": "="}, "answer_column": {"Cation1-mol": "avg"}, "condition": {"Cation1": "=='82'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Cation1-mol for Cation1 {}?"}
{"question": "What is the average C2 yield (%) for catalysts where the primary metal component (M1) is Sr?", "refer_dataset": "table21", "column names": ["M1", "C2 yield (%)"], "condition_column": {"M1": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='Sr'"}, "tool": "calculate_data", "answer": 12.842351371507691, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average C2 yield (%) for catalysts where the primary metal component (M1) is {}?"}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 0.53198504%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">0.53198504"}, "tool": "calculate_data", "answer": 48.26126007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals 4.92?", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_delta_e"], "condition_column": {"_oqmd_band_gap": "="}, "answer_column": {"_oqmd_delta_e": "max"}, "condition": {"_oqmd_band_gap": "=='4.92'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum _oqmd_delta_e observed when _oqmd_band_gap equals {}?"}
{"question": "Determine the total CO yield (COy) when Support_ID is 12 and M1_atom_number is less than 25.", "refer_dataset": "table17", "column names": ["Support_ID", "M1_atom_number", "COy"], "condition_column": {"Support_ID": "=", "M1_atom_number": "<"}, "answer_column": {"COy": "sum"}, "condition": {"Support_ID": "=='12'", "M1_atom_number": "<25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total CO yield (COy) when Support_ID is {} and M1_atom_number is less than {}."}
{"question": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is 50.0, pH > 10.2, and Catalyst dosage (g/L) is 0.15.", "refer_dataset": "table6", "column names": ["Antibiotic dosage (mg/L)", "pH", "Catalyst dosage (g/L)", "Illumination time (min)"], "condition_column": {"Antibiotic dosage (mg/L)": "=", "pH": ">", "Catalyst dosage (g/L)": "="}, "answer_column": {"Illumination time (min)": "avg"}, "condition": {"Antibiotic dosage (mg/L)": "=='50.0'", "pH": ">10.2", "Catalyst dosage (g/L)": "=='0.15'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is {}, pH > {}, and Catalyst dosage (g/L) is {}."}
{"question": "What is the minimum pH recorded for Degradation Rate > 90.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">90.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than 7.68 eV.", "refer_dataset": "table3", "column names": ["EAa", "Ra"], "condition_column": {"EAa": ">"}, "answer_column": {"Ra": "max"}, "condition": {"EAa": ">7.68"}, "tool": "calculate_data", "answer": 139.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than {} eV."}
{"question": "Determine the average LUMO energy for materials with polarizability (alpha) less than 24.450000762939453?", "refer_dataset": "table60", "column names": ["alpha", "lumo"], "condition_column": {"alpha": "<"}, "answer_column": {"lumo": "avg"}, "condition": {"alpha": "<24.450000762939453"}, "tool": "calculate_data", "answer": 1.9992947307499973, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average LUMO energy for materials with polarizability (alpha) less than {}?"}
{"question": "What is the average Light Wavelength used for Calcination Temperatures above 450°C when Pollutant is MB?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Calcination temperature(°C)", "Pollutant"], "condition_column": {"Calcination temperature(°C)": ">", "Pollutant": "="}, "answer_column": {"Light wavelength(nm)": "avg"}, "condition": {"Calcination temperature(°C)": ">450", "Pollutant": "=='MB'"}, "tool": "calculate_data", "answer": 462.31182795698925, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Light Wavelength used for Calcination Temperatures above {}°C when Pollutant is {}?"}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant Phenol under Experimental Temperature 25°C and Light Wavelength 510 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='Phenol'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='510'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 4.64464987317396?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='4.64464987317396'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 10.694074630737305?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='10.694074630737305'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds 10.694074630737305?", "refer_dataset": "table60", "column names": ["gap", "Cv"], "condition_column": {"gap": ">"}, "answer_column": {"Cv": "min"}, "condition": {"gap": ">10.694074630737305"}, "tool": "calculate_data", "answer": 29.42300033569336, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds {}?"}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 74.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">74.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.5, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "Calculate the maximum ethylene selectivity (C2H4s) when Support is TiO2.", "refer_dataset": "table17", "column names": ["Support", "C2H4s"], "condition_column": {"Support": "="}, "answer_column": {"C2H4s": "max"}, "condition": {"Support": "=='TiO2'"}, "tool": "calculate_data", "answer": 58.62, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum ethylene selectivity (C2H4s) when Support is {}."}
{"question": "What is the minimum elastic anisotropy for materials with energy above convex hull (e_hull) greater than 0.0584942214285715?", "refer_dataset": "table54", "column names": ["e_hull", "elastic anisotropy"], "condition_column": {"e_hull": ">"}, "answer_column": {"elastic anisotropy": "min"}, "condition": {"e_hull": ">0.0584942214285715"}, "tool": "calculate_data", "answer": 245.48480229609223, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum elastic anisotropy for materials with energy above convex hull (e_hull) greater than {}?"}
{"question": "What is the highest Yield (μmol/g/h) for Bi type Bi2S3/g-C3N4, Reaction medium gas-solid, and light source UV–VIS?", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Reaction medium", "light source", "Yield (μmol/g/h)"], "condition_column": {"Bi type in photocatalyst": "=", "Reaction medium": "=", "light source": "="}, "answer_column": {"Yield (μmol/g/h)": "max"}, "condition": {"Bi type in photocatalyst": "=='Bi2S3/g-C3N4'", "Reaction medium": "=='gas-solid'", "light source": "=='UV–VIS'"}, "tool": "calculate_data", "answer": 6.8425, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Yield (μmol/g/h) for Bi type {}, Reaction medium {}, and light source {}?"}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below -72.77434621?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<-72.77434621"}, "tool": "calculate_data", "answer": 26.95001607174691, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "What is the average reaction energy for elements with atomic number greater than 78?", "refer_dataset": "table18", "column names": ["A_AtimicN", "reaction_energy"], "condition_column": {"A_AtimicN": ">"}, "answer_column": {"reaction_energy": "avg"}, "condition": {"A_AtimicN": ">78"}, "tool": "calculate_data", "answer": 2.030713181818182, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction energy for elements with atomic number greater than {}?"}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -5.24487022846595.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-5.24487022846595"}, "tool": "calculate_data", "answer": -3.313830957367591, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "Calculate the minimum Alcohol% for composites with A1 substitution nan, X1 equal to nan, and Surface Area(m2/g) above 1.42.", "refer_dataset": "table4", "column names": ["A1", "X1", "Surface Area(m2/g)", "Alcohol%"], "condition_column": {"A1": "=", "X1": "=", "Surface Area(m2/g)": ">"}, "answer_column": {"Alcohol%": "min"}, "condition": {"A1": "=='nan'", "X1": "=='nan'", "Surface Area(m2/g)": ">1.42"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum Alcohol% for composites with A1 substitution {}, X1 equal to {}, and Surface Area(m2/g) above {}."}
{"question": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above -3.16052641.", "refer_dataset": "table66", "column names": ["efermi", "final_energy"], "condition_column": {"efermi": ">"}, "answer_column": {"final_energy": "min"}, "condition": {"efermi": ">-3.16052641"}, "tool": "calculate_data", "answer": 485.35742061, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above {}."}
{"question": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is 50.0, pH > 8.0, and Catalyst dosage (g/L) is 0.3.", "refer_dataset": "table6", "column names": ["Antibiotic dosage (mg/L)", "pH", "Catalyst dosage (g/L)", "Illumination time (min)"], "condition_column": {"Antibiotic dosage (mg/L)": "=", "pH": ">", "Catalyst dosage (g/L)": "="}, "answer_column": {"Illumination time (min)": "avg"}, "condition": {"Antibiotic dosage (mg/L)": "=='50.0'", "pH": ">8.0", "Catalyst dosage (g/L)": "=='0.3'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is {}, pH > {}, and Catalyst dosage (g/L) is {}."}
{"question": "What is the average bandgap for materials with a topology classification of bnn?", "refer_dataset": "table62", "column names": ["topology", "bandgap"], "condition_column": {"topology": "="}, "answer_column": {"bandgap": "avg"}, "condition": {"topology": "=='bnn'"}, "tool": "calculate_data", "answer": 2.5055796666666663, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bandgap for materials with a topology classification of {}?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than 0.89, Element B's Electronegativity (χpb) is less than 1.56, and the Tolerance Factor (t) is 0.939?", "refer_dataset": "table2", "column names": ["χpa", "χpb", "t", "Eg(eV)"], "condition_column": {"χpa": ">", "χpb": "<", "t": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"χpa": ">0.89", "χpb": "<1.56", "t": "=='0.939'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than {}, Element B's Electronegativity (χpb) is less than {}, and the Tolerance Factor (t) is {}?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than -1.73819887423718?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">-1.73819887423718"}, "tool": "calculate_data", "answer": -0.06082781412803505, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "What is the average calcination temperature for experiments using a photocatalyst dose of 0.05 g/L?", "refer_dataset": "table1", "column names": ["Photocatalyst dose(g L-1)", "Calcination temperature(K)"], "condition_column": {"Photocatalyst dose(g L-1)": "="}, "answer_column": {"Calcination temperature(K)": "avg"}, "condition": {"Photocatalyst dose(g L-1)": "=='0.05'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature for experiments using a photocatalyst dose of {} g/L?"}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 80 minutes, pH > 7.0, and Dopant C?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<80", "pH": ">7.0", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": 100.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "What is the highest methane conversion rate when Cation1 is Ba, Cation2Amount > 70%, and Support is SiO2?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='Ba'", "Cation2Amount": ">70", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": 900, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below 5.193113419746809?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<5.193113419746809"}, "tool": "calculate_data", "answer": 20.232, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "Calculate the total number of Preparations with Cation2-mol above 94.5%.", "refer_dataset": "table20", "column names": ["Cation2-mol", "Preparation"], "condition_column": {"Cation2-mol": ">"}, "answer_column": {"Preparation": "count"}, "condition": {"Cation2-mol": ">94.5"}, "tool": "calculate_data", "answer": 152, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total number of Preparations with Cation2-mol above {}%."}
{"question": "What is the highest Lattice Parameter observed when A_AtomN is 8.0, B_AtomN > 55.0, and Volume < 76.2355842565?", "refer_dataset": "table22", "column names": ["A_AtomN", "B_AtomN", "Volume", "Lattice"], "condition_column": {"A_AtomN": "=", "B_AtomN": ">", "Volume": "<"}, "answer_column": {"Lattice": "max"}, "condition": {"A_AtomN": "=='8.0'", "B_AtomN": ">55.0", "Volume": "<76.2355842565"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Lattice Parameter observed when A_AtomN is {}, B_AtomN > {}, and Volume < {}?"}
{"question": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is 45?", "refer_dataset": "table6", "column names": ["Illumination time (min)", "Antibiotic dosage (mg/L)"], "condition_column": {"Illumination time (min)": "="}, "answer_column": {"Antibiotic dosage (mg/L)": "min"}, "condition": {"Illumination time (min)": "=='45'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is {}?"}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 3.797527527%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">3.797527527"}, "tool": "calculate_data", "answer": 48.26126007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "What is the minimum journal impact factor for studies using the Nanjing Normal Univ method?", "refer_dataset": "table13", "column names": ["Facility", "IF"], "condition_column": {"Facility": "="}, "answer_column": {"IF": "min"}, "condition": {"Facility": "=='Nanjing Normal Univ'"}, "tool": "calculate_data", "answer": 32.086, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum journal impact factor for studies using the {} method?"}
{"question": "Find the maximum Degradation efficiency (%) recorded for Material PI-UiO-66-NH2.", "refer_dataset": "table6", "column names": ["Material", "Degradation efficiency (%)"], "condition_column": {"Material": "="}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"Material": "=='PI-UiO-66-NH2'"}, "tool": "calculate_data", "answer": 88.3, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Degradation efficiency (%) recorded for Material {}."}
{"question": "What is the minimum pH recorded for Degradation Rate > 88.0% under Experimental Temperature 25.0°C?", "refer_dataset": "table8", "column names": ["pH", "Degradation rate(%)", "Experimental temperature(°C)"], "condition_column": {"Degradation rate(%)": ">", "Experimental temperature(°C)": "="}, "answer_column": {"pH": "min"}, "condition": {"Degradation rate(%)": ">88.0", "Experimental temperature(°C)": "=='25.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pH recorded for Degradation Rate > {}% under Experimental Temperature {}°C?"}
{"question": "What is the maximum chem_pot where wycoff position is a and bulk_energy is above 73.16672?", "refer_dataset": "table68", "column names": ["wycoff", "bulk_energy", "chem_pot"], "condition_column": {"wycoff": "=", "bulk_energy": ">"}, "answer_column": {"chem_pot": "max"}, "condition": {"wycoff": "=='a'", "bulk_energy": ">73.16672"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum chem_pot where wycoff position is {} and bulk_energy is above {}?"}
{"question": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds 12.0 hours.", "refer_dataset": "table10", "column names": ["irradiation time(h)", "CB edge(V)"], "condition_column": {"irradiation time(h)": ">"}, "answer_column": {"CB edge(V)": "min"}, "condition": {"irradiation time(h)": ">12.0"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum Conduction Band (CB) edge when irradiation time exceeds {} hours."}
{"question": "What is the average Surface Energy (surf_en) for materials with the chemical formula 'CdSe'?", "refer_dataset": "table66", "column names": ["formula", "surf_en"], "condition_column": {"formula": "="}, "answer_column": {"surf_en": "avg"}, "condition": {"formula": "=='CdSe'"}, "tool": "calculate_data", "answer": 0.6399370751761874, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Energy (surf_en) for materials with the chemical formula '{}'?"}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 2.991 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<2.991"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "What is the total formula_energy for materials where ID contains the substring 222?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "sum"}, "condition": {"id": "=='222'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total formula_energy for materials where ID contains the substring {}?"}
{"question": "Determine the total Yield (μmol/g/h) for photocatalysts containing a Bi type of Bi2S3/UiO− 66.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Yield (μmol/g/h)"], "condition_column": {"Bi type in photocatalyst": "="}, "answer_column": {"Yield (μmol/g/h)": "count"}, "condition": {"Bi type in photocatalyst": "=='Bi2S3/UiO− 66'"}, "tool": "calculate_data", "answer": 4, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total Yield (μmol/g/h) for photocatalysts containing a Bi type of {}."}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 2.0828 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<2.0828"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "What is the maximum C.E. % observed for pH level 10.2?", "refer_dataset": "table12", "column names": ["pH", "C.E. %"], "condition_column": {"pH": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"pH": "=='10.2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum C.E. % observed for pH level {}?"}
{"question": "For materials in space group symbol Amm2, what is the minimum stress tensor value observed?", "refer_dataset": "table59", "column names": ["spacegroup_symbol", "stress"], "condition_column": {"spacegroup_symbol": "="}, "answer_column": {"stress": "min"}, "condition": {"spacegroup_symbol": "=='Amm2'"}, "tool": "calculate_data", "answer": "[[5.549941559762637e-05, 0.0, 0.0], [0.0, 6.655983401498065e-05, -5.087338562454191e-16], [0.0, -5.087338562454191e-16, 5.286257565041751e-05]]", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials in space group symbol {}, what is the minimum stress tensor value observed?"}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 1.88 eV, light source UV–VIS, and Reaction medium gas-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<1.88", "light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'"}, "tool": "calculate_data", "answer": 2.225, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "What is the maximum C.E. % observed for pH level 5.9?", "refer_dataset": "table12", "column names": ["pH", "C.E. %"], "condition_column": {"pH": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"pH": "=='5.9'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum C.E. % observed for pH level {}?"}
{"question": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > 15.0, pH < 4.1, and Antibiotic dosage (mg/L) = 50.0.", "refer_dataset": "table6", "column names": ["Illumination time (min)", "pH", "Antibiotic dosage (mg/L)", "Pore Volume (cm3/g)"], "condition_column": {"Illumination time (min)": ">", "pH": "<", "Antibiotic dosage (mg/L)": "="}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Illumination time (min)": ">15.0", "pH": "<4.1", "Antibiotic dosage (mg/L)": "=='50.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > {}, pH < {}, and Antibiotic dosage (mg/L) = {}."}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -2.39407464504146 and the HOMO-LUMO gap (gap) is less than 2.31935459822143?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-2.39407464504146", "gap": "<2.31935459822143"}, "tool": "calculate_data", "answer": 2.05689453649337, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below 1.0918?", "refer_dataset": "table56", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"gap pbe": "<"}, "answer_column": {"elastic anisotropy": "max"}, "condition": {"gap pbe": "<1.0918"}, "tool": "calculate_data", "answer": 401.4952807290347, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below {}?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than 1.863?", "refer_dataset": "table2", "column names": ["Ra/Rb", "Eg(eV)"], "condition_column": {"Ra/Rb": ">"}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Ra/Rb": ">1.863"}, "tool": "calculate_data", "answer": 3.0950980392156855, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than {}?"}
{"question": "Materials with bandgap of 0.1622, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='0.1622'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 67.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">67.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.7, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > 0.6325270000000001, synthesized as True, and sourced from CSD?", "refer_dataset": "table62", "column names": ["bandgap", "synthesized", "source", "pld"], "condition_column": {"bandgap": ">", "synthesized": "=", "source": "="}, "answer_column": {"pld": "min"}, "condition": {"bandgap": ">0.6325270000000001", "synthesized": "=='True'", "source": "=='CSD'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > {}, synthesized as {}, and sourced from {}?"}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) COC?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='COC'"}, "tool": "calculate_data", "answer": -3.57363860725201, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > 78.0% in under 20.0 minutes of illumination for pH = 7.0?", "refer_dataset": "table8", "column names": ["Catalyst/Pollutant mass ratio", "Degradation rate(%)", "Illumination time(min)", "pH"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "pH": "="}, "answer_column": {"Catalyst/Pollutant mass ratio": ""}, "condition": {"Degradation rate(%)": ">78.0", "Illumination time(min)": "<20.0", "pH": "=='7.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > {}% in under {} minutes of illumination for pH = {}?"}
{"question": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than 0.346445287061782.", "refer_dataset": "table57", "column names": ["_oqmd_delta_e", "_oqmd_stability"], "condition_column": {"_oqmd_delta_e": ">"}, "answer_column": {"_oqmd_stability": "min"}, "condition": {"_oqmd_delta_e": ">0.346445287061782"}, "tool": "calculate_data", "answer": 4.152984231249998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than {}."}
{"question": "What is the average number of atoms per structure in materials with a crystal system of hexagonal and space group symbol P6_3/mmc?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='hexagonal'", "spacegroup_symbol": "=='P6_3/mmc'"}, "tool": "calculate_data", "answer": 3.4936708860759493, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "How many synthesized compounds have a net magnetic moment above 3.88?", "refer_dataset": "table62", "column names": ["synthesized", "net_magmom"], "condition_column": {"net_magmom": ">"}, "answer_column": {"synthesized": "count"}, "condition": {"net_magmom": ">3.88"}, "tool": "calculate_data", "answer": 473, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many synthesized compounds have a net magnetic moment above {}?"}
{"question": "List organic compounds (OC) with light intensity (I) greater than 0.855 mW/cm².", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2"], "condition_column": {"I, mW/cm2": ">"}, "answer_column": {"OC": ""}, "condition": {"I, mW/cm2": ">0.855"}, "tool": "calculate_data", "answer": [{"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Acetaminophen"}, {"OC": "beta-blocker atenolol"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfisoxazole"}, {"OC": "Sulfathiazole"}, {"OC": "Sulfamethizole"}, {"OC": "4-Chlorophenol"}, {"OC": "4-Chlorophenol"}, {"OC": "4-Chlorophenol"}, {"OC": "4-Chlorophenol"}, {"OC": "4-Chlorophenol"}, {"OC": "4-Chlorophenol"}, {"OC": "4-Chlorophenol"}, {"OC": "2,6-Dichlorophenol"}, {"OC": "2,6-Dichlorophenol"}, {"OC": "2,6-Dichlorophenol"}, {"OC": "2,6-Dichlorophenol"}, {"OC": "2,6-Dichlorophenol"}, {"OC": "Sulfanilamide"}, {"OC": "Sulfacetamide natrium salt"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfadiazine natrium salt"}, {"OC": "Sulfathiazole natrium salt"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iopromide"}, {"OC": "Atrazine"}, {"OC": "Cyanazine"}, {"OC": "Irgarol"}, {"OC": "Prometryne"}, {"OC": "Propazine"}, {"OC": "Dichlofenthion"}, {"OC": "Bromophos ethyl"}, {"OC": "Bromophos methyl"}, {"OC": "Parathion ethyl"}, {"OC": "Parathion methyl"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "Phorate"}, {"OC": "Phorate"}, {"OC": "Phorate"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List organic compounds (OC) with light intensity (I) greater than {} mW/cm²."}
{"question": "Find the average Degradation efficiency (%) for Material MIL-101 when Catalyst dosage (g/L) > 0.05, Illumination time (min) > 5, and pH < 4.1.", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Illumination time (min)", "pH", "Degradation efficiency (%)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Illumination time (min)": ">", "pH": "<"}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.05", "Illumination time (min)": ">5", "pH": "<4.1"}, "tool": "calculate_data", "answer": 20.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Degradation efficiency (%) for Material {} when Catalyst dosage (g/L) > {}, Illumination time (min) > {}, and pH < {}."}
{"question": "Determine the minimum CT needed for molecular formulas containing LaCo0.90Mg0.10O3 when aged longer than 4 hours.", "refer_dataset": "table11", "column names": ["Molecular formulas", "AH (h)", "CT (℃)"], "condition_column": {"Molecular formulas": "=", "AH (h)": ">"}, "answer_column": {"CT (℃)": "min"}, "condition": {"Molecular formulas": "=='LaCo0.90Mg0.10O3'", "AH (h)": ">4"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum CT needed for molecular formulas containing {} when aged longer than {} hours."}
{"question": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds -6.91985559463501, internal energy at 0K (U0) is below -23.53123664855957, and Gibbs free energy (G) equals -22.124679565429688?", "refer_dataset": "table60", "column names": ["homo", "U0", "G", "Cv"], "condition_column": {"homo": ">", "U0": "<", "G": "="}, "answer_column": {"Cv": "min"}, "condition": {"homo": ">-6.91985559463501", "U0": "<-23.53123664855957", "G": "=='-22.124679565429688'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds {}, internal energy at 0K (U0) is below {}, and Gibbs free energy (G) equals {}?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than 1.0, Element B's Electronegativity (χpb) is less than 1.54, and the Tolerance Factor (t) is 0.82?", "refer_dataset": "table2", "column names": ["χpa", "χpb", "t", "Eg(eV)"], "condition_column": {"χpa": ">", "χpb": "<", "t": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"χpa": ">1.0", "χpb": "<1.54", "t": "=='0.82'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than {}, Element B's Electronegativity (χpb) is less than {}, and the Tolerance Factor (t) is {}?"}
{"question": "What is the average energy per atom for compounds in the formula MgF2 with an indirect gap below 6.508?", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "energy_per_atom"], "condition_column": {"formula": "=", "indir_gap": "<"}, "answer_column": {"energy_per_atom": "avg"}, "condition": {"formula": "=='MgF2'", "indir_gap": "<6.508"}, "tool": "calculate_data", "answer": -1007.6804437500003, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average energy per atom for compounds in the formula {} with an indirect gap below {}?"}
{"question": "How many Preparations have Contact-times shorter than 0.24 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<0.24"}, "tool": "calculate_data", "answer": 681, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "What is the maximum Onset potential for alloys where Platinum > 23.2%, Ruthenium < 58.9%, and Palladium > 4.8%?", "refer_dataset": "table15", "column names": ["Pt", "Ru", "Pd", "Onset"], "condition_column": {"Pt": ">", "Ru": "<", "Pd": ">"}, "answer_column": {"Onset": "max"}, "condition": {"Pt": ">23.2", "Ru": "<58.9", "Pd": ">4.8"}, "tool": "calculate_data", "answer": 0.600639, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Onset potential for alloys where Platinum > {}%, Ruthenium < {}%, and Palladium > {}%?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Direct\", Band_gap_HSE_optical < 1.838293, and Magnetic_ordering \"NM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Direct'", "Band_gap_HSE_optical": "<1.838293", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.684651}, {"Band_gap_GGA": 0.041666}, {"Band_gap_GGA": 0.2437109999999998}, {"Band_gap_GGA": 0.227571}, {"Band_gap_GGA": 0.287844}, {"Band_gap_GGA": 0.421518}, {"Band_gap_GGA": 0.059662}, {"Band_gap_GGA": 0.284829}, {"Band_gap_GGA": 0.473079}, {"Band_gap_GGA": 0.178726}, {"Band_gap_GGA": 0.1042529999999999}, {"Band_gap_GGA": 0.7822870000000002}, {"Band_gap_GGA": 0.6606369999999995}, {"Band_gap_GGA": 0.480542}, {"Band_gap_GGA": 0.508781}, {"Band_gap_GGA": 0.73837}, {"Band_gap_GGA": 0.371746}, {"Band_gap_GGA": 0.207128}, {"Band_gap_GGA": 0.436412}, {"Band_gap_GGA": 0.796822}, {"Band_gap_GGA": 0.240682}, {"Band_gap_GGA": 0.302014}, {"Band_gap_GGA": 1.197415}, {"Band_gap_GGA": 0.03858}, {"Band_gap_GGA": 0.152983}, {"Band_gap_GGA": 0.710765}, {"Band_gap_GGA": 0.106556}, {"Band_gap_GGA": 0.138406}, {"Band_gap_GGA": 0.010467}, {"Band_gap_GGA": 0.7083599999999999}, {"Band_gap_GGA": 0.9607050000000004}, {"Band_gap_GGA": 0.902245}, {"Band_gap_GGA": 0.464569}, {"Band_gap_GGA": 0.458572}, {"Band_gap_GGA": 0.2903539999999998}, {"Band_gap_GGA": 0.648889}, {"Band_gap_GGA": 0.379631}, {"Band_gap_GGA": 0.288977}, {"Band_gap_GGA": 0.533118}, {"Band_gap_GGA": 1.064508}, {"Band_gap_GGA": 1.1433990000000005}, {"Band_gap_GGA": 0.135669}, {"Band_gap_GGA": 0.242306}, {"Band_gap_GGA": 1.062955}, {"Band_gap_GGA": 0.924117}, {"Band_gap_GGA": 0.699347}, {"Band_gap_GGA": 0.962178}, {"Band_gap_GGA": 0.455467}, {"Band_gap_GGA": 0.5743109999999998}, {"Band_gap_GGA": 1.0781509999999996}, {"Band_gap_GGA": 0.678164}, {"Band_gap_GGA": 0.8268}, {"Band_gap_GGA": 0.240142}, {"Band_gap_GGA": 0.914581}, {"Band_gap_GGA": 0.183234}, {"Band_gap_GGA": 0.1812}, {"Band_gap_GGA": 0.124343}, {"Band_gap_GGA": 0.943776}, {"Band_gap_GGA": 0.723736}, {"Band_gap_GGA": 0.525212}, {"Band_gap_GGA": 0.664029}, {"Band_gap_GGA": 0.717893}, {"Band_gap_GGA": 0.1012110000000001}, {"Band_gap_GGA": 1.02982}, {"Band_gap_GGA": 1.015464}, {"Band_gap_GGA": 1.065708}, {"Band_gap_GGA": 0.841825}, {"Band_gap_GGA": 0.7109800000000002}, {"Band_gap_GGA": 0.11566}, {"Band_gap_GGA": 0.163075}, {"Band_gap_GGA": 0.095012}, {"Band_gap_GGA": 0.576212}, {"Band_gap_GGA": 0.0501729999999991}, {"Band_gap_GGA": 0.680086}, {"Band_gap_GGA": 0.1281699999999999}, {"Band_gap_GGA": 0.3171189999999999}, {"Band_gap_GGA": 0.3831039999999999}, {"Band_gap_GGA": 0.456402}, {"Band_gap_GGA": 0.617981}, {"Band_gap_GGA": 0.203862}, {"Band_gap_GGA": 0.670807}, {"Band_gap_GGA": 0.8609260000000001}, {"Band_gap_GGA": 0.471341}, {"Band_gap_GGA": 0.343373}, {"Band_gap_GGA": 0.525407}, {"Band_gap_GGA": 0.1007060000000001}, {"Band_gap_GGA": 0.808349}, {"Band_gap_GGA": 0.735533}, {"Band_gap_GGA": 0.1350280000000001}, {"Band_gap_GGA": 0.525745}, {"Band_gap_GGA": 0.335461}, {"Band_gap_GGA": 0.202096}, {"Band_gap_GGA": 0.604702}, {"Band_gap_GGA": 0.485755}, {"Band_gap_GGA": 1.21075}, {"Band_gap_GGA": 1.112092}, {"Band_gap_GGA": 0.0156169999999997}, {"Band_gap_GGA": 0.296561}, {"Band_gap_GGA": 0.131433}, {"Band_gap_GGA": 0.53058}, {"Band_gap_GGA": 0.367797}, {"Band_gap_GGA": 0.175978}, {"Band_gap_GGA": 0.067083}, {"Band_gap_GGA": 0.50262}, {"Band_gap_GGA": 0.516517}, {"Band_gap_GGA": 0.274882}, {"Band_gap_GGA": 0.412032}, {"Band_gap_GGA": 0.162911}, {"Band_gap_GGA": 0.8009390000000001}, {"Band_gap_GGA": 0.1764369999999999}, {"Band_gap_GGA": 0.792818}, {"Band_gap_GGA": 0.522287}, {"Band_gap_GGA": 0.441558}, {"Band_gap_GGA": 0.832407}, {"Band_gap_GGA": 1.095194}, {"Band_gap_GGA": 1.037218}, {"Band_gap_GGA": 1.078919}, {"Band_gap_GGA": 1.007073}, {"Band_gap_GGA": 1.038516}, {"Band_gap_GGA": 0.927868}, {"Band_gap_GGA": 1.043368}, {"Band_gap_GGA": 0.8569}, {"Band_gap_GGA": 1.194038}, {"Band_gap_GGA": 1.073826}, {"Band_gap_GGA": 0.1617000000000001}, {"Band_gap_GGA": 0.2272}, {"Band_gap_GGA": 0.2496929999999997}, {"Band_gap_GGA": 0.276941}, {"Band_gap_GGA": 0.673759}, {"Band_gap_GGA": 1.110984}, {"Band_gap_GGA": 1.151854}, {"Band_gap_GGA": 0.933413}, {"Band_gap_GGA": 0.055628}, {"Band_gap_GGA": 0.7006599999999992}, {"Band_gap_GGA": 0.850873}, {"Band_gap_GGA": 0.5459970000000007}, {"Band_gap_GGA": 0.8194119999999998}, {"Band_gap_GGA": 0.8477640000000006}, {"Band_gap_GGA": 0.096644}, {"Band_gap_GGA": 0.3041240000000007}, {"Band_gap_GGA": 0.678898}, {"Band_gap_GGA": 0.7683299999999997}, {"Band_gap_GGA": 0.296747}, {"Band_gap_GGA": 0.856754}, {"Band_gap_GGA": 0.3624319999999996}, {"Band_gap_GGA": 0.4508980000000004}, {"Band_gap_GGA": 0.176768}, {"Band_gap_GGA": 0.426338}, {"Band_gap_GGA": 0.076361}, {"Band_gap_GGA": 0.684893}, {"Band_gap_GGA": 0.0880399999999999}, {"Band_gap_GGA": 0.052264}, {"Band_gap_GGA": 0.6760039999999998}, {"Band_gap_GGA": 0.2383199999999998}, {"Band_gap_GGA": 1.1011969999999995}, {"Band_gap_GGA": 0.6758519999999999}, {"Band_gap_GGA": 0.481597}, {"Band_gap_GGA": 0.3921559999999999}, {"Band_gap_GGA": 0.5060239999999996}, {"Band_gap_GGA": 1.0181210000000005}, {"Band_gap_GGA": 0.574063}, {"Band_gap_GGA": 0.531585}, {"Band_gap_GGA": 0.213682}, {"Band_gap_GGA": 0.143524}, {"Band_gap_GGA": 0.885293}, {"Band_gap_GGA": 0.770421}, {"Band_gap_GGA": 0.984483}, {"Band_gap_GGA": 0.086018}, {"Band_gap_GGA": 0.3410599999999997}, {"Band_gap_GGA": 0.950668}, {"Band_gap_GGA": 0.874589}, {"Band_gap_GGA": 0.924818}, {"Band_gap_GGA": 0.848794}, {"Band_gap_GGA": 0.865236}, {"Band_gap_GGA": 0.86826}, {"Band_gap_GGA": 0.026395}, {"Band_gap_GGA": 0.177484}, {"Band_gap_GGA": 0.596343}, {"Band_gap_GGA": 0.903043}, {"Band_gap_GGA": 0.763741}, {"Band_gap_GGA": 1.114779}, {"Band_gap_GGA": 0.9474099999999996}, {"Band_gap_GGA": 1.1733320000000005}, {"Band_gap_GGA": 0.687912}, {"Band_gap_GGA": 0.622552}, {"Band_gap_GGA": 0.191293}, {"Band_gap_GGA": 0.089123}, {"Band_gap_GGA": 0.08064}, {"Band_gap_GGA": 0.853173}, {"Band_gap_GGA": 0.139055}, {"Band_gap_GGA": 0.688163}, {"Band_gap_GGA": 0.701328}, {"Band_gap_GGA": 0.887956}, {"Band_gap_GGA": 0.871742}, {"Band_gap_GGA": 0.514311}, {"Band_gap_GGA": 0.290651}, {"Band_gap_GGA": 0.229379}, {"Band_gap_GGA": 0.076168}, {"Band_gap_GGA": 0.053609}, {"Band_gap_GGA": 0.998991}, {"Band_gap_GGA": 0.481838}, {"Band_gap_GGA": 0.7076389999999999}, {"Band_gap_GGA": 0.566589}, {"Band_gap_GGA": 1.22023}, {"Band_gap_GGA": 0.738553}, {"Band_gap_GGA": 0.764115}, {"Band_gap_GGA": 0.598213}, {"Band_gap_GGA": 0.863919}, {"Band_gap_GGA": 0.615373}, {"Band_gap_GGA": 0.323051}, {"Band_gap_GGA": 0.209953}, {"Band_gap_GGA": 0.817623}, {"Band_gap_GGA": 0.557067}, {"Band_gap_GGA": 0.419048}, {"Band_gap_GGA": 0.066141}, {"Band_gap_GGA": 0.337935}, {"Band_gap_GGA": 0.160178}, {"Band_gap_GGA": 1.080185}, {"Band_gap_GGA": 0.229184}, {"Band_gap_GGA": 0.062749}, {"Band_gap_GGA": 0.107766}, {"Band_gap_GGA": 0.0562809999999998}, {"Band_gap_GGA": 1.036323}, {"Band_gap_GGA": 0.7615030000000003}, {"Band_gap_GGA": 0.067216}, {"Band_gap_GGA": 0.847272}, {"Band_gap_GGA": 0.694658}, {"Band_gap_GGA": 0.019902}, {"Band_gap_GGA": 0.314184}, {"Band_gap_GGA": 0.643368}, {"Band_gap_GGA": 0.486282}, {"Band_gap_GGA": 1.03743}, {"Band_gap_GGA": 0.584094}, {"Band_gap_GGA": 0.949039}, {"Band_gap_GGA": 0.724597}, {"Band_gap_GGA": 0.837015}, {"Band_gap_GGA": 0.6241520000000003}, {"Band_gap_GGA": 0.233836}, {"Band_gap_GGA": 0.466457}, {"Band_gap_GGA": 0.477402}, {"Band_gap_GGA": 0.515604}, {"Band_gap_GGA": 0.616294}, {"Band_gap_GGA": 0.873755}, {"Band_gap_GGA": 0.844649}, {"Band_gap_GGA": 0.16959}, {"Band_gap_GGA": 0.70457}, {"Band_gap_GGA": 0.064657}, {"Band_gap_GGA": 0.707323}, {"Band_gap_GGA": 0.780584}, {"Band_gap_GGA": 0.3010500000000005}, {"Band_gap_GGA": 0.593264}, {"Band_gap_GGA": 1.069505}, {"Band_gap_GGA": 0.8734719999999996}, {"Band_gap_GGA": 0.611021}, {"Band_gap_GGA": 1.004588}, {"Band_gap_GGA": 0.357758}, {"Band_gap_GGA": 0.903644}, {"Band_gap_GGA": 1.015622}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than 1.22086823512285?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<1.22086823512285"}, "tool": "calculate_data", "answer": 2.04884424920197, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "What is the minimum reaction solution volume used when the preparation method is 'Solid state reaction'?", "refer_dataset": "table1", "column names": ["Preparation method", "Reaction solution"], "condition_column": {"Preparation method": "="}, "answer_column": {"Reaction solution": "min"}, "condition": {"Preparation method": "=='Solid state reaction'"}, "tool": "calculate_data", "answer": "5/22 v/v CH3OH", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reaction solution volume used when the preparation method is '{}'?"}
{"question": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds 84.8 kJ/mol.", "refer_dataset": "table3", "column names": ["ΔfusHa", "B_Tm"], "condition_column": {"ΔfusHa": ">"}, "answer_column": {"B_Tm": "min"}, "condition": {"ΔfusHa": ">84.8"}, "tool": "calculate_data", "answer": 2952.29, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds {} kJ/mol."}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 5.1287890181418?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">5.1287890181418"}, "tool": "calculate_data", "answer": -4.66662696287739, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "Determine the highest overpotential in acidic conditions for articles published in SMALL METHODS journal.", "refer_dataset": "table13", "column names": ["Journal_Name", "Acid_OVP"], "condition_column": {"Journal_Name": "="}, "answer_column": {"Acid_OVP": "max"}, "condition": {"Journal_Name": "=='SMALL METHODS'"}, "tool": "calculate_data", "answer": 134.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the highest overpotential in acidic conditions for articles published in {} journal."}
{"question": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding 180.0°C?", "refer_dataset": "table7", "column names": ["Synhesis_Temp", "Reactor_Volume"], "condition_column": {"Synhesis_Temp": ">"}, "answer_column": {"Reactor_Volume": "min"}, "condition": {"Synhesis_Temp": ">180.0"}, "tool": "calculate_data", "answer": 80.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding {}°C?"}
{"question": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below 13.59469272407161.", "refer_dataset": "table56", "column names": ["mu_b", "shear modulus"], "condition_column": {"shear modulus": "<"}, "answer_column": {"mu_b": "avg"}, "condition": {"shear modulus": "<13.59469272407161"}, "tool": "calculate_data", "answer": 0.34722587272727284, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below {}."}
{"question": "What is the average Surface Area(m2/g) for materials with A equal to Cu, B equal to In, and Wave length(<nm) below 350.0?", "refer_dataset": "table4", "column names": ["A", "B", "Wave length(<nm)", "Surface Area(m2/g)"], "condition_column": {"A": "=", "B": "=", "Wave length(<nm)": "<"}, "answer_column": {"Surface Area(m2/g)": "avg"}, "condition": {"A": "=='Cu'", "B": "=='In'", "Wave length(<nm)": "<350.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Area(m2/g) for materials with A equal to {}, B equal to {}, and Wave length(<nm) below {}?"}
{"question": "Calculate the lowest Illumination Time required to achieve at least 70.0% Degradation Rate with Dopant/Ti mole ratio 16.0.", "refer_dataset": "table8", "column names": ["Illumination time(min)", "Degradation rate(%)", "Dopant/Ti mole ratio"], "condition_column": {"Degradation rate(%)": "<", "Dopant/Ti mole ratio": "="}, "answer_column": {"Illumination time(min)": "min"}, "condition": {"Degradation rate(%)": "<70.0", "Dopant/Ti mole ratio": "=='16.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the lowest Illumination Time required to achieve at least {}% Degradation Rate with Dopant/Ti mole ratio {}."}
{"question": "How many entries have SBET greater than 27.4 m²/g and produce CO as the Main product?", "refer_dataset": "table10", "column names": ["SBET (m2 /g)", "Main product"], "condition_column": {"SBET (m2 /g)": ">"}, "answer_column": {"Main product": "count"}, "condition": {"SBET (m2 /g)": ">27.4"}, "tool": "calculate_data", "answer": 49, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have SBET greater than {} m²/g and produce CO as the Main product?"}
{"question": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than 15.9?", "refer_dataset": "table2", "column names": ["ρb", "t"], "condition_column": {"ρb": "<"}, "answer_column": {"t": "avg"}, "condition": {"ρb": "<15.9"}, "tool": "calculate_data", "answer": 0.8669399999999995, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than {}?"}
{"question": "Find the median Band_gap_GGA where Band_gap_HSE_optical < 5.968427.", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": "<"}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Band_gap_HSE_optical": "<5.968427"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 2.037844}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.539445}, {"Band_gap_GGA": 0.84594}, {"Band_gap_GGA": 1.891728}, {"Band_gap_GGA": 1.137147}, {"Band_gap_GGA": 1.07639}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.489848}, {"Band_gap_GGA": 1.862139}, {"Band_gap_GGA": 1.623}, {"Band_gap_GGA": 1.150497}, {"Band_gap_GGA": 0.726702}, {"Band_gap_GGA": 1.119908}, {"Band_gap_GGA": 0.684651}, {"Band_gap_GGA": 1.173072}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.426179}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.915572}, {"Band_gap_GGA": 0.694418}, {"Band_gap_GGA": 1.959881}, {"Band_gap_GGA": 0.846528}, {"Band_gap_GGA": 0.759537}, {"Band_gap_GGA": 1.082826}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.29665}, {"Band_gap_GGA": 0.812729}, {"Band_gap_GGA": 1.253241}, {"Band_gap_GGA": 1.521543}, {"Band_gap_GGA": 1.604719}, {"Band_gap_GGA": 0.121138}, {"Band_gap_GGA": 1.327256}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.324094}, {"Band_gap_GGA": 0.763006}, {"Band_gap_GGA": 1.6843169999999996}, {"Band_gap_GGA": 1.298135}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.080963}, {"Band_gap_GGA": 1.812356}, {"Band_gap_GGA": 1.472881}, {"Band_gap_GGA": 1.917619}, {"Band_gap_GGA": 0.736109}, {"Band_gap_GGA": 2.514819}, {"Band_gap_GGA": 1.166888}, {"Band_gap_GGA": 1.199719}, {"Band_gap_GGA": 0.476453}, {"Band_gap_GGA": 0.049785}, {"Band_gap_GGA": 0.796627}, {"Band_gap_GGA": 0.517763}, {"Band_gap_GGA": 0.218723}, {"Band_gap_GGA": 0.451375}, {"Band_gap_GGA": 2.025862}, {"Band_gap_GGA": 2.638943}, {"Band_gap_GGA": 1.241031}, {"Band_gap_GGA": 0.041666}, {"Band_gap_GGA": 2.034844}, {"Band_gap_GGA": 1.819333}, {"Band_gap_GGA": 2.75736}, {"Band_gap_GGA": 2.646834}, {"Band_gap_GGA": 1.958661}, {"Band_gap_GGA": 2.228965}, {"Band_gap_GGA": 2.252553}, {"Band_gap_GGA": 2.372023}, {"Band_gap_GGA": 3.154054}, {"Band_gap_GGA": 1.300029}, {"Band_gap_GGA": 2.619155}, {"Band_gap_GGA": 2.616013}, {"Band_gap_GGA": 2.212373}, {"Band_gap_GGA": 2.957716}, {"Band_gap_GGA": 2.516797}, {"Band_gap_GGA": 1.3973739999999997}, {"Band_gap_GGA": 2.576314}, {"Band_gap_GGA": 1.20222}, {"Band_gap_GGA": 2.498679}, {"Band_gap_GGA": 3.357065}, {"Band_gap_GGA": 3.1444340000000004}, {"Band_gap_GGA": 0.116559}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.852829}, {"Band_gap_GGA": 1.015877}, {"Band_gap_GGA": 0.522174}, {"Band_gap_GGA": 0.616087}, {"Band_gap_GGA": 2.325548}, {"Band_gap_GGA": 2.330909}, {"Band_gap_GGA": 2.882815}, {"Band_gap_GGA": 0.882624}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 2.927575}, {"Band_gap_GGA": 0.189223}, {"Band_gap_GGA": 1.810657}, {"Band_gap_GGA": 1.632221}, {"Band_gap_GGA": 1.000199}, {"Band_gap_GGA": 0.58384}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.484641}, {"Band_gap_GGA": 1.00246}, {"Band_gap_GGA": 1.465159}, {"Band_gap_GGA": 2.609377}, {"Band_gap_GGA": 1.460508}, {"Band_gap_GGA": 1.461365}, {"Band_gap_GGA": 1.362999}, {"Band_gap_GGA": 1.2176}, {"Band_gap_GGA": 0.2031569999999999}, {"Band_gap_GGA": 0.62853}, {"Band_gap_GGA": 2.65807}, {"Band_gap_GGA": 2.218596}, {"Band_gap_GGA": 1.817097}, {"Band_gap_GGA": 1.446497}, {"Band_gap_GGA": 2.58846}, {"Band_gap_GGA": 1.58958}, {"Band_gap_GGA": 2.79909}, {"Band_gap_GGA": 1.312536}, {"Band_gap_GGA": 0.585286}, {"Band_gap_GGA": 0.937776}, {"Band_gap_GGA": 0.636041}, {"Band_gap_GGA": 0.611795}, {"Band_gap_GGA": 0.803879}, {"Band_gap_GGA": 1.403779}, {"Band_gap_GGA": 1.104735}, {"Band_gap_GGA": 0.551833}, {"Band_gap_GGA": 1.254096}, {"Band_gap_GGA": 1.0671210000000002}, {"Band_gap_GGA": 1.321603}, {"Band_gap_GGA": 1.829391}, {"Band_gap_GGA": 0.420153}, {"Band_gap_GGA": 1.512535}, {"Band_gap_GGA": 0.65297}, {"Band_gap_GGA": 0.241175}, {"Band_gap_GGA": 1.655065}, {"Band_gap_GGA": 0.251584}, {"Band_gap_GGA": 0.172653}, {"Band_gap_GGA": 0.061293}, {"Band_gap_GGA": 1.521364}, {"Band_gap_GGA": 1.203598}, {"Band_gap_GGA": 1.294462}, {"Band_gap_GGA": 1.2230359999999996}, {"Band_gap_GGA": 1.201254}, {"Band_gap_GGA": 1.684858}, {"Band_gap_GGA": 1.413167}, {"Band_gap_GGA": 1.278177}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.20687}, {"Band_gap_GGA": 0.210073}, {"Band_gap_GGA": 0.548871}, {"Band_gap_GGA": 0.905913}, {"Band_gap_GGA": 0.908602}, {"Band_gap_GGA": 0.2437109999999998}, {"Band_gap_GGA": 0.227571}, {"Band_gap_GGA": 1.957509}, {"Band_gap_GGA": 1.704363}, {"Band_gap_GGA": 2.269004}, {"Band_gap_GGA": 1.905525}, {"Band_gap_GGA": 1.961019}, {"Band_gap_GGA": 1.243615}, {"Band_gap_GGA": 1.658038}, {"Band_gap_GGA": 0.235177}, {"Band_gap_GGA": 1.140222}, {"Band_gap_GGA": 1.265602}, {"Band_gap_GGA": 1.198883}, {"Band_gap_GGA": 0.415049}, {"Band_gap_GGA": 1.200399}, {"Band_gap_GGA": 0.673361}, {"Band_gap_GGA": 2.287747}, {"Band_gap_GGA": 1.76431}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 1.322154}, {"Band_gap_GGA": 0.925883}, {"Band_gap_GGA": 1.338733}, {"Band_gap_GGA": 1.352438}, {"Band_gap_GGA": 1.398201}, {"Band_gap_GGA": 0.0}, {"Band_gap_GGA": 0.659463}, {"Band_gap_GGA": 1.366053}, {"Band_gap_GGA": 1.562408}, {"Band_gap_GGA": 2.572374}, {"Band_gap_GGA": 1.2921459999999998}, {"Band_gap_GGA": 2.566776}, {"Band_gap_GGA": 2.302644}, {"Band_gap_GGA": 1.031397}, {"Band_gap_GGA": 0.154163}, {"Band_gap_GGA": 0.792268}, {"Band_gap_GGA": 1.087767}, {"Band_gap_GGA": 0.538007}, {"Band_gap_GGA": 0.287844}, {"Band_gap_GGA": 0.026852}, {"Band_gap_GGA": 0.421518}, {"Band_gap_GGA": 0.018415}, {"Band_gap_GGA": 0.059662}, {"Band_gap_GGA": 0.230802}, {"Band_gap_GGA": 0.284829}, {"Band_gap_GGA": 2.396933}, {"Band_gap_GGA": 1.462945}, {"Band_gap_GGA": 1.460684}, {"Band_gap_GGA": 1.466414}, {"Band_gap_GGA": 2.861953}, {"Band_gap_GGA": 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2.564278}, {"Band_gap_GGA": 2.196636}, {"Band_gap_GGA": 1.175897}, {"Band_gap_GGA": 1.436867}, {"Band_gap_GGA": 1.305043}, {"Band_gap_GGA": 1.601978}, {"Band_gap_GGA": 1.66379}, {"Band_gap_GGA": 1.94988}, {"Band_gap_GGA": 1.824328}, {"Band_gap_GGA": 1.68645}, {"Band_gap_GGA": 2.577125}, {"Band_gap_GGA": 2.50703}, {"Band_gap_GGA": 2.628116}, {"Band_gap_GGA": 2.063832}, {"Band_gap_GGA": 2.059388}, {"Band_gap_GGA": 0.477598}, {"Band_gap_GGA": 2.395911}, {"Band_gap_GGA": 1.015622}, {"Band_gap_GGA": 2.542545}, {"Band_gap_GGA": 1.70482}, {"Band_gap_GGA": 1.607063}, {"Band_gap_GGA": 0.093388}, {"Band_gap_GGA": 0.16859}, {"Band_gap_GGA": 2.300021}, {"Band_gap_GGA": 0.332569}, {"Band_gap_GGA": 1.783169}, {"Band_gap_GGA": 0.1090209999999999}, {"Band_gap_GGA": 3.722443}, {"Band_gap_GGA": 1.666039}, {"Band_gap_GGA": 1.381963}, {"Band_gap_GGA": 0.987243}, {"Band_gap_GGA": 2.306227}, {"Band_gap_GGA": 3.066712}, {"Band_gap_GGA": 3.0295}, {"Band_gap_GGA": 0.768662}, {"Band_gap_GGA": 0.887118}, {"Band_gap_GGA": 0.852572}, {"Band_gap_GGA": 0.204799}, {"Band_gap_GGA": 0.5355}, {"Band_gap_GGA": 0.775819}, {"Band_gap_GGA": 1.27965}, {"Band_gap_GGA": 0.380005}, {"Band_gap_GGA": 2.319014}, {"Band_gap_GGA": 0.957195}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Band_gap_GGA where Band_gap_HSE_optical < {}."}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) C#C?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='C#C'"}, "tool": "calculate_data", "answer": -4.02850195638145, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the minimum defective_energy for material_type 2D?", "refer_dataset": "table68", "column names": ["material_type", "defective_energy"], "condition_column": {"material_type": "="}, "answer_column": {"defective_energy": "min"}, "condition": {"material_type": "=='2D'"}, "tool": "calculate_data", "answer": 0.36975072, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum defective_energy for material_type {}?"}
{"question": "What is the highest Lattice Parameter observed when A_AtomN is 41.0, B_AtomN > 80.0, and Volume < 70.4207718211?", "refer_dataset": "table22", "column names": ["A_AtomN", "B_AtomN", "Volume", "Lattice"], "condition_column": {"A_AtomN": "=", "B_AtomN": ">", "Volume": "<"}, "answer_column": {"Lattice": "max"}, "condition": {"A_AtomN": "=='41.0'", "B_AtomN": ">80.0", "Volume": "<70.4207718211"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Lattice Parameter observed when A_AtomN is {}, B_AtomN > {}, and Volume < {}?"}
{"question": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals 0.24874?", "refer_dataset": "table67", "column names": ["exfoliation_energy_per_atom", "total_magnetization"], "condition_column": {"total_magnetization": "="}, "answer_column": {"exfoliation_energy_per_atom": "max"}, "condition": {"total_magnetization": "=='0.24874'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals {}?"}
{"question": "How many Preparations have Contact-times shorter than 4.3 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<4.3"}, "tool": "calculate_data", "answer": 1720, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "What is the highest reaction energy recorded for element Mn?", "refer_dataset": "table18", "column names": ["AA", "reaction_energy"], "condition_column": {"AA": "="}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Mn'"}, "tool": "calculate_data", "answer": -0.154, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy recorded for element {}?"}
{"question": "What is the maximum PLD observed in compounds with a topology of tsy and synthesized status True?", "refer_dataset": "table62", "column names": ["topology", "synthesized", "pld"], "condition_column": {"topology": "=", "synthesized": "="}, "answer_column": {"pld": "max"}, "condition": {"topology": "=='tsy'", "synthesized": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD observed in compounds with a topology of {} and synthesized status {}?"}
{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 1.0, Indirect Bandgap < 0.0, and Lattice Parameter 4.1892967298?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='1.0'", "Indirect_Band": "<0.0", "Lattice": "=='4.1892967298'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
{"question": "What is the average band_gap for materials with nelements equal to 1?", "refer_dataset": "table55", "column names": ["band_gap", "nelements"], "condition_column": {"nelements": "="}, "answer_column": {"band_gap": "avg"}, "condition": {"nelements": "=='1'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average band_gap for materials with nelements equal to {}?"}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -0.37519962361434 and Gibbs free energy (G) under 5.90378031726968.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-0.37519962361434", "G": "<5.90378031726968"}, "tool": "calculate_data", "answer": -2.1840698733101873, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "What is the highest C2 selectivity (C2s) for M1 = Mn, M2_mol < 0.185, and Support = SiO2?", "refer_dataset": "table17", "column names": ["M1", "M2_mol", "Support", "C2s"], "condition_column": {"M1": "=", "M2_mol": "<", "Support": "="}, "answer_column": {"C2s": "max"}, "condition": {"M1": "=='Mn'", "M2_mol": "<0.185", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C2 selectivity (C2s) for M1 = {}, M2_mol < {}, and Support = {}?"}
{"question": "Determine the minimum CT needed for molecular formulas containing LaMg0.4Cr0.6O3 when aged longer than 5 hours.", "refer_dataset": "table11", "column names": ["Molecular formulas", "AH (h)", "CT (℃)"], "condition_column": {"Molecular formulas": "=", "AH (h)": ">"}, "answer_column": {"CT (℃)": "min"}, "condition": {"Molecular formulas": "=='LaMg0.4Cr0.6O3'", "AH (h)": ">5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum CT needed for molecular formulas containing {} when aged longer than {} hours."}
{"question": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below -52.72219089789422.", "refer_dataset": "table56", "column names": ["mu_b", "shear modulus"], "condition_column": {"shear modulus": "<"}, "answer_column": {"mu_b": "avg"}, "condition": {"shear modulus": "<-52.72219089789422"}, "tool": "calculate_data", "answer": 0.00117174, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below {}."}
{"question": "Calculate the minimum Band_gap_HSE_optical where SOC is True.", "refer_dataset": "table63", "column names": ["SOC", "Band_gap_HSE_optical"], "condition_column": {"SOC": "="}, "answer_column": {"Band_gap_HSE_optical": "min"}, "condition": {"SOC": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum Band_gap_HSE_optical where SOC is {}."}
{"question": "What is the average formation energy (ef) for bulk_formula Pm and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Pm'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 1.719765, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "List organic compounds (OC) with light intensity (I) greater than 1.0 mW/cm².", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2"], "condition_column": {"I, mW/cm2": ">"}, "answer_column": {"OC": ""}, "condition": {"I, mW/cm2": ">1.0"}, "tool": "calculate_data", "answer": [{"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "1,4-Dioxane"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "n-Nitrosodimethylamine"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Tris-2-chloroethyl phosphate"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "Gemfibrozil"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "17-beta estradiol"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "2-Chlorobiphenyl"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Benzylparaben"}, {"OC": "Acetaminophen"}, {"OC": "beta-blocker atenolol"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfisoxazole"}, {"OC": "Sulfathiazole"}, {"OC": "Sulfamethizole"}, {"OC": "Sulfanilamide"}, {"OC": "Sulfacetamide natrium salt"}, {"OC": "Sulfamethoxazole"}, {"OC": "Sulfadiazine natrium salt"}, {"OC": "Sulfathiazole natrium salt"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Carbamazepine"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Clofibric acid"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iomeprol"}, {"OC": "Iopromide"}, {"OC": "Atrazine"}, {"OC": "Cyanazine"}, {"OC": "Irgarol"}, {"OC": "Prometryne"}, {"OC": "Propazine"}, {"OC": "Dichlofenthion"}, {"OC": "Bromophos ethyl"}, {"OC": "Bromophos methyl"}, {"OC": "Parathion ethyl"}, {"OC": "Parathion methyl"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dinoseb"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Dicamba"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Floumeturon"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "Amaranth"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "2,4,6-Trinitrotoluene"}, {"OC": "Phorate"}, {"OC": "Phorate"}, {"OC": "Phorate"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Dichlorvos"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Phosphamidon"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-acetic acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Indole-3-butyric acid"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Terbufos"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}, {"OC": "Imazapyr"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List organic compounds (OC) with light intensity (I) greater than {} mW/cm²."}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.0, gap pbe > 0.0, and mu_b > -1.29e-05?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.0", "gap pbe": ">0.0", "mu_b": ">-1.29e-05"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "What is the highest SSA observed when CT exceeds 600°C and preparation method is 1?", "refer_dataset": "table11", "column names": ["CT (℃)", "PM", "SSA (m2 g -1 )"], "condition_column": {"CT (℃)": ">", "PM": "="}, "answer_column": {"SSA (m2 g -1 )": "avg"}, "condition": {"CT (℃)": ">600", "PM": "=='1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SSA observed when CT exceeds {}°C and preparation method is {}?"}
{"question": "What is the maximum Onset potential for alloys where Platinum > 2.6%, Ruthenium < 32.9%, and Palladium > 0.0%?", "refer_dataset": "table15", "column names": ["Pt", "Ru", "Pd", "Onset"], "condition_column": {"Pt": ">", "Ru": "<", "Pd": ">"}, "answer_column": {"Onset": "max"}, "condition": {"Pt": ">2.6", "Ru": "<32.9", "Pd": ">0.0"}, "tool": "calculate_data", "answer": 0.600639, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Onset potential for alloys where Platinum > {}%, Ruthenium < {}%, and Palladium > {}%?"}
{"question": "What is the average Cation1-mol for Cation1 83?", "refer_dataset": "table20", "column names": ["Cation1", "Cation1-mol"], "condition_column": {"Cation1": "="}, "answer_column": {"Cation1-mol": "avg"}, "condition": {"Cation1": "=='83'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Cation1-mol for Cation1 {}?"}
{"question": "How many materials have a bandgap less than 1.8022?", "refer_dataset": "table67", "column names": ["bandgap", "material_id"], "condition_column": {"bandgap": "<"}, "answer_column": {"material_id": "count"}, "condition": {"bandgap": "<1.8022"}, "tool": "calculate_data", "answer": 3763, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many materials have a bandgap less than {}?"}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than -1.3203823354756?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<-1.3203823354756"}, "tool": "calculate_data", "answer": 2.04884424920197, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "What is the minimum M1 atom number required to achieve C2s greater than 29.41?", "refer_dataset": "table17", "column names": ["M1_atom_number", "C2s"], "condition_column": {"C2s": ">"}, "answer_column": {"M1_atom_number": "min"}, "condition": {"C2s": ">29.41"}, "tool": "calculate_data", "answer": 25, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum M1 atom number required to achieve C2s greater than {}?"}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 100°C and references in study [38]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">100", "Ref.": "=='[38]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "What is the highest reaction energy for elements Rh with adsorbed species CH* and activation energy greater than 1.35?", "refer_dataset": "table18", "column names": ["AA", "ab", "activation_energy", "reaction_energy"], "condition_column": {"AA": "=", "ab": "=", "activation_energy": ">"}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Rh'", "ab": "=='CH*'", "activation_energy": ">1.35"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy for elements {} with adsorbed species {} and activation energy greater than {}?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -5.80095155192682.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-5.80095155192682"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "How many references document perovskite oxides with a calcination temperature (CT) above 900°C?", "refer_dataset": "table11", "column names": ["CT (℃)", "Ref."], "condition_column": {"CT (℃)": ">"}, "answer_column": {"Ref.": "count"}, "condition": {"CT (℃)": ">900"}, "tool": "calculate_data", "answer": 1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document perovskite oxides with a calcination temperature (CT) above {}°C?"}
{"question": "What is the median aging time (AH) for perovskite oxides with DT > 80°C and references in study [43]?", "refer_dataset": "table11", "column names": ["DT (℃)", "Ref.", "AH (h)"], "condition_column": {"DT (℃)": ">", "Ref.": "="}, "answer_column": {"AH (h)": "median"}, "condition": {"DT (℃)": ">80", "Ref.": "=='[43]'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median aging time (AH) for perovskite oxides with DT > {}°C and references in study {}?"}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'BN'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='BN'"}, "tool": "calculate_data", "answer": 12.731, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "What is the average Temperature when CH4-conversion% exceeds 6.8%?", "refer_dataset": "table20", "column names": ["Temperature", "CH4-conversion%"], "condition_column": {"CH4-conversion%": ">"}, "answer_column": {"Temperature": "avg"}, "condition": {"CH4-conversion%": ">6.8"}, "tool": "calculate_data", "answer": 1030.8219862585884, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Temperature when CH4-conversion% exceeds {}%?"}
{"question": "What is the average band_gap for materials with nelements equal to 2?", "refer_dataset": "table55", "column names": ["band_gap", "nelements"], "condition_column": {"nelements": "="}, "answer_column": {"band_gap": "avg"}, "condition": {"nelements": "=='2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average band_gap for materials with nelements equal to {}?"}
{"question": "What is the average Surface Area(m2/g) for materials with A equal to Ca, B equal to In, and Wave length(<nm) below 420.0?", "refer_dataset": "table4", "column names": ["A", "B", "Wave length(<nm)", "Surface Area(m2/g)"], "condition_column": {"A": "=", "B": "=", "Wave length(<nm)": "<"}, "answer_column": {"Surface Area(m2/g)": "avg"}, "condition": {"A": "=='Ca'", "B": "=='In'", "Wave length(<nm)": "<420.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Area(m2/g) for materials with A equal to {}, B equal to {}, and Wave length(<nm) below {}?"}
{"question": "Determine the minimum pH where Material is MIL-101, Surface area (m2/g) > 252.59, and Pore Volume (cm3/g) < 0.86.", "refer_dataset": "table6", "column names": ["Material", "Surface area (m2/g)", "Pore Volume (cm3/g)", "pH"], "condition_column": {"Material": "=", "Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<"}, "answer_column": {"pH": "min"}, "condition": {"Material": "=='MIL-101'", "Surface area (m2/g)": ">252.59", "Pore Volume (cm3/g)": "<0.86"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum pH where Material is {}, Surface area (m2/g) > {}, and Pore Volume (cm3/g) < {}."}
{"question": "What is the average number of atoms per structure in materials with a crystal system of cubic and space group symbol Fm-3m?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='cubic'", "spacegroup_symbol": "=='Fm-3m'"}, "tool": "calculate_data", "answer": 2.646875, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > 5.0, pH < 8.2, and Antibiotic dosage (mg/L) = 50.0.", "refer_dataset": "table6", "column names": ["Illumination time (min)", "pH", "Antibiotic dosage (mg/L)", "Pore Volume (cm3/g)"], "condition_column": {"Illumination time (min)": ">", "pH": "<", "Antibiotic dosage (mg/L)": "="}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Illumination time (min)": ">5.0", "pH": "<8.2", "Antibiotic dosage (mg/L)": "=='50.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Pore Volume (cm3/g) where Illumination time (min) > {}, pH < {}, and Antibiotic dosage (mg/L) = {}."}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 2.64 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<2.64"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "Calculate the average _oqmd_stability for materials with _oqmd_band_gap below 0.423.", "refer_dataset": "table57", "column names": ["_oqmd_band_gap", "_oqmd_stability"], "condition_column": {"_oqmd_band_gap": "<"}, "answer_column": {"_oqmd_stability": "avg"}, "condition": {"_oqmd_band_gap": "<0.423"}, "tool": "calculate_data", "answer": 0.6166105151605239, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average _oqmd_stability for materials with _oqmd_band_gap below {}."}
{"question": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"FM\", Space_group_rlx 62, and Band_gap_HSE > 2.143879.", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Space_group_rlx", "Band_gap_HSE", "Band_gap_GGA_optical"], "condition_column": {"Magnetic_ordering": "=", "Space_group_rlx": "=", "Band_gap_HSE": ">"}, "answer_column": {"Band_gap_GGA_optical": "avg"}, "condition": {"Magnetic_ordering": "=='FM'", "Space_group_rlx": "=='62'", "Band_gap_HSE": ">2.143879"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"{}\", Space_group_rlx {}, and Band_gap_HSE > {}."}
{"question": "Materials with bandgap of 2.9398, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='2.9398'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) CC#N?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='CC#N'"}, "tool": "calculate_data", "answer": -3.66769129288626, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 5.1287890181418?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">5.1287890181418"}, "tool": "calculate_data", "answer": -4.66662696287739, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.4566.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.4566"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "What is the highest Bandgap (Eg) observed in experiments where the Main product is CH4?", "refer_dataset": "table10", "column names": ["Main product", "Eg(eV)"], "condition_column": {"Main product": "="}, "answer_column": {"Eg(eV)": "max"}, "condition": {"Main product": "=='CH4'"}, "tool": "calculate_data", "answer": 3.4, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Bandgap (Eg) observed in experiments where the Main product is {}?"}
{"question": "What is the median O2-pressure when Anion1 is 0?", "refer_dataset": "table20", "column names": ["O2-pressure", "Anion1"], "condition_column": {"Anion1": "="}, "answer_column": {"O2-pressure": "median"}, "condition": {"Anion1": "=='0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median O2-pressure when Anion1 is {}?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -0.98739756794076 and the HOMO-LUMO gap (gap) is less than 1.89978772768646?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-0.98739756794076", "gap": "<1.89978772768646"}, "tool": "calculate_data", "answer": 1.98432129278939, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below 777.0 K, the electron affinity of element A (EAa) exceeds 4.7 eV, and the hydrogen production rate (RH2) is higher than 202.6 µmol h⁻¹ g⁻¹.", "refer_dataset": "table3", "column names": ["A_Tm", "EAa", "RH2(µmol h-1 g-1)", "χpb"], "condition_column": {"A_Tm": "<", "EAa": ">", "RH2(µmol h-1 g-1)": ">"}, "answer_column": {"χpb": "median"}, "condition": {"A_Tm": "<777.0", "EAa": ">4.7", "RH2(µmol h-1 g-1)": ">202.6"}, "tool": "calculate_data", "answer": [{"χpb": 1.54}, {"χpb": 1.55}, {"χpb": 1.55}, {"χpb": 1.6}, {"χpb": 1.6}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.12}, {"χpb": 1.54}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below {} K, the electron affinity of element A (EAa) exceeds {} eV, and the hydrogen production rate (RH2) is higher than {} µmol h⁻¹ g⁻¹."}
{"question": "What is the minimum e_hull value for materials with bulk modulus exceeding 37.9081914130929?", "refer_dataset": "table56", "column names": ["e_hull", "bulk modulus"], "condition_column": {"bulk modulus": ">"}, "answer_column": {"e_hull": "min"}, "condition": {"bulk modulus": ">37.9081914130929"}, "tool": "calculate_data", "answer": 2.2571706762500003, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum e_hull value for materials with bulk modulus exceeding {}?"}
{"question": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above 1.2504476675.", "refer_dataset": "table51", "column names": ["m06_lumo", "m06_scharber_voc"], "condition_column": {"m06_scharber_voc": ">"}, "answer_column": {"m06_lumo": "min"}, "condition": {"m06_scharber_voc": ">1.2504476675"}, "tool": "calculate_data", "answer": 0.024, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above {}."}
{"question": "Find the highest defective_energy where wycoff position is k and material_type is 3D?", "refer_dataset": "table68", "column names": ["wycoff", "material_type", "defective_energy"], "condition_column": {"wycoff": "=", "material_type": "="}, "answer_column": {"defective_energy": "max"}, "condition": {"wycoff": "=='k'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": -89.25672233, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest defective_energy where wycoff position is {} and material_type is {}?"}
{"question": "What is the average journal impact factor for research institutions located in CA 91125 USA?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='CA 91125 USA'"}, "tool": "calculate_data", "answer": 10.695, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "What is the highest ethylene selectivity observed when Support is SiO4?", "refer_dataset": "table19", "column names": ["Support", "C2H4 sel"], "condition_column": {"Support": "="}, "answer_column": {"C2H4 sel": "max"}, "condition": {"Support": "=='SiO4'"}, "tool": "calculate_data", "answer": 24.9, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ethylene selectivity observed when Support is {}?"}
{"question": "What is the minimum reaction solution volume used when the preparation method is 'Citrate nitrate self-combustion'?", "refer_dataset": "table1", "column names": ["Preparation method", "Reaction solution"], "condition_column": {"Preparation method": "="}, "answer_column": {"Reaction solution": "min"}, "condition": {"Preparation method": "=='Citrate nitrate self-combustion'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reaction solution volume used when the preparation method is '{}'?"}
{"question": "What is the maximum shear modulus recorded for materials with the chemical formula KYbS2?", "refer_dataset": "table56", "column names": ["shear modulus", "formula"], "condition_column": {"formula": "="}, "answer_column": {"shear modulus": "max"}, "condition": {"formula": "=='KYbS2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus recorded for materials with the chemical formula {}?"}
{"question": "How many times has research from Hunan Univ institution been cited?", "refer_dataset": "table13", "column names": ["Facility", "Cited_Time"], "condition_column": {"Facility": "="}, "answer_column": {"Cited_Time": "sum"}, "condition": {"Facility": "=='Hunan Univ'"}, "tool": "calculate_data", "answer": 1094, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many times has research from {} institution been cited?"}
{"question": "What is the maximum CH4 conversion (%) recorded when M1 is Zn, temperature exceeds 750°C, and total flow is below 20 mL/min?", "refer_dataset": "table21", "column names": ["M1", "Temp. (°C)", "Total flow(mL/min)", "CH4 conversion (%)"], "condition_column": {"M1": "=", "Temp. (°C)": ">", "Total flow(mL/min)": "<"}, "answer_column": {"CH4 conversion (%)": "max"}, "condition": {"M1": "=='Zn'", "Temp. (°C)": ">750", "Total flow(mL/min)": "<20"}, "tool": "calculate_data", "answer": 52.27734552, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum CH4 conversion (%) recorded when M1 is {}, temperature exceeds {}°C, and total flow is below {} mL/min?"}
{"question": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > 0.4, Ni < 0.0, and Fe = 0.1?", "refer_dataset": "table16", "column names": ["Mn", "Ni", "Fe", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">", "Ni": "<", "Fe": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.4", "Ni": "<0.0", "Fe": "=='0.1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average J.uAcm2_0.80_fromCV for samples with Mn > {}, Ni < {}, and Fe = {}?"}
{"question": "Calculate the average A_AtomN for materials where Element B is He, Cn exceeds 1, and Formation Energy is below 2.3?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='He'", "Cn": ">1", "Formation_E": "<2.3"}, "tool": "calculate_data", "answer": 8.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "What is the average Degradation efficiency (%) when pH is 2.0?", "refer_dataset": "table6", "column names": ["pH", "Degradation efficiency (%)"], "condition_column": {"pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"pH": "=='2.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when pH is {}?"}
{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 2.0, Indirect Bandgap < 0.0, and Lattice Parameter 3.6918493473?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='2.0'", "Indirect_Band": "<0.0", "Lattice": "=='3.6918493473'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 1.93793017046236.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<1.93793017046236"}, "tool": "calculate_data", "answer": [{"U": 6.19311549745637}, {"U": 5.74085587987803}, {"U": 5.85213296706841}, {"U": 4.54692058907546}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 4.1619487412596}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 2.9854853300983}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 4.28237851192289}, {"U": 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1.68175702981378}, {"U": 1.66775235284695}, {"U": 1.69638355624295}, {"U": 2.15033105093333}, {"U": 1.66656613580536}, {"U": 2.16992976024829}, {"U": 0.89750818373552}, {"U": 1.39497991516349}, {"U": 1.41447149915091}, {"U": 1.41040334951708}, {"U": 1.89166257710565}, {"U": 1.91104442295265}, {"U": 1.91333063421123}, {"U": 1.89792548954772}, {"U": 1.93441342123462}, {"U": 2.3823932513369}, {"U": 1.87871086372419}, {"U": 2.38514454328579}, {"U": 0.05679645160256}, {"U": 0.341940558211}, {"U": 0.32816580877646}, {"U": 0.56508000267395}, {"U": 0.84792744677235}, {"U": 0.82872065938743}, {"U": 0.56060164142}, {"U": 0.83194487046524}, {"U": 0.84336024988093}, {"U": 1.11763766777575}, {"U": 0.82945747261591}, {"U": 1.10670304592758}, {"U": 0.83144582320765}, {"U": 1.10423132495545}, {"U": -0.451758832007}, {"U": 0.05719098634546}, {"U": 0.32545370902057}, {"U": 0.05198626311451}, {"U": 0.83160520479254}, {"U": 0.32289576522383}, {"U": 0.82306914515622}, {"U": 1.10490543067512}, {"U": -0.16529525490075}, {"U": 0.34283675302437}, {"U": 0.61549161412881}, {"U": 0.33741516632545}, {"U": 0.83953247903085}, {"U": 1.12195403463194}, {"U": 1.11910084298124}, {"U": 1.61456854694026}, {"U": 1.60701229212905}, {"U": 1.33528236677951}, {"U": 1.34363552951513}, {"U": 1.61223269223721}, {"U": 1.34519276598383}, {"U": 1.62650648892934}, {"U": 1.62129392725978}, {"U": 1.88609206007332}, {"U": 0.7265936428571}, {"U": 1.23522992366553}, {"U": 1.5090683889987}, {"U": 1.01337598313312}, {"U": 1.52077379064262}, {"U": -0.43341427286817}, {"U": 0.06862465545122}, {"U": 0.33831136113882}, {"U": 0.77490193995407}, {"U": 0.57407591737485}, {"U": 0.84317735298024}, {"U": 1.2810560485389}, {"U": 1.11634693821948}, {"U": 0.79919587399094}, {"U": 1.55600757215339}, {"U": -0.42890717067269}, {"U": 0.07262748476338}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "Retrieve the ID with the highest Tc for materials where formula contains Bi1Pb1Sr2Y0.4Ca0.6Cu2O8 and Tc exceeds 79.5.", "refer_dataset": "table65", "column names": ["id", "formula", "Tc"], "condition_column": {"formula": "=", "Tc": ">"}, "answer_column": {"id": "max"}, "condition": {"formula": "=='Bi1Pb1Sr2Y0.4Ca0.6Cu2O8'", "Tc": ">79.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Retrieve the ID with the highest Tc for materials where formula contains {} and Tc exceeds {}."}
{"question": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding 120.0°C?", "refer_dataset": "table7", "column names": ["Synhesis_Temp", "Reactor_Volume"], "condition_column": {"Synhesis_Temp": ">"}, "answer_column": {"Reactor_Volume": "min"}, "condition": {"Synhesis_Temp": ">120.0"}, "tool": "calculate_data", "answer": 1000.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding {}°C?"}
{"question": "Find the total electronic spatial extent (R²) values where HOMO energy is above -7.126661777496338 and internal energy (U) is below -33.23590469360352?", "refer_dataset": "table60", "column names": ["homo", "U", "r2"], "condition_column": {"homo": ">", "U": "<"}, "answer_column": {"r2": "sum"}, "condition": {"homo": ">-7.126661777496338", "U": "<-33.23590469360352"}, "tool": "calculate_data", "answer": 3241356.8445281982, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the total electronic spatial extent (R²) values where HOMO energy is above {} and internal energy (U) is below {}?"}
{"question": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above 1.5769842815.", "refer_dataset": "table51", "column names": ["m06_lumo", "m06_scharber_voc"], "condition_column": {"m06_scharber_voc": ">"}, "answer_column": {"m06_lumo": "min"}, "condition": {"m06_scharber_voc": ">1.5769842815"}, "tool": "calculate_data", "answer": 0.024, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above {}."}
{"question": "What is the minimum Gold percentage in alloys where Ruthenium exceeds 88.0%?", "refer_dataset": "table15", "column names": ["Ru", "Au"], "condition_column": {"Ru": ">"}, "answer_column": {"Au": "min"}, "condition": {"Ru": ">88.0"}, "tool": "calculate_data", "answer": 8.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Gold percentage in alloys where Ruthenium exceeds {}%?"}
{"question": "What is the average C2 hydrocarbon yield (C2y) for catalysts with M1 equal to Mn?", "refer_dataset": "table17", "column names": ["M1", "C2y"], "condition_column": {"M1": "="}, "answer_column": {"C2y": "avg"}, "condition": {"M1": "=='Mn'"}, "tool": "calculate_data", "answer": 6.462598631239939, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average C2 hydrocarbon yield (C2y) for catalysts with M1 equal to {}?"}
{"question": "Calculate the average Surface area (m2/g) when Pore Volume (cm3/g) is below 0.11.", "refer_dataset": "table6", "column names": ["Pore Volume (cm3/g)", "Surface area (m2/g)"], "condition_column": {"Pore Volume (cm3/g)": "<"}, "answer_column": {"Surface area (m2/g)": "avg"}, "condition": {"Pore Volume (cm3/g)": "<0.11"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Surface area (m2/g) when Pore Volume (cm3/g) is below {}."}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.6677.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.6677"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "What is the average Power(W) for materials where X is O, A mole is greater than 0.473, and Wave length(<nm) below 440.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='O'", "A mole": ">0.473", "Wave length(<nm)": "<440.0"}, "tool": "calculate_data", "answer": 357.2857142857143, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "Determine the average temperature (°C) required to achieve C2 yield (%) over 1.53265494% with M2 as Mo and PAr below 0.4 atm.", "refer_dataset": "table21", "column names": ["C2 yield (%)", "M2", "PAr (atm)", "Temp. (°C)"], "condition_column": {"C2 yield (%)": ">", "M2": "=", "PAr (atm)": "<"}, "answer_column": {"Temp. (°C)": "avg"}, "condition": {"C2 yield (%)": ">1.53265494", "M2": "=='Mo'", "PAr (atm)": "<0.4"}, "tool": "calculate_data", "answer": 803.2051282051282, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average temperature (°C) required to achieve C2 yield (%) over {}% with M2 as {} and PAr below {} atm."}
{"question": "What is the average journal impact factor for research institutions located in Australia?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='Australia'"}, "tool": "calculate_data", "answer": 16.28593333333334, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 5.84049874%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">5.84049874"}, "tool": "calculate_data", "answer": 47.88292248, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below -47.90233721?", "refer_dataset": "table66", "column names": ["final_energy", "avg_max"], "condition_column": {"final_energy": "<"}, "answer_column": {"avg_max": "min"}, "condition": {"final_energy": "<-47.90233721"}, "tool": "calculate_data", "answer": 26.95001607174691, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum average maximum potential (avg_max) where final energy (final_energy) is below {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A74]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A74]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}, {"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than -36.21764755249024?", "refer_dataset": "table60", "column names": ["H", "U0"], "condition_column": {"H": ">"}, "answer_column": {"U0": "max"}, "condition": {"H": ">-36.21764755249024"}, "tool": "calculate_data", "answer": -9.240361213684082, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than {}?"}
{"question": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above 4, support material BaO, and argon pressure 0.4 atm.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Support", "PAr (atm)", "C2 selectivity(%)"], "condition_column": {"CH4/O2 (mol/mol)": ">", "Support": "=", "PAr (atm)": "="}, "answer_column": {"C2 selectivity(%)": "min"}, "condition": {"CH4/O2 (mol/mol)": ">4", "Support": "=='BaO'", "PAr (atm)": "=='0.4'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above {}, support material {}, and argon pressure {} atm."}
{"question": "What is the highest reaction energy recorded for element Pd?", "refer_dataset": "table18", "column names": ["AA", "reaction_energy"], "condition_column": {"AA": "="}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Pd'"}, "tool": "calculate_data", "answer": 1.99, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy recorded for element {}?"}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -4.0143823269903.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-4.0143823269903"}, "tool": "calculate_data", "answer": -2.8229160065451313, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "For materials with B_AtomN 51, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='51'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Indirect\", Band_gap_HSE_optical < 4.147475, and Magnetic_ordering \"NM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Indirect'", "Band_gap_HSE_optical": "<4.147475", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 2.037844}, {"Band_gap_GGA": 1.489848}, {"Band_gap_GGA": 1.623}, {"Band_gap_GGA": 1.150497}, {"Band_gap_GGA": 1.119908}, {"Band_gap_GGA": 1.173072}, {"Band_gap_GGA": 1.426179}, {"Band_gap_GGA": 0.694418}, {"Band_gap_GGA": 1.959881}, {"Band_gap_GGA": 0.846528}, {"Band_gap_GGA": 1.082826}, {"Band_gap_GGA": 0.812729}, {"Band_gap_GGA": 1.604719}, {"Band_gap_GGA": 0.121138}, {"Band_gap_GGA": 1.327256}, {"Band_gap_GGA": 1.324094}, {"Band_gap_GGA": 0.763006}, {"Band_gap_GGA": 1.298135}, {"Band_gap_GGA": 1.812356}, {"Band_gap_GGA": 1.472881}, {"Band_gap_GGA": 1.917619}, {"Band_gap_GGA": 0.736109}, {"Band_gap_GGA": 2.514819}, {"Band_gap_GGA": 1.166888}, {"Band_gap_GGA": 1.199719}, {"Band_gap_GGA": 0.476453}, {"Band_gap_GGA": 0.049785}, {"Band_gap_GGA": 0.796627}, {"Band_gap_GGA": 0.517763}, {"Band_gap_GGA": 0.451375}, {"Band_gap_GGA": 1.241031}, {"Band_gap_GGA": 2.212373}, {"Band_gap_GGA": 1.3973739999999997}, {"Band_gap_GGA": 1.20222}, {"Band_gap_GGA": 2.498679}, {"Band_gap_GGA": 0.116559}, {"Band_gap_GGA": 1.852829}, {"Band_gap_GGA": 2.330909}, {"Band_gap_GGA": 1.484641}, {"Band_gap_GGA": 1.362999}, {"Band_gap_GGA": 1.2176}, {"Band_gap_GGA": 2.218596}, {"Band_gap_GGA": 1.817097}, {"Band_gap_GGA": 1.446497}, {"Band_gap_GGA": 2.58846}, {"Band_gap_GGA": 1.58958}, {"Band_gap_GGA": 0.636041}, {"Band_gap_GGA": 0.611795}, {"Band_gap_GGA": 0.803879}, {"Band_gap_GGA": 1.403779}, {"Band_gap_GGA": 1.104735}, {"Band_gap_GGA": 1.829391}, {"Band_gap_GGA": 1.512535}, {"Band_gap_GGA": 0.241175}, {"Band_gap_GGA": 1.521364}, {"Band_gap_GGA": 0.548871}, {"Band_gap_GGA": 1.957509}, {"Band_gap_GGA": 1.704363}, {"Band_gap_GGA": 1.961019}, {"Band_gap_GGA": 1.243615}, {"Band_gap_GGA": 1.658038}, {"Band_gap_GGA": 0.235177}, {"Band_gap_GGA": 1.140222}, {"Band_gap_GGA": 1.198883}, {"Band_gap_GGA": 0.415049}, {"Band_gap_GGA": 2.287747}, {"Band_gap_GGA": 1.322154}, {"Band_gap_GGA": 0.925883}, {"Band_gap_GGA": 1.562408}, {"Band_gap_GGA": 1.2921459999999998}, {"Band_gap_GGA": 2.302644}, {"Band_gap_GGA": 1.031397}, {"Band_gap_GGA": 0.792268}, {"Band_gap_GGA": 1.087767}, {"Band_gap_GGA": 0.538007}, {"Band_gap_GGA": 0.018415}, {"Band_gap_GGA": 0.230802}, {"Band_gap_GGA": 2.119317}, {"Band_gap_GGA": 1.215124}, {"Band_gap_GGA": 1.069901}, {"Band_gap_GGA": 1.525048}, {"Band_gap_GGA": 1.1726}, {"Band_gap_GGA": 1.189953}, {"Band_gap_GGA": 1.107226}, 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{"Band_gap_GGA": 1.812366}, {"Band_gap_GGA": 1.990662}, {"Band_gap_GGA": 1.871972}, {"Band_gap_GGA": 1.610609}, {"Band_gap_GGA": 0.174592}, {"Band_gap_GGA": 2.351361}, {"Band_gap_GGA": 1.645783}, {"Band_gap_GGA": 1.129361}, {"Band_gap_GGA": 2.104882}, {"Band_gap_GGA": 2.09107}, {"Band_gap_GGA": 1.654697}, {"Band_gap_GGA": 1.65824}, {"Band_gap_GGA": 1.667675}, {"Band_gap_GGA": 1.614546}, {"Band_gap_GGA": 0.927177}, {"Band_gap_GGA": 0.952176}, {"Band_gap_GGA": 0.748636}, {"Band_gap_GGA": 0.975196}, {"Band_gap_GGA": 2.390607}, {"Band_gap_GGA": 1.267896}, {"Band_gap_GGA": 2.635571}, {"Band_gap_GGA": 1.596943}, {"Band_gap_GGA": 1.211805}, {"Band_gap_GGA": 1.876854}, {"Band_gap_GGA": 1.490522}, {"Band_gap_GGA": 2.209694}, {"Band_gap_GGA": 1.925467}, {"Band_gap_GGA": 1.986507}, {"Band_gap_GGA": 1.330583}, {"Band_gap_GGA": 0.894779}, {"Band_gap_GGA": 2.029982}, {"Band_gap_GGA": 2.500153}, {"Band_gap_GGA": 2.276321}, {"Band_gap_GGA": 1.62318}, {"Band_gap_GGA": 1.733938}, {"Band_gap_GGA": 2.347727}, {"Band_gap_GGA": 2.599148}, {"Band_gap_GGA": 2.535212}, {"Band_gap_GGA": 1.520556}, {"Band_gap_GGA": 1.032317}, {"Band_gap_GGA": 1.894462}, {"Band_gap_GGA": 2.250861}, {"Band_gap_GGA": 2.102199}, {"Band_gap_GGA": 2.763222}, {"Band_gap_GGA": 2.960813}, {"Band_gap_GGA": 1.55756}, {"Band_gap_GGA": 1.382571}, {"Band_gap_GGA": 0.606807}, {"Band_gap_GGA": 2.027044}, {"Band_gap_GGA": 0.823484}, {"Band_gap_GGA": 2.209528}, {"Band_gap_GGA": 2.565877}, {"Band_gap_GGA": 2.316807}, {"Band_gap_GGA": 2.677563}, {"Band_gap_GGA": 0.727435}, {"Band_gap_GGA": 2.7272220000000003}, {"Band_gap_GGA": 1.842911}, {"Band_gap_GGA": 1.439385}, {"Band_gap_GGA": 1.03154}, {"Band_gap_GGA": 2.762808}, {"Band_gap_GGA": 0.827258}, {"Band_gap_GGA": 0.689105}, {"Band_gap_GGA": 0.394198}, {"Band_gap_GGA": 1.463383}, {"Band_gap_GGA": 1.185585}, {"Band_gap_GGA": 0.853574}, {"Band_gap_GGA": 0.979447}, {"Band_gap_GGA": 2.070407}, {"Band_gap_GGA": 2.486355}, {"Band_gap_GGA": 1.370191}, {"Band_gap_GGA": 2.064247}, {"Band_gap_GGA": 1.466453}, {"Band_gap_GGA": 1.201798}, {"Band_gap_GGA": 2.144045}, {"Band_gap_GGA": 1.436723}, {"Band_gap_GGA": 0.044612}, {"Band_gap_GGA": 2.212292}, {"Band_gap_GGA": 1.263702}, {"Band_gap_GGA": 1.68655}, {"Band_gap_GGA": 1.855932}, {"Band_gap_GGA": 1.8878}, {"Band_gap_GGA": 1.207162}, {"Band_gap_GGA": 0.3737000000000003}, {"Band_gap_GGA": 1.859685}, {"Band_gap_GGA": 1.429847}, {"Band_gap_GGA": 0.645766}, {"Band_gap_GGA": 1.074611}, {"Band_gap_GGA": 2.42974}, {"Band_gap_GGA": 2.40879}, {"Band_gap_GGA": 2.237308}, {"Band_gap_GGA": 1.875662}, {"Band_gap_GGA": 1.754102}, {"Band_gap_GGA": 1.409758}, {"Band_gap_GGA": 1.621974}, {"Band_gap_GGA": 1.618741}, {"Band_gap_GGA": 0.444592}, {"Band_gap_GGA": 2.010366}, {"Band_gap_GGA": 0.924272}, {"Band_gap_GGA": 2.990818}, {"Band_gap_GGA": 1.215515}, {"Band_gap_GGA": 2.125477}, {"Band_gap_GGA": 2.269805}, {"Band_gap_GGA": 0.811707}, {"Band_gap_GGA": 1.744571}, {"Band_gap_GGA": 2.090222}, {"Band_gap_GGA": 2.189527}, {"Band_gap_GGA": 1.235843}, {"Band_gap_GGA": 1.220787}, {"Band_gap_GGA": 2.701244}, {"Band_gap_GGA": 2.151341}, {"Band_gap_GGA": 1.562761}, {"Band_gap_GGA": 1.992365}, {"Band_gap_GGA": 1.825093}, {"Band_gap_GGA": 1.87319}, {"Band_gap_GGA": 2.544654}, {"Band_gap_GGA": 1.2418799999999997}, {"Band_gap_GGA": 0.892895}, {"Band_gap_GGA": 2.578329}, {"Band_gap_GGA": 2.570836}, {"Band_gap_GGA": 1.865955}, {"Band_gap_GGA": 1.67306}, {"Band_gap_GGA": 1.20408}, {"Band_gap_GGA": 1.859734}, {"Band_gap_GGA": 2.507368}, {"Band_gap_GGA": 2.004025}, {"Band_gap_GGA": 1.784577}, {"Band_gap_GGA": 2.016476}, {"Band_gap_GGA": 2.521763}, {"Band_gap_GGA": 2.461123}, {"Band_gap_GGA": 2.564278}, {"Band_gap_GGA": 2.196636}, {"Band_gap_GGA": 1.436867}, {"Band_gap_GGA": 1.305043}, {"Band_gap_GGA": 1.601978}, {"Band_gap_GGA": 1.66379}, {"Band_gap_GGA": 1.824328}, {"Band_gap_GGA": 1.68645}, {"Band_gap_GGA": 2.577125}, {"Band_gap_GGA": 2.063832}, {"Band_gap_GGA": 0.477598}, {"Band_gap_GGA": 1.70482}, {"Band_gap_GGA": 1.666039}, {"Band_gap_GGA": 1.381963}, {"Band_gap_GGA": 1.27965}, {"Band_gap_GGA": 0.380005}, {"Band_gap_GGA": 0.957195}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "What is the median Onset potential for alloys with Ru > 83.4%, Rh > 0.0%, and Pd < 12.8%?", "refer_dataset": "table15", "column names": ["Ru", "Rh", "Pd", "Onset"], "condition_column": {"Ru": ">", "Rh": ">", "Pd": "<"}, "answer_column": {"Onset": "median"}, "condition": {"Ru": ">83.4", "Rh": ">0.0", "Pd": "<12.8"}, "tool": "calculate_data", "answer": [{"Onset": 0.487666}, {"Onset": 0.490676}, {"Onset": 0.485673}, {"Onset": 0.486658}, {"Onset": 0.491697}, {"Onset": 0.486656}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Onset potential for alloys with Ru > {}%, Rh > {}%, and Pd < {}%?"}
{"question": "What is the minimum Tc recorded for materials where formula contains Pb0.5Ca1Sr2Y0.5Cu2O6.97?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "min"}, "condition": {"formula": "=='Pb0.5Ca1Sr2Y0.5Cu2O6.97'"}, "tool": "calculate_data", "answer": 55.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Tc recorded for materials where formula contains {}?"}
{"question": "What is the average degradation rate for experiments using Dopant S with a Calcination Temperature above 800°C?", "refer_dataset": "table8", "column names": ["Dopant", "Calcination temperature(°C)", "Degradation rate(%)"], "condition_column": {"Dopant": "=", "Calcination temperature(°C)": ">"}, "answer_column": {"Degradation rate(%)": "avg"}, "condition": {"Dopant": "=='S'", "Calcination temperature(°C)": ">800"}, "tool": "calculate_data", "answer": 20.844444444444445, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average degradation rate for experiments using Dopant {} with a Calcination Temperature above {}°C?"}
{"question": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) CO?", "refer_dataset": "table61", "column names": ["SMILES_relaxed", "R2"], "condition_column": {"SMILES_relaxed": "="}, "answer_column": {"R2": "max"}, "condition": {"SMILES_relaxed": "=='CO'"}, "tool": "calculate_data", "answer": -3.94197228761989, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest statistical correlation coefficient (R2) for samples with optimized molecular structure (SMILES_relaxed) {}?"}
{"question": "What is the average formation energy (ef) for bulk_formula As and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='As'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 1.41749, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "For Support1 59, what is the maximum C2-yield?", "refer_dataset": "table20", "column names": ["Support1", "C2-yield"], "condition_column": {"Support1": "="}, "answer_column": {"C2-yield": "max"}, "condition": {"Support1": "=='59'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For Support1 {}, what is the maximum C2-yield?"}
{"question": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > 43.0% in under 40.0 minutes of illumination for pH = 7.0?", "refer_dataset": "table8", "column names": ["Catalyst/Pollutant mass ratio", "Degradation rate(%)", "Illumination time(min)", "pH"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "pH": "="}, "answer_column": {"Catalyst/Pollutant mass ratio": ""}, "condition": {"Degradation rate(%)": ">43.0", "Illumination time(min)": "<40.0", "pH": "=='7.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > {}% in under {} minutes of illumination for pH = {}?"}
{"question": "What is the maximum BandGap(eV) for composites with X1 substitution nan, Sac. Agent1 equal to nan, and Power(W) less than 300.0?", "refer_dataset": "table4", "column names": ["X1", "Sac. Agent1", "Power(W)", "BandGap(eV)"], "condition_column": {"X1": "=", "Sac. Agent1": "=", "Power(W)": "<"}, "answer_column": {"BandGap(eV)": "max"}, "condition": {"X1": "=='nan'", "Sac. Agent1": "=='nan'", "Power(W)": "<300.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum BandGap(eV) for composites with X1 substitution {}, Sac. Agent1 equal to {}, and Power(W) less than {}?"}
{"question": "Calculate the average atomic number of elements in surface -211.0 where carbon species is 3.0 and reaction energy exceeds 1.413.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-211.0'", "b_key": "=='3.0'", "reaction_energy": ">1.413"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "What is the average Cation1-mol for Cation1 3?", "refer_dataset": "table20", "column names": ["Cation1", "Cation1-mol"], "condition_column": {"Cation1": "="}, "answer_column": {"Cation1-mol": "avg"}, "condition": {"Cation1": "=='3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Cation1-mol for Cation1 {}?"}
{"question": "Calculate the minimum CH4-pressure when C2-selectivity is greater than 2.0%?", "refer_dataset": "table20", "column names": ["CH4-pressure", "C2-selectivity"], "condition_column": {"C2-selectivity": ">"}, "answer_column": {"CH4-pressure": "min"}, "condition": {"C2-selectivity": ">2.0"}, "tool": "calculate_data", "answer": 2.7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum CH4-pressure when C2-selectivity is greater than {}%?"}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than -1.40792992183875?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<-1.40792992183875"}, "tool": "calculate_data", "answer": 2.04884424920197, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than 0.1656000000000004?", "refer_dataset": "table54", "column names": ["gap pbe", "mu_b"], "condition_column": {"gap pbe": "<"}, "answer_column": {"mu_b": "max"}, "condition": {"gap pbe": "<0.1656000000000004"}, "tool": "calculate_data", "answer": 55.98974449999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than {}?"}
{"question": "What is the average energy per atom for compounds in the formula MgF2 with an indirect gap below 6.644?", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "energy_per_atom"], "condition_column": {"formula": "=", "indir_gap": "<"}, "answer_column": {"energy_per_atom": "avg"}, "condition": {"formula": "=='MgF2'", "indir_gap": "<6.644"}, "tool": "calculate_data", "answer": -1007.7423096153851, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average energy per atom for compounds in the formula {} with an indirect gap below {}?"}
{"question": "How many Preparations have Contact-times shorter than 5.3 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<5.3"}, "tool": "calculate_data", "answer": 1743, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 0.825128814%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">0.825128814"}, "tool": "calculate_data", "answer": 48.26126007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "For materials with B_AtomN 44, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='44'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above 0.6215?", "refer_dataset": "table9", "column names": ["T, oC", "-log(k), min-1"], "condition_column": {"-log(k), min-1": ">"}, "answer_column": {"T, oC": "avg"}, "condition": {"-log(k), min-1": ">0.6215"}, "tool": "calculate_data", "answer": 28.026455026455025, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above {}?"}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 1.7599321041748.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<1.7599321041748"}, "tool": "calculate_data", "answer": [{"U": 5.85213296706841}, {"U": 4.54692058907546}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 4.28237851192289}, {"U": 3.78009136638114}, {"U": 3.34822214041645}, {"U": 3.59604221522057}, {"U": 3.59705598661295}, {"U": 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1.11910084298124}, {"U": 1.61456854694026}, {"U": 1.60701229212905}, {"U": 1.33528236677951}, {"U": 1.34363552951513}, {"U": 1.61223269223721}, {"U": 1.34519276598383}, {"U": 1.62650648892934}, {"U": 1.62129392725978}, {"U": 1.88609206007332}, {"U": 0.7265936428571}, {"U": 1.23522992366553}, {"U": 1.5090683889987}, {"U": 1.01337598313312}, {"U": 1.52077379064262}, {"U": -0.43341427286817}, {"U": 0.06862465545122}, {"U": 0.33831136113882}, {"U": 0.77490193995407}, {"U": 0.57407591737485}, {"U": 0.84317735298024}, {"U": 1.2810560485389}, {"U": 1.11634693821948}, {"U": 0.79919587399094}, {"U": 1.55600757215339}, {"U": -0.42890717067269}, {"U": 0.07262748476338}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -1.14217756995184 and the HOMO-LUMO gap (gap) is less than 1.94216821965969?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-1.14217756995184", "gap": "<1.94216821965969"}, "tool": "calculate_data", "answer": 1.98432129278939, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is 2-Chlorophenol, temperature (T) is 40°C, and initial concentration (C0) is below 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "C0, mg/L", "-log(k), min-1"], "condition_column": {"OC": "=", "T, oC": "=", "C0, mg/L": "<"}, "answer_column": {"-log(k), min-1": "max"}, "condition": {"OC": "=='2-Chlorophenol'", "T, oC": "=='40'", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is {}, temperature (T) is {}°C, and initial concentration (C0) is below {} mg/L."}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 10.133520126342772?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='10.133520126342772'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > 3.055806?", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": ">"}, "answer_column": {"Band_gap_GGA": "min"}, "condition": {"Band_gap_HSE_optical": ">3.055806"}, "tool": "calculate_data", "answer": 9.123469, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > {}?"}
{"question": "For entries where dipole moment (mu) is below 1.625599980354309, what is the average polarizability (alpha)?", "refer_dataset": "table60", "column names": ["mu", "alpha"], "condition_column": {"mu": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": "<1.625599980354309"}, "tool": "calculate_data", "answer": 62.51447774053291, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For entries where dipole moment (mu) is below {}, what is the average polarizability (alpha)?"}
{"question": "What is the maximum Degradation Rate achieved with Illumination Time under 100 minutes, pH > 7.0, and Dopant C?", "refer_dataset": "table8", "column names": ["Degradation rate(%)", "Illumination time(min)", "pH", "Dopant"], "condition_column": {"Illumination time(min)": "<", "pH": ">", "Dopant": "="}, "answer_column": {"Degradation rate(%)": "max"}, "condition": {"Illumination time(min)": "<100", "pH": ">7.0", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": 100.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Degradation Rate achieved with Illumination Time under {} minutes, pH > {}, and Dopant {}?"}
{"question": "Retrieve the ID with the highest Tc for materials where formula contains Tb1Th3.4Ru0.6B4 and Tc exceeds 0.0.", "refer_dataset": "table65", "column names": ["id", "formula", "Tc"], "condition_column": {"formula": "=", "Tc": ">"}, "answer_column": {"id": "max"}, "condition": {"formula": "=='Tb1Th3.4Ru0.6B4'", "Tc": ">0.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Retrieve the ID with the highest Tc for materials where formula contains {} and Tc exceeds {}."}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 1.94216821965969.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<1.94216821965969"}, "tool": "calculate_data", "answer": [{"U": 6.19311549745637}, {"U": 5.74085587987803}, {"U": 5.85213296706841}, {"U": 4.54692058907546}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 4.1619487412596}, {"U": 4.19426139798513}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 2.9854853300983}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 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0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "Determine the minimum Calcination Temperature required for 70.0% Degradation Rate when pH is 7.0 and Catalyst/Pollutant mass ratio is 20.0.", "refer_dataset": "table8", "column names": ["Calcination temperature(°C)", "Degradation rate(%)", "pH", "Catalyst/Pollutant mass ratio"], "condition_column": {"Degradation rate(%)": "=", "pH": "=", "Catalyst/Pollutant mass ratio": "="}, "answer_column": {"Calcination temperature(°C)": "min"}, "condition": {"Degradation rate(%)": "=='70.0'", "pH": "=='7.0'", "Catalyst/Pollutant mass ratio": "=='20.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Calcination Temperature required for {}% Degradation Rate when pH is {} and Catalyst/Pollutant mass ratio is {}."}
{"question": "How many Preparations have Contact-times shorter than 42.1 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<42.1"}, "tool": "calculate_data", "answer": 1846, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "What is the average Ruthenium content in alloys where Onset potential is greater than 0.562701V?", "refer_dataset": "table15", "column names": ["Ru", "Onset"], "condition_column": {"Onset": ">"}, "answer_column": {"Ru": "avg"}, "condition": {"Onset": ">0.562701"}, "tool": "calculate_data", "answer": 0.5799999999999998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Ruthenium content in alloys where Onset potential is greater than {}V?"}
{"question": "Find the average Eg(eV) for samples calcined at exactly 773.0 K.", "refer_dataset": "table1", "column names": ["Calcination temperature(K)", "Eg(eV)"], "condition_column": {"Calcination temperature(K)": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Calcination temperature(K)": "=='773.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Eg(eV) for samples calcined at exactly {} K."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -0.69666045604944.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-0.69666045604944'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Find the average Eg(eV) for samples calcined at exactly 473.0 K.", "refer_dataset": "table1", "column names": ["Calcination temperature(K)", "Eg(eV)"], "condition_column": {"Calcination temperature(K)": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Calcination temperature(K)": "=='473.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Eg(eV) for samples calcined at exactly {} K."}
{"question": "Calculate the average Alcohol% when Light Type is Hg?", "refer_dataset": "table4", "column names": ["Light Type", "Alcohol%"], "condition_column": {"Light Type": "="}, "answer_column": {"Alcohol%": "avg"}, "condition": {"Light Type": "=='Hg'"}, "tool": "calculate_data", "answer": 7.367766666666668, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Alcohol% when Light Type is {}?"}
{"question": "What is the average Surface Energy (surf_en) for materials with the chemical formula 'GaN'?", "refer_dataset": "table66", "column names": ["formula", "surf_en"], "condition_column": {"formula": "="}, "answer_column": {"surf_en": "avg"}, "condition": {"formula": "=='GaN'"}, "tool": "calculate_data", "answer": 3.2894878416378757, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Energy (surf_en) for materials with the chemical formula '{}'?"}
{"question": "Calculate the maximum loading (g/l) used under a UV–VIS light source.", "refer_dataset": "table10", "column names": ["light source", "loading (g/l)"], "condition_column": {"light source": "="}, "answer_column": {"loading (g/l)": "max"}, "condition": {"light source": "=='UV–VIS'"}, "tool": "calculate_data", "answer": 2.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum loading (g/l) used under a {} light source."}
{"question": "Find the lowest e_hull value for materials where bandgap (gap pbe) is greater than 1.0918 and shear modulus is less than 20.0.", "refer_dataset": "table56", "column names": ["e_hull", "gap pbe", "shear modulus"], "condition_column": {"gap pbe": ">", "shear modulus": "<"}, "answer_column": {"e_hull": "min"}, "condition": {"gap pbe": ">1.0918", "shear modulus": "<20.0"}, "tool": "calculate_data", "answer": 1.2713673600000002, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest e_hull value for materials where bandgap (gap pbe) is greater than {} and shear modulus is less than {}."}
{"question": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below 896.85 K, the electron affinity of element A (EAa) exceeds 41.505 eV, and the hydrogen production rate (RH2) is higher than 30.7 µmol h⁻¹ g⁻¹.", "refer_dataset": "table3", "column names": ["A_Tm", "EAa", "RH2(µmol h-1 g-1)", "χpb"], "condition_column": {"A_Tm": "<", "EAa": ">", "RH2(µmol h-1 g-1)": ">"}, "answer_column": {"χpb": "median"}, "condition": {"A_Tm": "<896.85", "EAa": ">41.505", "RH2(µmol h-1 g-1)": ">30.7"}, "tool": "calculate_data", "answer": [{"χpb": 1.54}, {"χpb": 1.6}, {"χpb": 1.6}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.52}, {"χpb": 1.53}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.55}, {"χpb": 1.51}, {"χpb": 1.54}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below {} K, the electron affinity of element A (EAa) exceeds {} eV, and the hydrogen production rate (RH2) is higher than {} µmol h⁻¹ g⁻¹."}
{"question": "What is the average Degradation efficiency (%) when pH is 12.2?", "refer_dataset": "table6", "column names": ["pH", "Degradation efficiency (%)"], "condition_column": {"pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"pH": "=='12.2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when pH is {}?"}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 8.767508506774902?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='8.767508506774902'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than 2.1521?", "refer_dataset": "table54", "column names": ["gap pbe", "mu_b"], "condition_column": {"gap pbe": "<"}, "answer_column": {"mu_b": "max"}, "condition": {"gap pbe": "<2.1521"}, "tool": "calculate_data", "answer": 55.98974449999999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum magnetic moment (mu_b) in compounds with band gap (gap pbe) less than {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) greater than -1.6533411120312502?", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": ">"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": ">-1.6533411120312502"}, "tool": "calculate_data", "answer": 133.39854437005226, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) greater than {}?"}
{"question": "Determine the average H2 selectivity when Cation1 is Fe, Cation3Amount > 0%, and O2 conv < 20.2%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='Fe'", "Cation3Amount": ">0", "O2 conv": "<20.2"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "Find the highest COx value when C2-yield-class is 2.", "refer_dataset": "table20", "column names": ["COx", "C2-yield-class"], "condition_column": {"C2-yield-class": "="}, "answer_column": {"COx": "max"}, "condition": {"C2-yield-class": "=='2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest COx value when C2-yield-class is {}."}
{"question": "Calculate the average atomic number of elements in surface -211.0 where carbon species is 5.0 and reaction energy exceeds 0.032.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-211.0'", "b_key": "=='5.0'", "reaction_energy": ">0.032"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -1.71824475676759.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-1.71824475676759'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds 81.65 kJ/mol.", "refer_dataset": "table3", "column names": ["ΔfusHa", "B_Tm"], "condition_column": {"ΔfusHa": ">"}, "answer_column": {"B_Tm": "min"}, "condition": {"ΔfusHa": ">81.65"}, "tool": "calculate_data", "answer": 2952.29, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds {} kJ/mol."}
{"question": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is C3H8O?", "refer_dataset": "table4", "column names": ["Sac. Agent1", "Surface Area(m2/g)"], "condition_column": {"Sac. Agent1": "="}, "answer_column": {"Surface Area(m2/g)": "max"}, "condition": {"Sac. Agent1": "=='C3H8O'"}, "tool": "calculate_data", "answer": 9.81, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is {}?"}
{"question": "What is the median O2-pressure when Anion1 is 35?", "refer_dataset": "table20", "column names": ["O2-pressure", "Anion1"], "condition_column": {"Anion1": "="}, "answer_column": {"O2-pressure": "median"}, "condition": {"Anion1": "=='35'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median O2-pressure when Anion1 is {}?"}
{"question": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > 1.134232, synthesized as True, and sourced from CSD?", "refer_dataset": "table62", "column names": ["bandgap", "synthesized", "source", "pld"], "condition_column": {"bandgap": ">", "synthesized": "=", "source": "="}, "answer_column": {"pld": "min"}, "condition": {"bandgap": ">1.134232", "synthesized": "=='True'", "source": "=='CSD'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > {}, synthesized as {}, and sourced from {}?"}
{"question": "What is the median Anion2-mol when CH4-pressure is 0.66?", "refer_dataset": "table20", "column names": ["Anion2-mol", "CH4-pressure"], "condition_column": {"CH4-pressure": "="}, "answer_column": {"Anion2-mol": "median"}, "condition": {"CH4-pressure": "=='0.66'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Anion2-mol when CH4-pressure is {}?"}
{"question": "What is the average calcination temperature (CT) for samples referenced in study [33]?", "refer_dataset": "table11", "column names": ["Ref.", "CT (℃)"], "condition_column": {"Ref.": "="}, "answer_column": {"CT (℃)": "avg"}, "condition": {"Ref.": "=='[33]'"}, "tool": "calculate_data", "answer": 700.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature (CT) for samples referenced in study {}?"}
{"question": "Calculate the average chem_pot for symbol Ir when ef is greater than 1.62107?", "refer_dataset": "table68", "column names": ["symbol", "ef", "chem_pot"], "condition_column": {"symbol": "=", "ef": ">"}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Ir'", "ef": ">1.62107"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {} when ef is greater than {}?"}
{"question": "What is the average Temperature when CH4-conversion% exceeds 15.0%?", "refer_dataset": "table20", "column names": ["Temperature", "CH4-conversion%"], "condition_column": {"CH4-conversion%": ">"}, "answer_column": {"Temperature": "avg"}, "condition": {"CH4-conversion%": ">15.0"}, "tool": "calculate_data", "answer": 1033.1549295774648, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Temperature when CH4-conversion% exceeds {}%?"}
{"question": "What is the highest reaction energy for elements Ni with adsorbed species CH* and activation energy greater than 1.39?", "refer_dataset": "table18", "column names": ["AA", "ab", "activation_energy", "reaction_energy"], "condition_column": {"AA": "=", "ab": "=", "activation_energy": ">"}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Ni'", "ab": "=='CH*'", "activation_energy": ">1.39"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy for elements {} with adsorbed species {} and activation energy greater than {}?"}
{"question": "Identify materials where the ionization energy of element B (I1b) exceeds 7.258 eV, the atomic radius of element B (Rb) is below 62.2 Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than 72.2 kJ/mol. What is their average hydrogen production rate (RH2)?", "refer_dataset": "table3", "column names": ["I1b", "Rb", "ΔfusHa", "RH2(µmol h-1 g-1)"], "condition_column": {"I1b": ">", "Rb": "<", "ΔfusHa": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "avg"}, "condition": {"I1b": ">7.258", "Rb": "<62.2", "ΔfusHa": ">72.2"}, "tool": "calculate_data", "answer": 2.5, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where the ionization energy of element B (I1b) exceeds {} eV, the atomic radius of element B (Rb) is below {} Å, and the enthalpy of fusion for element A (ΔfusHa) is greater than {} kJ/mol. What is their average hydrogen production rate (RH2)?"}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'GaAs'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='GaAs'"}, "tool": "calculate_data", "answer": 3.604, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding 40.0°C?", "refer_dataset": "table7", "column names": ["Synhesis_Temp", "Reactor_Volume"], "condition_column": {"Synhesis_Temp": ">"}, "answer_column": {"Reactor_Volume": "min"}, "condition": {"Synhesis_Temp": ">40.0"}, "tool": "calculate_data", "answer": 1000.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding {}°C?"}
{"question": "What is the highest Surface area (m2/g) observed when Material is MIL-101, Catalyst dosage (g/L) > 0.05, and Degradation efficiency (%) > 19.0?", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Degradation efficiency (%)", "Surface area (m2/g)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Degradation efficiency (%)": ">"}, "answer_column": {"Surface area (m2/g)": "max"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.05", "Degradation efficiency (%)": ">19.0"}, "tool": "calculate_data", "answer": 252.59, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Surface area (m2/g) observed when Material is {}, Catalyst dosage (g/L) > {}, and Degradation efficiency (%) > {}?"}
{"question": "What is the maximum band gap energy for photocatalysts containing none as the noble metal?", "refer_dataset": "table7", "column names": ["Noble_Metal", "Band_gap"], "condition_column": {"Noble_Metal": "="}, "answer_column": {"Band_gap": "max"}, "condition": {"Noble_Metal": "=='none'"}, "tool": "calculate_data", "answer": 5.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum band gap energy for photocatalysts containing {} as the noble metal?"}
{"question": "Calculate the average atomic number of elements in surface -211.0 where carbon species is 3.0 and reaction energy exceeds -0.447.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-211.0'", "b_key": "=='3.0'", "reaction_energy": ">-0.447"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than 1.719?", "refer_dataset": "table2", "column names": ["Ra/Rb", "Eg(eV)"], "condition_column": {"Ra/Rb": ">"}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Ra/Rb": ">1.719"}, "tool": "calculate_data", "answer": 2.949882352941176, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than {}?"}
{"question": "Identify materials where enthalpy (H) is greater than -29.481576919555664, energy gap (gap) is less than 12.0437593460083, and R² spatial extent is above 109.50309753417967. What is their maximum internal energy (U)?", "refer_dataset": "table60", "column names": ["H", "gap", "r2", "U"], "condition_column": {"H": ">", "gap": "<", "r2": ">"}, "answer_column": {"U": "max"}, "condition": {"H": ">-29.481576919555664", "gap": "<12.0437593460083", "r2": ">109.50309753417967"}, "tool": "calculate_data", "answer": -18.64750099182129, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where enthalpy (H) is greater than {}, energy gap (gap) is less than {}, and R² spatial extent is above {}. What is their maximum internal energy (U)?"}
{"question": "What is the average number of atoms per structure in materials with a crystal system of orthorhombic and space group symbol Imma?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='orthorhombic'", "spacegroup_symbol": "=='Imma'"}, "tool": "calculate_data", "answer": 2.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "How many entries have SBET greater than 5.5 m²/g and produce CO as the Main product?", "refer_dataset": "table10", "column names": ["SBET (m2 /g)", "Main product"], "condition_column": {"SBET (m2 /g)": ">"}, "answer_column": {"Main product": "count"}, "condition": {"SBET (m2 /g)": ">5.5"}, "tool": "calculate_data", "answer": 125, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have SBET greater than {} m²/g and produce CO as the Main product?"}
{"question": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"NM\", Space_group_rlx 2, and Band_gap_HSE > 2.587537.", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Space_group_rlx", "Band_gap_HSE", "Band_gap_GGA_optical"], "condition_column": {"Magnetic_ordering": "=", "Space_group_rlx": "=", "Band_gap_HSE": ">"}, "answer_column": {"Band_gap_GGA_optical": "avg"}, "condition": {"Magnetic_ordering": "=='NM'", "Space_group_rlx": "=='2'", "Band_gap_HSE": ">2.587537"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"{}\", Space_group_rlx {}, and Band_gap_HSE > {}."}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 1.48657793094747.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<1.48657793094747"}, "tool": "calculate_data", "answer": [{"U": 5.85213296706841}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 4.28237851192289}, {"U": 3.78009136638114}, {"U": 3.59604221522057}, {"U": 2.92411819429234}, {"U": 3.06909011621485}, {"U": 3.53668171969642}, {"U": 3.36763795283073}, {"U": 3.83280486597178}, {"U": 3.48205825390004}, {"U": 3.84218486416411}, {"U": 3.91996307758737}, {"U": 3.59120067297812}, {"U": 4.04224794538619}, {"U": 2.22476225107403}, {"U": 3.07303546364394}, {"U": 3.00402846301502}, {"U": 3.34725539965568}, {"U": 2.32843082719585}, {"U": 3.10486997561481}, {"U": 2.77914365955695}, {"U": 3.06939058969455}, {"U": 2.29578111761049}, {"U": 2.73295174088221}, {"U": 2.7462483455621}, {"U": 3.20788012289417}, {"U": 2.81559501186372}, {"U": 3.01722055518023}, {"U": 3.53752565825245}, {"U": 3.37981888641644}, {"U": 2.87727568521372}, {"U": 3.31659404066207}, {"U": 3.5800413492234}, {"U": 3.40896742676009}, {"U": 3.67920543596261}, {"U": 3.20486493684571}, {"U": 2.18323681617965}, {"U": 3.19802459276005}, {"U": 3.41227002222391}, {"U": 3.7561109698883}, {"U": 3.50620848322923}, {"U": 3.85279288440392}, {"U": 3.79629603178194}, {"U": 4.07281263030373}, {"U": 4.01220582304204}, {"U": 3.343989383572}, {"U": 3.70197087447231}, {"U": 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0.3400436560696}, {"U": 0.63216919865853}, {"U": 0.79835977387351}, {"U": 1.08664970717376}, {"U": -0.44038003197145}, {"U": 0.01119764144861}, {"U": 0.06577668942625}, {"U": 0.33450710560454}, {"U": 0.76803285492687}, {"U": -0.15131931887545}, {"U": 0.29920277814636}, {"U": 0.34959871272402}, {"U": 0.7867405950542}, {"U": 1.06680278063644}, {"U": 0.08367445756483}, {"U": 0.52587735841829}, {"U": 0.58956205923724}, {"U": 0.85813048101778}, {"U": 1.2816099648667}, {"U": 0.37046724909232}, {"U": 0.81138725882811}, {"U": 0.87010500238699}, {"U": 1.29798446310385}, {"U": 1.57700936197791}, {"U": 0.36226562950298}, {"U": 0.80512434638604}, {"U": 0.8676385070406}, {"U": 1.30082720350309}, {"U": 1.13637937447035}, {"U": 1.56308568220995}, {"U": 0.65170258765182}, {"U": 1.09612376662931}, {"U": 1.15108167247266}, {"U": 1.58341075350193}, {"U": 0.84596783712214}, {"U": 1.13269792114083}, {"U": 1.57455070507011}, {"U": 1.11516594680362}, {"U": 1.55441636911742}, {"U": -0.42337062020763}, {"U": 0.08537017311548}, {"U": 0.35609155269838}, {"U": 0.03447519128023}, {"U": 0.53242768027572}, {"U": 0.79471489992412}, {"U": 1.777190019779}, {"U": 1.84216283734135}, {"U": 2.05515411662908}, {"U": 2.07187611897753}, {"U": 2.16404309285906}, {"U": 2.37747071189557}, {"U": 1.97574812078971}, {"U": 2.28544221709599}, {"U": 2.59587312663074}, {"U": -0.46481505790313}, {"U": 0.02272537181758}, {"U": 0.2923624340607}, {"U": 0.02470065834499}, {"U": 0.49344973792662}, {"U": 0.75029446837317}, {"U": 0.02821227883816}, {"U": 0.51782989478809}, {"U": 0.79154817072939}, {"U": 0.78156199995192}, {"U": 0.51016651464934}, {"U": 0.97053107774094}, {"U": 1.23259620829565}, {"U": 0.51314512131766}, {"U": 0.7839265955965}, {"U": 0.52253034513573}, {"U": 0.99154331881692}, {"U": 1.25255809859912}, {"U": 1.00063068196816}, {"U": 1.27568671809733}, {"U": 0.51222279837563}, {"U": 0.7826306404145}, {"U": 1.24278095285101}, {"U": 1.27492377674018}, {"U": 1.46573227478753}, {"U": 1.72787840254112}, {"U": 1.25718800299935}, {"U": 1.4641384589387}, {"U": 1.72453138925856}, {"U": 1.73750400514295}, {"U": 1.04952424914733}, {"U": 1.51195032159095}, {"U": 1.54291737968999}, {"U": 2.00154964785081}, {"U": 1.99893160935813}, {"U": 0.74577952773909}, {"U": 0.85288133996808}, {"U": 1.05577148471219}, {"U": 1.22325540229632}, {"U": 1.52839797858837}, {"U": 1.2517847059905}, {"U": 1.35575898121776}, {"U": 1.56485978214661}, {"U": 1.22768412010579}, {"U": 1.53960694578757}, {"U": 1.70899037832597}, {"U": 2.01559090419778}, {"U": 1.70760297469362}, {"U": 1.8083974566618}, {"U": 2.02033054673842}, {"U": 1.80642739576012}, {"U": 2.31184730392935}, {"U": 2.09894747309196}, {"U": 2.30945135453036}, {"U": 0.78695484570929}, {"U": 1.26177087676797}, {"U": 1.09546795059971}, {"U": 1.56442605521069}, {"U": 1.27204968258654}, {"U": 1.74523270560338}, {"U": 1.58354661977101}, {"U": 1.82557670126198}, {"U": 2.05182800584945}, {"U": 1.57562457115843}, {"U": 2.0052023602388}, {"U": 1.88527424964596}, {"U": 0.77189981796995}, {"U": 1.26158797986729}, {"U": 1.28404249364582}, {"U": 1.24731418317516}, {"U": 1.7286230542082}, {"U": 1.66401341763435}, {"U": 1.68445345269247}, {"U": 1.68175702981378}, {"U": 1.66775235284695}, {"U": 1.69638355624295}, {"U": 2.15033105093333}, {"U": 1.66656613580536}, {"U": 2.16992976024829}, {"U": 0.89750818373552}, {"U": 1.39497991516349}, {"U": 1.41447149915091}, {"U": 1.41040334951708}, {"U": 1.89166257710565}, {"U": 1.91104442295265}, {"U": 1.91333063421123}, {"U": 1.89792548954772}, {"U": 1.93441342123462}, {"U": 2.3823932513369}, {"U": 1.87871086372419}, {"U": 2.38514454328579}, {"U": 0.05679645160256}, {"U": 0.341940558211}, {"U": 0.32816580877646}, {"U": 0.56508000267395}, {"U": 0.84792744677235}, {"U": 0.82872065938743}, {"U": 0.56060164142}, {"U": 0.83194487046524}, {"U": 0.84336024988093}, {"U": 1.11763766777575}, {"U": 0.82945747261591}, {"U": 1.10670304592758}, {"U": 0.83144582320765}, {"U": 1.10423132495545}, {"U": -0.451758832007}, {"U": 0.05719098634546}, {"U": 0.32545370902057}, {"U": 0.05198626311451}, {"U": 0.83160520479254}, {"U": 0.32289576522383}, {"U": 0.82306914515622}, {"U": 1.10490543067512}, {"U": -0.16529525490075}, {"U": 0.34283675302437}, {"U": 0.61549161412881}, {"U": 0.33741516632545}, {"U": 0.83953247903085}, {"U": 1.12195403463194}, {"U": 1.11910084298124}, {"U": 1.61456854694026}, {"U": 1.60701229212905}, {"U": 1.33528236677951}, {"U": 1.34363552951513}, {"U": 1.61223269223721}, {"U": 1.34519276598383}, {"U": 1.62650648892934}, {"U": 1.62129392725978}, {"U": 1.88609206007332}, {"U": 0.7265936428571}, {"U": 1.23522992366553}, {"U": 1.5090683889987}, {"U": 1.01337598313312}, {"U": 1.52077379064262}, {"U": -0.43341427286817}, {"U": 0.06862465545122}, {"U": 0.33831136113882}, {"U": 0.77490193995407}, {"U": 0.57407591737485}, {"U": 0.84317735298024}, {"U": 1.2810560485389}, {"U": 1.11634693821948}, {"U": 0.79919587399094}, {"U": 1.55600757215339}, {"U": -0.42890717067269}, {"U": 0.07262748476338}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals 6.1e-06?", "refer_dataset": "table67", "column names": ["exfoliation_energy_per_atom", "total_magnetization"], "condition_column": {"total_magnetization": "="}, "answer_column": {"exfoliation_energy_per_atom": "max"}, "condition": {"total_magnetization": "=='6.1e-06'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals {}?"}
{"question": "What is the highest methane conversion rate when Cation1 is Y, Cation2Amount > 70%, and Support is SiO2?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='Y'", "Cation2Amount": ">70", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "Find the average CH4-conversion% for reactions where Cation1 = 58.0, Contact-times > 0.04, and O2-pressure < 0.084.", "refer_dataset": "table20", "column names": ["Cation1", "Contact-times", "O2-pressure", "CH4-conversion%"], "condition_column": {"Cation1": "=", "Contact-times": ">", "O2-pressure": "<"}, "answer_column": {"CH4-conversion%": "avg"}, "condition": {"Cation1": "=='58.0'", "Contact-times": ">0.04", "O2-pressure": "<0.084"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average CH4-conversion% for reactions where Cation1 = {}, Contact-times > {}, and O2-pressure < {}."}
{"question": "Identify compounds where crystal system is orthorhombic and formation energy per atom is less than 0.055. What is their average final energy?", "refer_dataset": "table59", "column names": ["crystal_system", "f_enp", "final_energy"], "condition_column": {"crystal_system": "=", "f_enp": "<"}, "answer_column": {"final_energy": "avg"}, "condition": {"crystal_system": "=='orthorhombic'", "f_enp": "<0.055"}, "tool": "calculate_data", "answer": -97.16964328589513, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify compounds where crystal system is {} and formation energy per atom is less than {}. What is their average final energy?"}
{"question": "Calculate the maximum formation energy per atom for materials with space group number 74.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "max"}, "condition": {"spacegroup_number": "=='74'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum formation energy per atom for materials with space group number {}."}
{"question": "What is the minimum Duration of cycles (h) when B site is Sb?", "refer_dataset": "table5", "column names": ["B site", "Duration of cycles (h)"], "condition_column": {"B site": "="}, "answer_column": {"Duration of cycles (h)": "min"}, "condition": {"B site": "=='Sb'"}, "tool": "calculate_data", "answer": 5.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Duration of cycles (h) when B site is {}?"}
{"question": "How many synthesized compounds have a net magnetic moment above 6.0?", "refer_dataset": "table62", "column names": ["synthesized", "net_magmom"], "condition_column": {"net_magmom": ">"}, "answer_column": {"synthesized": "count"}, "condition": {"net_magmom": ">6.0"}, "tool": "calculate_data", "answer": 291, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many synthesized compounds have a net magnetic moment above {}?"}
{"question": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above 1.495350128.", "refer_dataset": "table51", "column names": ["m06_lumo", "m06_scharber_voc"], "condition_column": {"m06_scharber_voc": ">"}, "answer_column": {"m06_lumo": "min"}, "condition": {"m06_scharber_voc": ">1.495350128"}, "tool": "calculate_data", "answer": 0.024, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the minimum M06 LUMO value for materials with M06 Scharber voltage above {}."}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 5.38 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<5.38"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than 0.1372651699999991.", "refer_dataset": "table56", "column names": ["gap pbe", "e_hull"], "condition_column": {"e_hull": "<"}, "answer_column": {"gap pbe": "max"}, "condition": {"e_hull": "<0.1372651699999991"}, "tool": "calculate_data", "answer": 7.7947, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than {}."}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 3.9292001725187?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">3.9292001725187"}, "tool": "calculate_data", "answer": -2.8232307020853, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "Find the lowest e_hull value for materials where bandgap (gap pbe) is greater than 1.6671 and shear modulus is less than 44.73353525702305.", "refer_dataset": "table56", "column names": ["e_hull", "gap pbe", "shear modulus"], "condition_column": {"gap pbe": ">", "shear modulus": "<"}, "answer_column": {"e_hull": "min"}, "condition": {"gap pbe": ">1.6671", "shear modulus": "<44.73353525702305"}, "tool": "calculate_data", "answer": 1.2713673600000002, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest e_hull value for materials where bandgap (gap pbe) is greater than {} and shear modulus is less than {}."}
{"question": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than 4.52?", "refer_dataset": "table2", "column names": ["ρb", "t"], "condition_column": {"ρb": "<"}, "answer_column": {"t": "avg"}, "condition": {"ρb": "<4.52"}, "tool": "calculate_data", "answer": 0.8813793103448276, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than {}?"}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.41234490060345?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.41234490060345"}, "tool": "calculate_data", "answer": 0.003176159939645416, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to 196.59702621928105?", "refer_dataset": "table54", "column names": ["bulk modulus", "gap pbe"], "condition_column": {"bulk modulus": "="}, "answer_column": {"gap pbe": "avg"}, "condition": {"bulk modulus": "=='196.59702621928105'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to {}?"}
{"question": "Find the highest COx value when C2-yield-class is 3.", "refer_dataset": "table20", "column names": ["COx", "C2-yield-class"], "condition_column": {"C2-yield-class": "="}, "answer_column": {"COx": "max"}, "condition": {"C2-yield-class": "=='3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest COx value when C2-yield-class is {}."}
{"question": "What is the average pH for catalysts where Year is 2003.0?", "refer_dataset": "table12", "column names": ["Year", "pH"], "condition_column": {"Year": "="}, "answer_column": {"pH": "avg"}, "condition": {"Year": "=='2003.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average pH for catalysts where Year is {}?"}
{"question": "What is the highest methane conversion rate when Cation1 is V, Cation2Amount > 70%, and Support is SiO2?", "refer_dataset": "table19", "column names": ["Cation1", "Cation2Amount", "Support", "Temp CH4 conv"], "condition_column": {"Cation1": "=", "Cation2Amount": ">", "Support": "="}, "answer_column": {"Temp CH4 conv": "max"}, "condition": {"Cation1": "=='V'", "Cation2Amount": ">70", "Support": "=='SiO2'"}, "tool": "calculate_data", "answer": 900, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest methane conversion rate when Cation1 is {}, Cation2Amount > {}%, and Support is {}?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than 0.0420409726748?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">0.0420409726748"}, "tool": "calculate_data", "answer": -0.3452858546157117, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "What Light Wavelength achieves Degradation Rate above 70.0% within 40 minutes of Illumination Time for Dopant C?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Degradation rate(%)", "Illumination time(min)", "Dopant"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "Dopant": "="}, "answer_column": {"Light wavelength(nm)": ""}, "condition": {"Degradation rate(%)": ">70.0", "Illumination time(min)": "<40", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": [{"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}, {"Light wavelength(nm)": 425}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Light Wavelength achieves Degradation Rate above {}% within {} minutes of Illumination Time for Dopant {}?"}
{"question": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < -3.2309, scf_vbm > 2.477, and formula is 'ZnSe'.", "refer_dataset": "table66", "column names": ["surf_vbm", "scf_vbm", "formula", "final_energy"], "condition_column": {"surf_vbm": "<", "scf_vbm": ">", "formula": "="}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<-3.2309", "scf_vbm": ">2.477", "formula": "=='ZnSe'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < {}, scf_vbm > {}, and formula is '{}'."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -1.73819887423718.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-1.73819887423718'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > 3.294992?", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": ">"}, "answer_column": {"Band_gap_GGA": "min"}, "condition": {"Band_gap_HSE_optical": ">3.294992"}, "tool": "calculate_data", "answer": 9.123469, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > {}?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -7.13461980636636.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-7.13461980636636"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "What is the total formula_energy for materials where ID contains the substring 1969?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "sum"}, "condition": {"id": "=='1969'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total formula_energy for materials where ID contains the substring {}?"}
{"question": "Calculate the average Surface area (m2/g) when Pore Volume (cm3/g) is below 0.426.", "refer_dataset": "table6", "column names": ["Pore Volume (cm3/g)", "Surface area (m2/g)"], "condition_column": {"Pore Volume (cm3/g)": "<"}, "answer_column": {"Surface area (m2/g)": "avg"}, "condition": {"Pore Volume (cm3/g)": "<0.426"}, "tool": "calculate_data", "answer": 353.8341258741258, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Surface area (m2/g) when Pore Volume (cm3/g) is below {}."}
{"question": "Find the minimum activation energy for adsorbed species CH* on surfaces with key 5 and elements of atomic number 47.", "refer_dataset": "table18", "column names": ["ab", "surfaces_key", "A_AtimicN", "activation_energy"], "condition_column": {"ab": "=", "surfaces_key": "=", "A_AtimicN": "="}, "answer_column": {"activation_energy": "min"}, "condition": {"ab": "=='CH*'", "surfaces_key": "=='5'", "A_AtimicN": "=='47'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum activation energy for adsorbed species {} on surfaces with key {} and elements of atomic number {}."}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 3.355 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<3.355"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > 1.7927, scf_vbm < 7.36, and formula contains 'Be2FeW'?", "refer_dataset": "table66", "column names": ["surf_cbm", "scf_vbm", "formula", "efermi"], "condition_column": {"surf_cbm": ">", "scf_vbm": "<", "formula": "="}, "answer_column": {"efermi": "min"}, "condition": {"surf_cbm": ">1.7927", "scf_vbm": "<7.36", "formula": "=='Be2FeW'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > {}, scf_vbm < {}, and formula contains '{}'?"}
{"question": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is 150?", "refer_dataset": "table6", "column names": ["Illumination time (min)", "Antibiotic dosage (mg/L)"], "condition_column": {"Illumination time (min)": "="}, "answer_column": {"Antibiotic dosage (mg/L)": "min"}, "condition": {"Illumination time (min)": "=='150'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is {}?"}
{"question": "What is the average Light Wavelength used for Calcination Temperatures above 700°C when Pollutant is Phenol?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Calcination temperature(°C)", "Pollutant"], "condition_column": {"Calcination temperature(°C)": ">", "Pollutant": "="}, "answer_column": {"Light wavelength(nm)": "avg"}, "condition": {"Calcination temperature(°C)": ">700", "Pollutant": "=='Phenol'"}, "tool": "calculate_data", "answer": 510.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Light Wavelength used for Calcination Temperatures above {}°C when Pollutant is {}?"}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than -0.37816371587465.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<-0.37816371587465"}, "tool": "calculate_data", "answer": [{"U": 5.85213296706841}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.49215677563079}, {"U": 4.28237851192289}, {"U": 3.48205825390004}, {"U": 3.84218486416411}, {"U": 3.59120067297812}, {"U": 4.04224794538619}, {"U": 2.32843082719585}, {"U": 3.10486997561481}, {"U": 2.87727568521372}, {"U": 3.40896742676009}, {"U": 3.67920543596261}, {"U": 3.50620848322923}, {"U": 3.85279288440392}, {"U": 3.79629603178194}, {"U": 4.01220582304204}, {"U": 3.343989383572}, {"U": 3.48011432112703}, {"U": 2.33181180704568}, {"U": 3.14268260342526}, {"U": 3.11768059710145}, {"U": 2.90524062132865}, {"U": 3.42470701147057}, {"U": 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1.31354115091365}, {"U": 1.58801714258635}, {"U": 1.11684859828993}, {"U": 1.55633156094889}, {"U": 1.85256444536466}, {"U": 0.11299021793197}, {"U": 0.55543349756918}, {"U": 0.39066690536668}, {"U": 0.8340429591974}, {"U": 0.33676457592158}, {"U": 0.62359655964208}, {"U": 0.81073666842424}, {"U": -0.44554817582227}, {"U": -0.16258315514485}, {"U": 0.06106317501428}, {"U": 0.33990517698765}, {"U": 0.78343277396465}, {"U": 0.79941273745889}, {"U": 0.08059656400757}, {"U": 0.35932882784053}, {"U": 0.86475657444835}, {"U": 0.85739105497643}, {"U": 0.81792974224694}, {"U": 1.30886160306894}, {"U": 0.79834932262205}, {"U": 1.30474380999064}, {"U": 1.31076373083608}, {"U": 0.64056416640003}, {"U": 1.14598668738211}, {"U": 1.10216720279056}, {"U": 1.5928508463902}, {"U": 0.83737690841562}, {"U": 1.12472100345804}, {"U": 1.30045618407598}, {"U": 1.58693282524657}, {"U": 1.57058445513809}, {"U": 1.10532086792096}, {"U": 1.57281841013933}, {"U": 0.72422904721251}, {"U": 1.53072338203995}, {"U": 1.51704791949436}, {"U": 0.63216919865853}, {"U": 0.34959871272402}, {"U": 0.08367445756483}, {"U": 0.52587735841829}, {"U": 0.58956205923724}, {"U": 0.85813048101778}, {"U": 0.37046724909232}, {"U": 0.81138725882811}, {"U": 0.87010500238699}, {"U": 1.29798446310385}, {"U": 1.57700936197791}, {"U": 0.36226562950298}, {"U": 0.80512434638604}, {"U": 0.8676385070406}, {"U": 1.30082720350309}, {"U": 0.65170258765182}, {"U": 1.09612376662931}, {"U": 1.15108167247266}, {"U": 1.58341075350193}, {"U": 1.13269792114083}, {"U": 0.08537017311548}, {"U": 0.35609155269838}, {"U": 0.53242768027572}, {"U": 0.79471489992412}, {"U": 1.777190019779}, {"U": 1.84216283734135}, {"U": 2.05515411662908}, {"U": 2.07187611897753}, {"U": 2.16404309285906}, {"U": 2.37747071189557}, {"U": 1.97574812078971}, {"U": 2.28544221709599}, {"U": 2.59587312663074}, {"U": 0.02272537181758}, {"U": 0.2923624340607}, {"U": 0.02470065834499}, {"U": 0.49344973792662}, {"U": 0.75029446837317}, {"U": 0.02821227883816}, {"U": 0.51782989478809}, {"U": 0.79154817072939}, {"U": 0.51016651464934}, {"U": 0.97053107774094}, {"U": 1.23259620829565}, {"U": 0.51314512131766}, {"U": 0.7839265955965}, {"U": 0.52253034513573}, {"U": 0.99154331881692}, {"U": 1.25255809859912}, {"U": 1.00063068196816}, {"U": 1.27568671809733}, {"U": 0.51222279837563}, {"U": 0.7826306404145}, {"U": 1.24278095285101}, {"U": 1.27492377674018}, {"U": 1.46573227478753}, {"U": 1.72787840254112}, {"U": 1.25718800299935}, {"U": 1.4641384589387}, {"U": 1.72453138925856}, {"U": 1.73750400514295}, {"U": 1.04952424914733}, {"U": 1.51195032159095}, {"U": 1.54291737968999}, {"U": 2.00154964785081}, {"U": 1.99893160935813}, {"U": 0.74577952773909}, {"U": 0.85288133996808}, {"U": 1.05577148471219}, {"U": 1.22325540229632}, {"U": 1.52839797858837}, {"U": 1.2517847059905}, {"U": 1.35575898121776}, {"U": 1.56485978214661}, {"U": 1.22768412010579}, {"U": 1.53960694578757}, {"U": 1.70899037832597}, {"U": 2.01559090419778}, {"U": 1.70760297469362}, {"U": 1.8083974566618}, {"U": 2.02033054673842}, {"U": 1.80642739576012}, {"U": 2.31184730392935}, {"U": 2.09894747309196}, {"U": 2.30945135453036}, {"U": 0.78695484570929}, {"U": 1.26177087676797}, {"U": 1.09546795059971}, {"U": 1.56442605521069}, {"U": 1.27204968258654}, {"U": 1.74523270560338}, {"U": 1.58354661977101}, {"U": 1.82557670126198}, {"U": 2.05182800584945}, {"U": 1.57562457115843}, {"U": 2.0052023602388}, {"U": 1.88527424964596}, {"U": 0.77189981796995}, {"U": 1.26158797986729}, {"U": 1.28404249364582}, {"U": 1.24731418317516}, {"U": 1.7286230542082}, {"U": 1.66401341763435}, {"U": 1.68445345269247}, {"U": 1.68175702981378}, {"U": 1.66775235284695}, {"U": 1.69638355624295}, {"U": 2.15033105093333}, {"U": 1.66656613580536}, {"U": 2.16992976024829}, {"U": 0.89750818373552}, {"U": 1.39497991516349}, {"U": 1.41447149915091}, {"U": 1.41040334951708}, {"U": 1.89166257710565}, {"U": 1.91104442295265}, {"U": 1.91333063421123}, {"U": 1.89792548954772}, {"U": 1.93441342123462}, {"U": 2.3823932513369}, {"U": 1.87871086372419}, {"U": 2.38514454328579}, {"U": 0.05679645160256}, {"U": 0.341940558211}, {"U": 0.32816580877646}, {"U": 0.56508000267395}, {"U": 0.84792744677235}, {"U": 0.82872065938743}, {"U": 0.56060164142}, {"U": 0.84336024988093}, {"U": 1.11763766777575}, {"U": 0.82945747261591}, {"U": 1.10670304592758}, {"U": 0.83144582320765}, {"U": 1.10423132495545}, {"U": 0.32545370902057}, {"U": 0.32289576522383}, {"U": 1.10490543067512}, {"U": 0.34283675302437}, {"U": 0.61549161412881}, {"U": 0.33741516632545}, {"U": 0.83953247903085}, {"U": 1.12195403463194}, {"U": 1.11910084298124}, {"U": 1.61456854694026}, {"U": 1.60701229212905}, {"U": 1.33528236677951}, {"U": 1.34363552951513}, {"U": 1.61223269223721}, {"U": 1.34519276598383}, {"U": 1.62650648892934}, {"U": 1.62129392725978}, {"U": 1.88609206007332}, {"U": 0.7265936428571}, {"U": 1.23522992366553}, {"U": 1.5090683889987}, {"U": -0.43341427286817}, {"U": 0.06862465545122}, {"U": 0.57407591737485}, {"U": 1.11634693821948}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.52441679602566}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 80.0?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">80.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "Determine the minimum pH where Material is Ag2S-MIL-53-Fe, Surface area (m2/g) > 199.307, and Pore Volume (cm3/g) < 0.426.", "refer_dataset": "table6", "column names": ["Material", "Surface area (m2/g)", "Pore Volume (cm3/g)", "pH"], "condition_column": {"Material": "=", "Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<"}, "answer_column": {"pH": "min"}, "condition": {"Material": "=='Ag2S-MIL-53-Fe'", "Surface area (m2/g)": ">199.307", "Pore Volume (cm3/g)": "<0.426"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum pH where Material is {}, Surface area (m2/g) > {}, and Pore Volume (cm3/g) < {}."}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 2.0 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<2.0"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above -5.154133360427776?", "refer_dataset": "table54", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"elastic anisotropy": ">"}, "answer_column": {"gap pbe": "min"}, "condition": {"elastic anisotropy": ">-5.154133360427776"}, "tool": "calculate_data", "answer": 11.803, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum band gap (gap pbe) for materials with elastic anisotropy above {}?"}
{"question": "Determine the minimum Calcination Temperature required for 62.0% Degradation Rate when pH is 7.0 and Catalyst/Pollutant mass ratio is 20.0.", "refer_dataset": "table8", "column names": ["Calcination temperature(°C)", "Degradation rate(%)", "pH", "Catalyst/Pollutant mass ratio"], "condition_column": {"Degradation rate(%)": "=", "pH": "=", "Catalyst/Pollutant mass ratio": "="}, "answer_column": {"Calcination temperature(°C)": "min"}, "condition": {"Degradation rate(%)": "=='62.0'", "pH": "=='7.0'", "Catalyst/Pollutant mass ratio": "=='20.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Calcination Temperature required for {}% Degradation Rate when pH is {} and Catalyst/Pollutant mass ratio is {}."}
{"question": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"NM\", Space_group_rlx 122, and Band_gap_HSE > 3.055806.", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "Space_group_rlx", "Band_gap_HSE", "Band_gap_GGA_optical"], "condition_column": {"Magnetic_ordering": "=", "Space_group_rlx": "=", "Band_gap_HSE": ">"}, "answer_column": {"Band_gap_GGA_optical": "avg"}, "condition": {"Magnetic_ordering": "=='NM'", "Space_group_rlx": "=='122'", "Band_gap_HSE": ">3.055806"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA_optical where Magnetic_ordering is \"{}\", Space_group_rlx {}, and Band_gap_HSE > {}."}
{"question": "What is the minimum desorption temperature (DT) observed for samples aged over 3 hours?", "refer_dataset": "table11", "column names": ["AH (h)", "DT (℃)"], "condition_column": {"AH (h)": ">"}, "answer_column": {"DT (℃)": "min"}, "condition": {"AH (h)": ">3"}, "tool": "calculate_data", "answer": 300, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum desorption temperature (DT) observed for samples aged over {} hours?"}
{"question": "What is the maximum Onset potential for alloys where Platinum > 24.1%, Ruthenium < 44.1%, and Palladium > 15.8%?", "refer_dataset": "table15", "column names": ["Pt", "Ru", "Pd", "Onset"], "condition_column": {"Pt": ">", "Ru": "<", "Pd": ">"}, "answer_column": {"Onset": "max"}, "condition": {"Pt": ">24.1", "Ru": "<44.1", "Pd": ">15.8"}, "tool": "calculate_data", "answer": 0.600639, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Onset potential for alloys where Platinum > {}%, Ruthenium < {}%, and Palladium > {}%?"}
{"question": "What is the average bandgap for materials with a topology classification of dmd?", "refer_dataset": "table62", "column names": ["topology", "bandgap"], "condition_column": {"topology": "="}, "answer_column": {"bandgap": "avg"}, "condition": {"topology": "=='dmd'"}, "tool": "calculate_data", "answer": 2.4989865833333336, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bandgap for materials with a topology classification of {}?"}
{"question": "How many atoms do structures with a final energy greater than -21.52884660210856 typically have?", "refer_dataset": "table59", "column names": ["final_energy", "natoms"], "condition_column": {"final_energy": ">"}, "answer_column": {"natoms": "count"}, "condition": {"final_energy": ">-21.52884660210856"}, "tool": "calculate_data", "answer": 744, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many atoms do structures with a final energy greater than {} typically have?"}
{"question": "What is the minimum e_hull value for materials with bulk modulus exceeding 84.16972454847519?", "refer_dataset": "table56", "column names": ["e_hull", "bulk modulus"], "condition_column": {"bulk modulus": ">"}, "answer_column": {"e_hull": "min"}, "condition": {"bulk modulus": ">84.16972454847519"}, "tool": "calculate_data", "answer": 2.2571706762500003, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum e_hull value for materials with bulk modulus exceeding {}?"}
{"question": "How many entries have a wycoff position of d?", "refer_dataset": "table68", "column names": ["wycoff", "jid"], "condition_column": {"wycoff": "="}, "answer_column": {"jid": "count"}, "condition": {"wycoff": "=='d'"}, "tool": "calculate_data", "answer": 59, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many entries have a wycoff position of {}?"}
{"question": "What is the highest First Ionization Energy of B (I1b) observed in materials with EAa greater than 9.03, EAb less than 13.27, and ρa exceeding 2.99?", "refer_dataset": "table2", "column names": ["EAa", "EAb", "ρa", "I1b"], "condition_column": {"EAa": ">", "EAb": "<", "ρa": ">"}, "answer_column": {"I1b": "max"}, "condition": {"EAa": ">9.03", "EAb": "<13.27", "ρa": ">2.99"}, "tool": "calculate_data", "answer": 6.836, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest First Ionization Energy of B (I1b) observed in materials with EAa greater than {}, EAb less than {}, and ρa exceeding {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than -0.3393416995238088?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.3393416995238088"}, "tool": "calculate_data", "answer": 125.46995111686115, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "What is the highest density for materials with pretty_formula equal to TeO3?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='TeO3'"}, "tool": "calculate_data", "answer": 1.3241628266469725, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "Find the minimum activation energy for adsorbed species CH* on surfaces with key 5 and elements of atomic number 45.", "refer_dataset": "table18", "column names": ["ab", "surfaces_key", "A_AtimicN", "activation_energy"], "condition_column": {"ab": "=", "surfaces_key": "=", "A_AtimicN": "="}, "answer_column": {"activation_energy": "min"}, "condition": {"ab": "=='CH*'", "surfaces_key": "=='5'", "A_AtimicN": "=='45'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum activation energy for adsorbed species {} on surfaces with key {} and elements of atomic number {}."}
{"question": "What is the total formula_energy for materials where ID contains the substring 1267?", "refer_dataset": "table64", "column names": ["id", "formula_energy"], "condition_column": {"id": "="}, "answer_column": {"formula_energy": "sum"}, "condition": {"id": "=='1267'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total formula_energy for materials where ID contains the substring {}?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Direct\", Band_gap_HSE_optical < 1.229253, and Magnetic_ordering \"NM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Direct'", "Band_gap_HSE_optical": "<1.229253", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 0.041666}, {"Band_gap_GGA": 0.227571}, {"Band_gap_GGA": 0.059662}, {"Band_gap_GGA": 0.284829}, {"Band_gap_GGA": 0.178726}, {"Band_gap_GGA": 0.1042529999999999}, {"Band_gap_GGA": 0.480542}, {"Band_gap_GGA": 0.207128}, {"Band_gap_GGA": 0.240682}, {"Band_gap_GGA": 0.03858}, {"Band_gap_GGA": 0.152983}, {"Band_gap_GGA": 0.106556}, {"Band_gap_GGA": 0.138406}, {"Band_gap_GGA": 0.010467}, {"Band_gap_GGA": 0.464569}, {"Band_gap_GGA": 0.458572}, {"Band_gap_GGA": 0.2903539999999998}, {"Band_gap_GGA": 0.379631}, {"Band_gap_GGA": 0.288977}, {"Band_gap_GGA": 0.533118}, {"Band_gap_GGA": 0.135669}, {"Band_gap_GGA": 0.242306}, {"Band_gap_GGA": 0.455467}, {"Band_gap_GGA": 0.5743109999999998}, {"Band_gap_GGA": 0.240142}, {"Band_gap_GGA": 0.183234}, {"Band_gap_GGA": 0.1812}, {"Band_gap_GGA": 0.124343}, {"Band_gap_GGA": 0.525212}, {"Band_gap_GGA": 0.1012110000000001}, {"Band_gap_GGA": 0.7109800000000002}, {"Band_gap_GGA": 0.11566}, {"Band_gap_GGA": 0.163075}, {"Band_gap_GGA": 0.095012}, {"Band_gap_GGA": 0.576212}, {"Band_gap_GGA": 0.0501729999999991}, {"Band_gap_GGA": 0.1281699999999999}, {"Band_gap_GGA": 0.3171189999999999}, {"Band_gap_GGA": 0.3831039999999999}, {"Band_gap_GGA": 0.617981}, {"Band_gap_GGA": 0.203862}, {"Band_gap_GGA": 0.343373}, {"Band_gap_GGA": 0.525407}, {"Band_gap_GGA": 0.1007060000000001}, {"Band_gap_GGA": 0.1350280000000001}, {"Band_gap_GGA": 0.525745}, {"Band_gap_GGA": 0.335461}, {"Band_gap_GGA": 0.202096}, {"Band_gap_GGA": 0.485755}, {"Band_gap_GGA": 0.0156169999999997}, {"Band_gap_GGA": 0.296561}, {"Band_gap_GGA": 0.131433}, {"Band_gap_GGA": 0.53058}, {"Band_gap_GGA": 0.367797}, {"Band_gap_GGA": 0.175978}, {"Band_gap_GGA": 0.067083}, {"Band_gap_GGA": 0.50262}, {"Band_gap_GGA": 0.516517}, {"Band_gap_GGA": 0.274882}, {"Band_gap_GGA": 0.412032}, {"Band_gap_GGA": 0.162911}, {"Band_gap_GGA": 0.1764369999999999}, {"Band_gap_GGA": 0.522287}, {"Band_gap_GGA": 0.441558}, {"Band_gap_GGA": 0.1617000000000001}, {"Band_gap_GGA": 0.2272}, {"Band_gap_GGA": 0.2496929999999997}, {"Band_gap_GGA": 0.276941}, {"Band_gap_GGA": 0.055628}, {"Band_gap_GGA": 0.5459970000000007}, {"Band_gap_GGA": 0.096644}, {"Band_gap_GGA": 0.3041240000000007}, {"Band_gap_GGA": 0.4508980000000004}, {"Band_gap_GGA": 0.176768}, {"Band_gap_GGA": 0.426338}, {"Band_gap_GGA": 0.076361}, {"Band_gap_GGA": 0.0880399999999999}, {"Band_gap_GGA": 0.052264}, {"Band_gap_GGA": 0.2383199999999998}, {"Band_gap_GGA": 0.481597}, {"Band_gap_GGA": 0.3921559999999999}, {"Band_gap_GGA": 0.574063}, {"Band_gap_GGA": 0.531585}, {"Band_gap_GGA": 0.213682}, {"Band_gap_GGA": 0.143524}, {"Band_gap_GGA": 0.086018}, {"Band_gap_GGA": 0.3410599999999997}, {"Band_gap_GGA": 0.026395}, {"Band_gap_GGA": 0.177484}, {"Band_gap_GGA": 0.596343}, {"Band_gap_GGA": 0.763741}, {"Band_gap_GGA": 0.687912}, {"Band_gap_GGA": 0.622552}, {"Band_gap_GGA": 0.191293}, {"Band_gap_GGA": 0.089123}, {"Band_gap_GGA": 0.08064}, {"Band_gap_GGA": 0.139055}, {"Band_gap_GGA": 0.688163}, {"Band_gap_GGA": 0.229379}, {"Band_gap_GGA": 0.076168}, {"Band_gap_GGA": 0.053609}, {"Band_gap_GGA": 0.7076389999999999}, {"Band_gap_GGA": 0.566589}, {"Band_gap_GGA": 0.598213}, {"Band_gap_GGA": 0.323051}, {"Band_gap_GGA": 0.557067}, {"Band_gap_GGA": 0.419048}, {"Band_gap_GGA": 0.066141}, {"Band_gap_GGA": 0.337935}, {"Band_gap_GGA": 0.229184}, {"Band_gap_GGA": 0.062749}, {"Band_gap_GGA": 0.107766}, {"Band_gap_GGA": 0.0562809999999998}, {"Band_gap_GGA": 0.067216}, {"Band_gap_GGA": 0.019902}, {"Band_gap_GGA": 0.314184}, {"Band_gap_GGA": 0.486282}, {"Band_gap_GGA": 0.233836}, {"Band_gap_GGA": 0.16959}, {"Band_gap_GGA": 0.064657}, {"Band_gap_GGA": 0.3010500000000005}, {"Band_gap_GGA": 0.593264}, {"Band_gap_GGA": 0.357758}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "Identify compounds where crystal system is monoclinic and formation energy per atom is less than -2.0751. What is their average final energy?", "refer_dataset": "table59", "column names": ["crystal_system", "f_enp", "final_energy"], "condition_column": {"crystal_system": "=", "f_enp": "<"}, "answer_column": {"final_energy": "avg"}, "condition": {"crystal_system": "=='monoclinic'", "f_enp": "<-2.0751"}, "tool": "calculate_data", "answer": -98.76971517041179, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify compounds where crystal system is {} and formation energy per atom is less than {}. What is their average final energy?"}
{"question": "What is the maximum final energy (final_energy) where surface valence band maximum (surf_vbm) is below -0.8432?", "refer_dataset": "table66", "column names": ["surf_vbm", "final_energy"], "condition_column": {"surf_vbm": "<"}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<-0.8432"}, "tool": "calculate_data", "answer": 44.39983435, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum final energy (final_energy) where surface valence band maximum (surf_vbm) is below {}?"}
{"question": "What is the maximum pH recorded for Pollutant Phenol under Light Wavelength 580 nm?", "refer_dataset": "table8", "column names": ["Pollutant", "Light wavelength(nm)", "pH"], "condition_column": {"Pollutant": "=", "Light wavelength(nm)": "<"}, "answer_column": {"pH": "max"}, "condition": {"Pollutant": "=='Phenol'", "Light wavelength(nm)": "<580"}, "tool": "calculate_data", "answer": 8.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH recorded for Pollutant {} under Light Wavelength {} nm?"}
{"question": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of 0.05, Illumination time (min) > 10.0, and Antibiotic dosage (mg/L) < 50.0.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Illumination time (min)", "Antibiotic dosage (mg/L)", "Degradation efficiency (%)"], "condition_column": {"Catalyst dosage (g/L)": "=", "Illumination time (min)": ">", "Antibiotic dosage (mg/L)": "<"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"Catalyst dosage (g/L)": "=='0.05'", "Illumination time (min)": ">10.0", "Antibiotic dosage (mg/L)": "<50.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of {}, Illumination time (min) > {}, and Antibiotic dosage (mg/L) < {}."}
{"question": "What is the average BandGap(eV) for materials where B is In?", "refer_dataset": "table4", "column names": ["B", "BandGap(eV)"], "condition_column": {"B": "="}, "answer_column": {"BandGap(eV)": "avg"}, "condition": {"B": "=='In'"}, "tool": "calculate_data", "answer": 2.6113095238095236, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average BandGap(eV) for materials where B is {}?"}
{"question": "What is the highest Lattice Parameter observed when A_AtomN is 51.0, B_AtomN > 83.0, and Volume < 71.0530211546?", "refer_dataset": "table22", "column names": ["A_AtomN", "B_AtomN", "Volume", "Lattice"], "condition_column": {"A_AtomN": "=", "B_AtomN": ">", "Volume": "<"}, "answer_column": {"Lattice": "max"}, "condition": {"A_AtomN": "=='51.0'", "B_AtomN": ">83.0", "Volume": "<71.0530211546"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Lattice Parameter observed when A_AtomN is {}, B_AtomN > {}, and Volume < {}?"}
{"question": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than 11.937.", "refer_dataset": "table66", "column names": ["scf_vbm", "efermi"], "condition_column": {"scf_vbm": ">"}, "answer_column": {"efermi": "min"}, "condition": {"scf_vbm": ">11.937"}, "tool": "calculate_data", "answer": 2.85569339, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Fermi energy level (efermi) for materials where SCF valence band maximum (scf_vbm) is greater than {}."}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than 0.20136633895406?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<0.20136633895406"}, "tool": "calculate_data", "answer": 2.04884424920197, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "What is the average Temperature when CH4-conversion% exceeds 8.4%?", "refer_dataset": "table20", "column names": ["Temperature", "CH4-conversion%"], "condition_column": {"CH4-conversion%": ">"}, "answer_column": {"Temperature": "avg"}, "condition": {"CH4-conversion%": ">8.4"}, "tool": "calculate_data", "answer": 1030.6825712392313, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Temperature when CH4-conversion% exceeds {}%?"}
{"question": "Materials with bandgap of 1.9866, what is their total energy per atom?", "refer_dataset": "table67", "column names": ["bandgap", "energy_per_atom"], "condition_column": {"bandgap": "="}, "answer_column": {"energy_per_atom": "sum"}, "condition": {"bandgap": "=='1.9866'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Materials with bandgap of {}, what is their total energy per atom?"}
{"question": "What is the total sum of optb88vdw_cbm values where offset equals -0.31134686625131147?", "refer_dataset": "table52", "column names": ["optb88vdw_cbm", "offset"], "condition_column": {"offset": "="}, "answer_column": {"optb88vdw_cbm": "sum"}, "condition": {"offset": "=='-0.31134686625131147'"}, "tool": "calculate_data", "answer": 4.5854, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total sum of optb88vdw_cbm values where offset equals {}?"}
{"question": "What is the highest Bandgap (Eg) observed in experiments where the Main product is methanol?", "refer_dataset": "table10", "column names": ["Main product", "Eg(eV)"], "condition_column": {"Main product": "="}, "answer_column": {"Eg(eV)": "max"}, "condition": {"Main product": "=='methanol'"}, "tool": "calculate_data", "answer": 2.98, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Bandgap (Eg) observed in experiments where the Main product is {}?"}
{"question": "Find the average Eg(eV) for samples calcined at exactly 1023.0 K.", "refer_dataset": "table1", "column names": ["Calcination temperature(K)", "Eg(eV)"], "condition_column": {"Calcination temperature(K)": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Calcination temperature(K)": "=='1023.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Eg(eV) for samples calcined at exactly {} K."}
{"question": "What is the average irradiation time (h) for experiments using a Visible light source?", "refer_dataset": "table10", "column names": ["light source", "irradiation time(h)"], "condition_column": {"light source": "="}, "answer_column": {"irradiation time(h)": "avg"}, "condition": {"light source": "=='Visible'"}, "tool": "calculate_data", "answer": 4.89873417721519, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average irradiation time (h) for experiments using a {} light source?"}
{"question": "Calculate the average chem_pot for symbol K?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='K'"}, "tool": "calculate_data", "answer": 1.232342, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN 7.0, Bn (count of B) 1.0, and Formation Energy ≤ 1.22?", "refer_dataset": "table22", "column names": ["C_AtomN", "Bn", "Formation_E", "Volume"], "condition_column": {"C_AtomN": "=", "Bn": "=", "Formation_E": "<="}, "answer_column": {"Volume": "min"}, "condition": {"C_AtomN": "=='7.0'", "Bn": "=='1.0'", "Formation_E": "<=1.22"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN {}, Bn (count of B) {}, and Formation Energy ≤ {}?"}
{"question": "For materials with B_AtomN 73, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='73'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than 51?", "refer_dataset": "table22", "column names": ["B_AtomN", "Direct_Band"], "condition_column": {"B_AtomN": ">"}, "answer_column": {"Direct_Band": "max"}, "condition": {"B_AtomN": ">51"}, "tool": "calculate_data", "answer": 4.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Direct Bandgap observed in materials with B_AtomN greater than {}?"}
{"question": "What is the maximum BandGap(eV) for composites with X1 substitution N, Sac. Agent1 equal to HCOOH, and Power(W) less than 300.0?", "refer_dataset": "table4", "column names": ["X1", "Sac. Agent1", "Power(W)", "BandGap(eV)"], "condition_column": {"X1": "=", "Sac. Agent1": "=", "Power(W)": "<"}, "answer_column": {"BandGap(eV)": "max"}, "condition": {"X1": "=='N'", "Sac. Agent1": "=='HCOOH'", "Power(W)": "<300.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum BandGap(eV) for composites with X1 substitution {}, Sac. Agent1 equal to {}, and Power(W) less than {}?"}
{"question": "What is the average bandgap for materials with a topology classification of cpr?", "refer_dataset": "table62", "column names": ["topology", "bandgap"], "condition_column": {"topology": "="}, "answer_column": {"bandgap": "avg"}, "condition": {"topology": "=='cpr'"}, "tool": "calculate_data", "answer": 2.5533174, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bandgap for materials with a topology classification of {}?"}
{"question": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is 3.9641769879?", "refer_dataset": "table22", "column names": ["Lattice", "D_AtomN"], "condition_column": {"Lattice": "="}, "answer_column": {"D_AtomN": "median"}, "condition": {"Lattice": "=='3.9641769879'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is {}?"}
{"question": "What is the average methane conversion rate when Cation1 is Ni?", "refer_dataset": "table19", "column names": ["Cation1", "Temp CH4 conv"], "condition_column": {"Cation1": "="}, "answer_column": {"Temp CH4 conv": "avg"}, "condition": {"Cation1": "=='Ni'"}, "tool": "calculate_data", "answer": 750.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average methane conversion rate when Cation1 is {}?"}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 1.68 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<1.68"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "What is the highest C.E. % for Material Re bpy(CO3)Cl when Surface Strain is 0.0?", "refer_dataset": "table12", "column names": ["Material", "Surface Strain", "C.E. %"], "condition_column": {"Material": "=", "Surface Strain": "="}, "answer_column": {"C.E. %": "max"}, "condition": {"Material": "=='Re bpy(CO3)Cl'", "Surface Strain": "=='0.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest C.E. % for Material {} when Surface Strain is {}?"}
{"question": "What is the highest SSA observed when CT exceeds 500°C and preparation method is 1?", "refer_dataset": "table11", "column names": ["CT (℃)", "PM", "SSA (m2 g -1 )"], "condition_column": {"CT (℃)": ">", "PM": "="}, "answer_column": {"SSA (m2 g -1 )": "avg"}, "condition": {"CT (℃)": ">500", "PM": "=='1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SSA observed when CT exceeds {}°C and preparation method is {}?"}
{"question": "Determine the total CO yield (COy) when Support_ID is 4 and M1_atom_number is less than 25.", "refer_dataset": "table17", "column names": ["Support_ID", "M1_atom_number", "COy"], "condition_column": {"Support_ID": "=", "M1_atom_number": "<"}, "answer_column": {"COy": "sum"}, "condition": {"Support_ID": "=='4'", "M1_atom_number": "<25"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total CO yield (COy) when Support_ID is {} and M1_atom_number is less than {}."}
{"question": "Calculate the average C2 yield (%) for catalysts with primary metal K, secondary metal V, and support material BaO–La2O3.", "refer_dataset": "table21", "column names": ["M1", "M2", "Support", "C2 yield (%)"], "condition_column": {"M1": "=", "M2": "=", "Support": "="}, "answer_column": {"C2 yield (%)": "avg"}, "condition": {"M1": "=='K'", "M2": "=='V'", "Support": "=='BaO–La2O3'"}, "tool": "calculate_data", "answer": 10.934183409265959, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average C2 yield (%) for catalysts with primary metal {}, secondary metal {}, and support material {}."}
{"question": "Calculate the average atomic number of elements in surface -111.0 where carbon species is 3.0 and reaction energy exceeds 1.426.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-111.0'", "b_key": "=='3.0'", "reaction_energy": ">1.426"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "For entries where dipole moment (mu) is below 0.0896999984979629, what is the average polarizability (alpha)?", "refer_dataset": "table60", "column names": ["mu", "alpha"], "condition_column": {"mu": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": "<0.0896999984979629"}, "tool": "calculate_data", "answer": 60.40848474791556, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For entries where dipole moment (mu) is below {}, what is the average polarizability (alpha)?"}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below 2.969990679614116?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<2.969990679614116"}, "tool": "calculate_data", "answer": 20.232, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < 0.2863, scf_vbm > 9.168, and formula is 'AlN'.", "refer_dataset": "table66", "column names": ["surf_vbm", "scf_vbm", "formula", "final_energy"], "condition_column": {"surf_vbm": "<", "scf_vbm": ">", "formula": "="}, "answer_column": {"final_energy": "max"}, "condition": {"surf_vbm": "<0.2863", "scf_vbm": ">9.168", "formula": "=='AlN'"}, "tool": "calculate_data", "answer": -140.63968855, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum final energy (final_energy) for structures where surface valence band maximum (surf_vbm) < {}, scf_vbm > {}, and formula is '{}'."}
{"question": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below 117.7980801890949.", "refer_dataset": "table56", "column names": ["mu_b", "shear modulus"], "condition_column": {"shear modulus": "<"}, "answer_column": {"mu_b": "avg"}, "condition": {"shear modulus": "<117.7980801890949"}, "tool": "calculate_data", "answer": 0.4459253265734266, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average magnetic moment (mu_b) for materials where shear modulus is below {}."}
{"question": "What is the number of articles from CA 93106 USA country that triggered an OER data warning?", "refer_dataset": "table13", "column names": ["Country", "Warning_OER.1"], "condition_column": {"Country": "="}, "answer_column": {"Warning_OER.1": "count"}, "condition": {"Country": "=='CA 93106 USA'"}, "tool": "calculate_data", "answer": 1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the number of articles from {} country that triggered an OER data warning?"}
{"question": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding 0.0009920999999999?", "refer_dataset": "table54", "column names": ["mu_b", "shear modulus"], "condition_column": {"mu_b": ">"}, "answer_column": {"shear modulus": "max"}, "condition": {"mu_b": ">0.0009920999999999"}, "tool": "calculate_data", "answer": 213.9683850846991, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding {}?"}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below -0.6812256643469425?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<-0.6812256643469425"}, "tool": "calculate_data", "answer": 5.171, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than 4.10148724644?", "refer_dataset": "table51", "column names": ["pbe0_homo", "pbe0_scharber_pce"], "condition_column": {"pbe0_scharber_pce": "<"}, "answer_column": {"pbe0_homo": "max"}, "condition": {"pbe0_scharber_pce": "<4.10148724644"}, "tool": "calculate_data", "answer": -0.173, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PBE0 Scharber power conversion efficiency when PBE0 HOMO energy level is less than {}?"}
{"question": "What is the average number of atoms per structure in materials with a crystal system of hexagonal and space group symbol P6/mmm?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='hexagonal'", "spacegroup_symbol": "=='P6/mmm'"}, "tool": "calculate_data", "answer": 2.7046413502109705, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds 49.12 kJ/mol.", "refer_dataset": "table3", "column names": ["ΔfusHa", "B_Tm"], "condition_column": {"ΔfusHa": ">"}, "answer_column": {"B_Tm": "min"}, "condition": {"ΔfusHa": ">49.12"}, "tool": "calculate_data", "answer": 2952.29, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds {} kJ/mol."}
{"question": "Find the median ProdRate(μmol/g) when B1 is nan, CatW(g/L) equals 1.0, and Surface Area(m2/g) exceeds 4.5.", "refer_dataset": "table4", "column names": ["B1", "CatW(g/L)", "Surface Area(m2/g)", "ProdRate(μmol/g)"], "condition_column": {"B1": "=", "CatW(g/L)": "=", "Surface Area(m2/g)": ">"}, "answer_column": {"ProdRate(μmol/g)": "median"}, "condition": {"B1": "=='nan'", "CatW(g/L)": "=='1.0'", "Surface Area(m2/g)": ">4.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median ProdRate(μmol/g) when B1 is {}, CatW(g/L) equals {}, and Surface Area(m2/g) exceeds {}."}
{"question": "What is the average bulk_energy for bulk_formula Cu?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Cu'"}, "tool": "calculate_data", "answer": 60.7932, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "Calculate the median Palladium percentage for alloys where Gold percentage is under 13.5%.", "refer_dataset": "table15", "column names": ["Pd", "Au"], "condition_column": {"Au": "<"}, "answer_column": {"Pd": "median"}, "condition": {"Au": "<13.5"}, "tool": "calculate_data", "answer": [{"Pd": 15.2}, {"Pd": 16.8}, {"Pd": 15.8}, {"Pd": 7.6}, {"Pd": 12.8}, {"Pd": 8.7}, {"Pd": 6.0}, {"Pd": 4.8}, {"Pd": 7.0}, {"Pd": 27.9}, {"Pd": 29.7}, {"Pd": 0.3}, {"Pd": 2.3}, {"Pd": 4.7}, {"Pd": 9.6}, {"Pd": 8.0}, {"Pd": 10.2}, {"Pd": 25.1}, {"Pd": 20.1}, {"Pd": 25.2}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 1.4}, {"Pd": 0.6}, {"Pd": 0.8}, {"Pd": 2.4}, {"Pd": 1.2}, {"Pd": 2.6}, {"Pd": 5.8}, {"Pd": 7.5}, {"Pd": 9.4}, {"Pd": 39.7}, {"Pd": 42.7}, {"Pd": 40.2}, {"Pd": 9.7}, {"Pd": 9.8}, {"Pd": 9.1}, {"Pd": 8.6}, {"Pd": 3.1}, {"Pd": 2.9}, {"Pd": 3.3}, {"Pd": 3.3}, {"Pd": 2.6}, {"Pd": 1.1}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 5.2}, {"Pd": 5.0}, {"Pd": 9.8}, {"Pd": 47.1}, {"Pd": 46.9}, {"Pd": 49.8}, {"Pd": 15.8}, {"Pd": 17.8}, {"Pd": 16.8}, {"Pd": 4.3}, {"Pd": 7.0}, {"Pd": 5.0}, {"Pd": 34.9}, {"Pd": 39.2}, {"Pd": 35.1}, {"Pd": 72.8}, {"Pd": 72.0}, {"Pd": 70.7}, {"Pd": 10.2}, {"Pd": 9.6}, {"Pd": 10.2}, {"Pd": 3.4}, {"Pd": 4.0}, {"Pd": 2.4}, {"Pd": 10.2}, {"Pd": 10.2}, {"Pd": 8.0}, {"Pd": 29.2}, {"Pd": 32.1}, {"Pd": 28.2}, {"Pd": 3.1}, {"Pd": 0.0}, {"Pd": 1.9}, {"Pd": 13.2}, {"Pd": 17.6}, {"Pd": 15.3}, {"Pd": 5.7}, {"Pd": 1.3}, {"Pd": 0.6}, {"Pd": 15.3}, {"Pd": 10.7}, {"Pd": 10.2}, {"Pd": 72.8}, {"Pd": 73.5}, {"Pd": 75.3}, {"Pd": 1.6}, {"Pd": 1.9}, {"Pd": 3.0}, {"Pd": 5.4}, {"Pd": 4.3}, {"Pd": 2.1}, {"Pd": 8.1}, {"Pd": 0.0}, {"Pd": 3.1}, {"Pd": 5.8}, {"Pd": 7.5}, {"Pd": 9.1}, {"Pd": 4.1}, {"Pd": 1.7}, {"Pd": 3.3}, {"Pd": 97.9}, {"Pd": 97.7}, {"Pd": 98.1}, {"Pd": 3.1}, {"Pd": 4.0}, {"Pd": 3.4}, {"Pd": 47.3}, {"Pd": 3.3}, {"Pd": 2.6}, {"Pd": 1.7}, {"Pd": 9.4}, {"Pd": 5.8}, {"Pd": 9.1}, {"Pd": 28.7}, {"Pd": 25.8}, {"Pd": 41.7}, {"Pd": 43.3}, {"Pd": 42.1}, {"Pd": 23.4}, {"Pd": 23.1}, {"Pd": 23.8}, {"Pd": 0.3}, {"Pd": 0.5}, {"Pd": 0.0}, {"Pd": 17.6}, {"Pd": 23.0}, {"Pd": 15.3}, {"Pd": 25.0}, {"Pd": 26.3}, {"Pd": 26.7}, {"Pd": 46.6}, {"Pd": 44.7}, {"Pd": 44.6}, {"Pd": 5.4}, {"Pd": 2.1}, {"Pd": 4.9}, {"Pd": 43.9}, {"Pd": 2.9}, {"Pd": 2.9}, {"Pd": 8.6}, {"Pd": 49.8}, {"Pd": 46.9}, {"Pd": 48.2}, {"Pd": 1.4}, {"Pd": 2.9}, {"Pd": 0.8}, {"Pd": 8.0}, {"Pd": 9.6}, {"Pd": 10.2}, {"Pd": 27.9}, {"Pd": 26.3}, {"Pd": 25.0}, {"Pd": 30.0}, {"Pd": 2.4}, {"Pd": 2.1}, {"Pd": 1.2}, {"Pd": 19.3}, {"Pd": 23.3}, {"Pd": 12.9}, {"Pd": 44.6}, {"Pd": 46.6}, {"Pd": 45.4}, {"Pd": 5.7}, {"Pd": 1.3}, {"Pd": 0.0}, {"Pd": 48.9}, {"Pd": 39.3}, {"Pd": 38.6}, {"Pd": 1.7}, {"Pd": 4.1}, {"Pd": 2.2}, {"Pd": 15.2}, {"Pd": 17.8}, {"Pd": 15.8}, {"Pd": 0.8}, {"Pd": 0.6}, {"Pd": 2.9}, {"Pd": 42.5}, {"Pd": 41.7}, {"Pd": 43.2}, {"Pd": 42.1}, {"Pd": 10.2}, {"Pd": 15.3}, {"Pd": 13.1}, {"Pd": 42.5}, {"Pd": 47.3}, {"Pd": 29.2}, {"Pd": 28.2}, {"Pd": 26.8}, {"Pd": 98.1}, {"Pd": 98.8}, {"Pd": 97.9}, {"Pd": 22.1}, {"Pd": 23.9}, {"Pd": 24.6}, {"Pd": 25.2}, {"Pd": 20.1}, {"Pd": 25.2}, {"Pd": 29.2}, {"Pd": 26.8}, {"Pd": 32.1}, {"Pd": 45.4}, {"Pd": 46.6}, {"Pd": 44.7}, {"Pd": 30.0}, {"Pd": 26.7}, {"Pd": 26.3}, {"Pd": 4.8}, {"Pd": 6.0}, {"Pd": 7.6}, {"Pd": 61.6}, {"Pd": 64.9}, {"Pd": 68.4}, {"Pd": 0.0}, {"Pd": 0.5}, {"Pd": 0.2}, {"Pd": 61.6}, {"Pd": 68.4}, {"Pd": 69.6}, {"Pd": 98.1}, {"Pd": 97.7}, {"Pd": 98.8}, {"Pd": 72.8}, {"Pd": 73.5}, {"Pd": 75.3}, {"Pd": 4.6}, {"Pd": 5.6}, {"Pd": 2.9}, {"Pd": 73.5}, {"Pd": 75.3}, {"Pd": 75.3}, {"Pd": 28.2}, {"Pd": 32.1}, {"Pd": 26.8}, {"Pd": 48.2}, {"Pd": 47.1}, {"Pd": 49.8}, {"Pd": 4.6}, {"Pd": 6.5}, {"Pd": 3.0}, {"Pd": 9.8}, {"Pd": 11.9}, {"Pd": 5.0}, {"Pd": 43.1}, {"Pd": 43.9}, {"Pd": 0.2}, {"Pd": 0.3}, {"Pd": 0.0}, {"Pd": 2.5}, {"Pd": 4.4}, {"Pd": 4.3}, {"Pd": 43.2}, {"Pd": 43.3}, {"Pd": 41.7}, {"Pd": 44.7}, {"Pd": 44.6}, {"Pd": 45.4}, {"Pd": 19.3}, {"Pd": 12.9}, {"Pd": 16.5}, {"Pd": 25.2}, {"Pd": 25.2}, {"Pd": 25.1}, {"Pd": 3.1}, {"Pd": 4.0}, {"Pd": 2.4}, {"Pd": 23.0}, {"Pd": 13.2}, {"Pd": 17.6}, {"Pd": 69.6}, {"Pd": 68.4}, {"Pd": 64.9}, {"Pd": 75.8}, {"Pd": 70.7}, {"Pd": 72.0}, {"Pd": 1.4}, {"Pd": 0.6}, {"Pd": 2.9}, {"Pd": 8.1}, {"Pd": 3.1}, {"Pd": 1.9}, {"Pd": 0.0}, {"Pd": 1.1}, {"Pd": 0.0}, {"Pd": 20.5}, {"Pd": 17.3}, {"Pd": 18.2}, {"Pd": 97.9}, {"Pd": 97.7}, {"Pd": 98.8}, {"Pd": 1.6}, {"Pd": 3.0}, {"Pd": 5.6}, {"Pd": 42.1}, {"Pd": 43.2}, {"Pd": 43.3}, {"Pd": 5.0}, {"Pd": 4.2}, {"Pd": 5.5}, {"Pd": 23.9}, {"Pd": 22.9}, {"Pd": 22.1}, {"Pd": 5.0}, {"Pd": 11.9}, {"Pd": 5.2}, {"Pd": 34.8}, {"Pd": 35.9}, {"Pd": 30.2}, {"Pd": 1.9}, {"Pd": 3.0}, {"Pd": 5.6}, {"Pd": 7.0}, {"Pd": 7.9}, {"Pd": 5.0}, {"Pd": 21.2}, {"Pd": 20.5}, {"Pd": 17.3}, {"Pd": 9.7}, {"Pd": 9.1}, {"Pd": 10.7}, {"Pd": 40.2}, {"Pd": 43.1}, {"Pd": 39.7}, {"Pd": 69.6}, {"Pd": 64.9}, {"Pd": 61.6}, {"Pd": 7.7}, {"Pd": 5.6}, {"Pd": 5.0}, {"Pd": 10.7}, {"Pd": 13.1}, {"Pd": 10.2}, {"Pd": 8.1}, {"Pd": 12.8}, {"Pd": 7.6}, {"Pd": 4.2}, {"Pd": 5.0}, {"Pd": 4.9}, {"Pd": 4.3}, {"Pd": 4.4}, {"Pd": 6.2}, {"Pd": 9.8}, {"Pd": 11.9}, {"Pd": 5.2}, {"Pd": 32.5}, {"Pd": 35.9}, {"Pd": 30.2}, {"Pd": 7.7}, {"Pd": 5.6}, {"Pd": 6.5}, {"Pd": 1.7}, {"Pd": 2.2}, {"Pd": 3.3}, {"Pd": 4.6}, {"Pd": 0.6}, {"Pd": 3.0}, {"Pd": 6.4}, {"Pd": 5.6}, {"Pd": 4.6}, {"Pd": 5.5}, {"Pd": 4.9}, {"Pd": 5.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 7.0}, {"Pd": 4.3}, {"Pd": 7.9}, {"Pd": 3.2}, {"Pd": 4.1}, {"Pd": 3.2}, {"Pd": 6.5}, {"Pd": 5.0}, {"Pd": 5.6}, {"Pd": 8.2}, {"Pd": 3.2}, {"Pd": 4.1}, {"Pd": 34.9}, {"Pd": 39.2}, {"Pd": 38.8}, {"Pd": 75.3}, {"Pd": 75.3}, {"Pd": 72.8}, {"Pd": 2.4}, {"Pd": 3.4}, {"Pd": 3.1}, {"Pd": 4.2}, {"Pd": 5.5}, {"Pd": 4.9}, {"Pd": 5.7}, {"Pd": 0.0}, {"Pd": 0.6}, {"Pd": 16.4}, {"Pd": 16.8}, {"Pd": 18.2}, {"Pd": 1.2}, {"Pd": 2.6}, {"Pd": 2.1}, {"Pd": 9.1}, {"Pd": 10.7}, {"Pd": 9.8}, {"Pd": 28.0}, {"Pd": 28.7}, {"Pd": 25.8}, {"Pd": 34.8}, {"Pd": 32.5}, {"Pd": 35.9}, {"Pd": 2.6}, {"Pd": 1.7}, {"Pd": 3.3}, {"Pd": 9.8}, {"Pd": 10.7}, {"Pd": 9.7}, {"Pd": 48.2}, {"Pd": 46.9}, {"Pd": 47.1}, {"Pd": 9.2}, {"Pd": 9.4}, {"Pd": 8.7}, {"Pd": 43.1}, {"Pd": 13.2}, {"Pd": 15.3}, {"Pd": 23.0}, {"Pd": 2.7}, {"Pd": 4.7}, {"Pd": 0.3}, {"Pd": 16.5}, {"Pd": 23.3}, {"Pd": 12.9}, {"Pd": 43.1}, {"Pd": 42.7}, {"Pd": 40.2}, {"Pd": 17.8}, {"Pd": 15.2}, {"Pd": 16.8}, {"Pd": 16.8}, {"Pd": 18.2}, {"Pd": 18.4}, {"Pd": 2.9}, {"Pd": 2.9}, {"Pd": 3.1}, {"Pd": 2.7}, {"Pd": 0.3}, {"Pd": 2.3}, {"Pd": 2.3}, {"Pd": 2.7}, {"Pd": 4.7}, {"Pd": 4.6}, {"Pd": 6.4}, {"Pd": 2.9}, {"Pd": 21.2}, {"Pd": 20.5}, {"Pd": 18.2}, {"Pd": 23.4}, {"Pd": 23.8}, {"Pd": 25.0}, {"Pd": 25.8}, {"Pd": 28.0}, {"Pd": 38.8}, {"Pd": 35.1}, {"Pd": 34.9}, {"Pd": 6.5}, {"Pd": 5.0}, {"Pd": 7.7}, {"Pd": 4.3}, {"Pd": 2.1}, {"Pd": 4.9}, {"Pd": 8.2}, {"Pd": 3.2}, {"Pd": 3.2}, {"Pd": 47.3}, {"Pd": 42.5}, {"Pd": 21.2}, {"Pd": 18.2}, {"Pd": 17.3}, {"Pd": 70.7}, {"Pd": 72.8}, {"Pd": 75.8}, {"Pd": 8.7}, {"Pd": 8.1}, {"Pd": 12.8}, {"Pd": 47.0}, {"Pd": 48.9}, {"Pd": 38.6}, {"Pd": 3.3}, {"Pd": 3.3}, {"Pd": 1.7}, {"Pd": 7.5}, {"Pd": 9.1}, {"Pd": 9.4}, {"Pd": 4.8}, {"Pd": 7.6}, {"Pd": 7.0}, {"Pd": 23.8}, {"Pd": 25.0}, {"Pd": 23.1}, {"Pd": 39.7}, {"Pd": 42.7}, {"Pd": 43.1}, {"Pd": 7.0}, {"Pd": 7.6}, {"Pd": 6.0}, {"Pd": 0.6}, {"Pd": 4.6}, {"Pd": 6.5}, {"Pd": 9.0}, {"Pd": 8.7}, {"Pd": 9.2}, {"Pd": 16.4}, {"Pd": 18.2}, {"Pd": 18.4}, {"Pd": 25.1}, {"Pd": 25.2}, {"Pd": 20.1}, {"Pd": 39.2}, {"Pd": 38.8}, {"Pd": 35.1}, {"Pd": 2.6}, {"Pd": 2.4}, {"Pd": 2.1}, {"Pd": 24.6}, {"Pd": 22.9}, {"Pd": 23.9}, {"Pd": 3.3}, {"Pd": 4.1}, {"Pd": 2.2}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 5.4}, {"Pd": 4.9}, {"Pd": 4.3}, {"Pd": 0.6}, {"Pd": 1.3}, {"Pd": 0.0}, {"Pd": 32.5}, {"Pd": 34.8}, {"Pd": 30.2}, {"Pd": 6.2}, {"Pd": 2.5}, {"Pd": 4.3}, {"Pd": 30.0}, {"Pd": 25.0}, {"Pd": 26.7}, {"Pd": 9.4}, {"Pd": 9.2}, {"Pd": 9.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 16.8}, {"Pd": 16.4}, {"Pd": 18.4}, {"Pd": 8.2}, {"Pd": 4.1}, {"Pd": 3.2}, {"Pd": 9.4}, {"Pd": 9.0}, {"Pd": 8.7}, {"Pd": 72.8}, {"Pd": 72.0}, {"Pd": 75.8}, {"Pd": 29.7}, {"Pd": 23.3}, {"Pd": 16.5}, {"Pd": 19.3}, {"Pd": 6.5}, {"Pd": 0.6}, {"Pd": 3.0}, {"Pd": 47.0}, {"Pd": 48.9}, {"Pd": 39.3}, {"Pd": 38.6}, {"Pd": 39.3}, {"Pd": 47.0}, {"Pd": 25.0}, {"Pd": 23.1}, {"Pd": 23.4}, {"Pd": 7.9}, {"Pd": 5.0}, {"Pd": 4.3}, {"Pd": 8.1}, {"Pd": 0.0}, {"Pd": 1.9}, {"Pd": 8.7}, {"Pd": 7.6}, {"Pd": 8.1}, {"Pd": 5.6}, {"Pd": 6.4}, {"Pd": 2.9}, {"Pd": 2.9}, {"Pd": 8.6}, {"Pd": 3.1}, {"Pd": 5.6}, {"Pd": 1.9}, {"Pd": 1.6}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 1.1}, {"Pd": 22.1}, {"Pd": 22.9}, {"Pd": 24.6}, {"Pd": 0.3}, {"Pd": 0.5}, {"Pd": 0.2}, {"Pd": 43.9}, {"Pd": 43.1}, {"Pd": 28.7}, {"Pd": 28.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 2.5}, {"Pd": 6.2}, {"Pd": 4.4}, {"Pd": 15.3}, {"Pd": 13.1}, {"Pd": 10.7}, {"Pd": 27.9}, {"Pd": 29.7}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median Palladium percentage for alloys where Gold percentage is under {}%."}
{"question": "Determine the average LUMO energy for materials with polarizability (alpha) less than 28.1299991607666?", "refer_dataset": "table60", "column names": ["alpha", "lumo"], "condition_column": {"alpha": "<"}, "answer_column": {"lumo": "avg"}, "condition": {"alpha": "<28.1299991607666"}, "tool": "calculate_data", "answer": 0.5758447448412577, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average LUMO energy for materials with polarizability (alpha) less than {}?"}
{"question": "What is the average J.uAcm2_0.80_fromCV when Mn concentration exceeds 0.7?", "refer_dataset": "table16", "column names": ["Mn", "J.uAcm2_0.80_fromCV"], "condition_column": {"Mn": ">"}, "answer_column": {"J.uAcm2_0.80_fromCV": "avg"}, "condition": {"Mn": ">0.7"}, "tool": "calculate_data", "answer": 600.1745677419356, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average J.uAcm2_0.80_fromCV when Mn concentration exceeds {}?"}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 7.741639137268066?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='7.741639137268066'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds 104.31 Å, the electronegativity of element B (χpb) is below 1.81, and the molar mass (M) is less than 238.31 g/mol?", "refer_dataset": "table3", "column names": ["Ra", "χpb", "M", "RH2(µmol h-1 g-1)"], "condition_column": {"Ra": ">", "χpb": "<", "M": "<"}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Ra": ">104.31", "χpb": "<1.81", "M": "<238.31"}, "tool": "calculate_data", "answer": 962.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest hydrogen production rate (RH2) for materials where the atomic radius of element A (Ra) exceeds {} Å, the electronegativity of element B (χpb) is below {}, and the molar mass (M) is less than {} g/mol?"}
{"question": "What is the minimum initial concentration (C0) recorded when light intensity (I) is 3.15 mW/cm², nanoparticle dose (D) is 1.0 g/L, and reference (Ref) is 20.0?", "refer_dataset": "table9", "column names": ["I, mW/cm2", "D, g/L", "Ref", "C0, mg/L"], "condition_column": {"I, mW/cm2": "=", "D, g/L": "=", "Ref": "="}, "answer_column": {"C0, mg/L": "min"}, "condition": {"I, mW/cm2": "=='3.15'", "D, g/L": "=='1.0'", "Ref": "=='20.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum initial concentration (C0) recorded when light intensity (I) is {} mW/cm², nanoparticle dose (D) is {} g/L, and reference (Ref) is {}?"}
{"question": "List references (Ref) where initial concentration (C0) is greater than 10.0 mg/L.", "refer_dataset": "table9", "column names": ["Ref", "C0, mg/L"], "condition_column": {"C0, mg/L": ">"}, "answer_column": {"Ref": ""}, "condition": {"C0, mg/L": ">10.0"}, "tool": "calculate_data", "answer": [{"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 20}, {"Ref": 20}, {"Ref": 20}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 21}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 23}, {"Ref": 25}, {"Ref": 25}, {"Ref": 25}, {"Ref": 25}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 29}, {"Ref": 30}, {"Ref": 30}, {"Ref": 30}, {"Ref": 30}, {"Ref": 30}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 35}, {"Ref": 35}, {"Ref": 35}, {"Ref": 36}, {"Ref": 36}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 39}, {"Ref": 39}, {"Ref": 39}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 43}, {"Ref": 43}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List references (Ref) where initial concentration (C0) is greater than {} mg/L."}
{"question": "Find the minimum Degradation efficiency (%) for Material AgI-UiO-66-NH2.", "refer_dataset": "table6", "column names": ["Material", "Degradation efficiency (%)"], "condition_column": {"Material": "="}, "answer_column": {"Degradation efficiency (%)": "min"}, "condition": {"Material": "=='AgI-UiO-66-NH2'"}, "tool": "calculate_data", "answer": 79.9, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum Degradation efficiency (%) for Material {}."}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -5.29133620516503.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-5.29133620516503"}, "tool": "calculate_data", "answer": -3.4468329397765975, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "What is the total number of articles indexed on 2021-06-04 00:00:00 that used the electrochemical deposition method?", "refer_dataset": "table13", "column names": ["Indexed_Date", "Judge_Electrochemical_Deposition"], "condition_column": {"Indexed_Date": "="}, "answer_column": {"Judge_Electrochemical_Deposition": "count"}, "condition": {"Indexed_Date": "=='2021-06-04 00:00:00'"}, "tool": "calculate_data", "answer": 9, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the total number of articles indexed on {} that used the electrochemical deposition method?"}
{"question": "What is the highest LUMO energy for molecules where the HOMO energy is greater than -0.15431696888113 and the HOMO-LUMO gap (gap) is less than 0.55632613213507?", "refer_dataset": "table61", "column names": ["HOMO", "gap", "LUMO"], "condition_column": {"HOMO": ">", "gap": "<"}, "answer_column": {"LUMO": "max"}, "condition": {"HOMO": ">-0.15431696888113", "gap": "<0.55632613213507"}, "tool": "calculate_data", "answer": 1.32902759228586, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest LUMO energy for molecules where the HOMO energy is greater than {} and the HOMO-LUMO gap (gap) is less than {}?"}
{"question": "Calculate the average atomic number of elements in surface -211.0 where carbon species is 3.0 and reaction energy exceeds 0.744.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-211.0'", "b_key": "=='3.0'", "reaction_energy": ">0.744"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "What is the highest density for materials with pretty_formula equal to Rb3Hf?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='Rb3Hf'"}, "tool": "calculate_data", "answer": 3.0850912213010244, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "Find the average Eg(eV) for samples calcined at exactly 823.0 K.", "refer_dataset": "table1", "column names": ["Calcination temperature(K)", "Eg(eV)"], "condition_column": {"Calcination temperature(K)": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Calcination temperature(K)": "=='823.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Eg(eV) for samples calcined at exactly {} K."}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 2.70289805057916.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<2.70289805057916"}, "tool": "calculate_data", "answer": [{"U": 6.19311549745637}, {"U": 6.46228747900917}, {"U": 5.74085587987803}, {"U": 5.85213296706841}, {"U": 5.33647867089936}, {"U": 4.54692058907546}, {"U": 4.88454826774226}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 4.1619487412596}, {"U": 4.19426139798513}, {"U": 4.76626100362987}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 2.9854853300983}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 3.72489046894116}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 4.53315367807953}, {"U": 3.49215677563079}, {"U": 3.93208391647714}, {"U": 4.22689804350615}, {"U": 4.28237851192289}, {"U": 3.00182324895532}, {"U": 3.01987778586592}, {"U": 3.78009136638114}, {"U": 2.80742213321591}, {"U": 3.58342232907322}, {"U": 3.34822214041645}, {"U": 3.59604221522057}, {"U": 3.59705598661295}, {"U": 2.92411819429234}, {"U": 3.06909011621485}, {"U": 3.53668171969642}, {"U": 3.36763795283073}, {"U": 3.83280486597178}, {"U": 1.81243163972837}, {"U": 3.48205825390004}, {"U": 3.84218486416411}, {"U": 3.91996307758737}, {"U": 3.59120067297812}, {"U": 4.04224794538619}, {"U": 2.22476225107403}, {"U": 2.56144409148299}, {"U": 3.07303546364394}, {"U": 3.00402846301502}, {"U": 3.34725539965568}, {"U": 2.32843082719585}, {"U": 3.10486997561481}, {"U": 2.77914365955695}, {"U": 3.06939058969455}, {"U": 2.29578111761049}, {"U": 2.73295174088221}, {"U": 2.7462483455621}, {"U": 3.20788012289417}, {"U": 2.81559501186372}, {"U": 3.01722055518023}, {"U": 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0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "What is the average Onset potential for alloys where Platinum percentage exceeds 21.0%?", "refer_dataset": "table15", "column names": ["Pt", "Onset"], "condition_column": {"Pt": ">"}, "answer_column": {"Onset": "avg"}, "condition": {"Pt": ">21.0"}, "tool": "calculate_data", "answer": 0.5082170410256407, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Onset potential for alloys where Platinum percentage exceeds {}%?"}
{"question": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx 55.", "refer_dataset": "table63", "column names": ["Space_group_rlx", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "="}, "answer_column": {"Band_gap_GGA": "max"}, "condition": {"Space_group_rlx": "=='55'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx {}."}
{"question": "What is the average energy per atom for compounds in the formula MgF2 with an indirect gap below 6.228?", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "energy_per_atom"], "condition_column": {"formula": "=", "indir_gap": "<"}, "answer_column": {"energy_per_atom": "avg"}, "condition": {"formula": "=='MgF2'", "indir_gap": "<6.228"}, "tool": "calculate_data", "answer": -1007.5925844444447, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average energy per atom for compounds in the formula {} with an indirect gap below {}?"}
{"question": "How many organic compounds (OC) have pH values equal to 6.3?", "refer_dataset": "table9", "column names": ["OC", "pH"], "condition_column": {"pH": "="}, "answer_column": {"OC": "count"}, "condition": {"pH": "=='6.3'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many organic compounds (OC) have pH values equal to {}?"}
{"question": "Calculate the average SBET (m²/g) for entries with Bandgap less than 2.9 eV and irradiation time over 8.0 hours.", "refer_dataset": "table10", "column names": ["Eg(eV)", "irradiation time(h)", "SBET (m2 /g)"], "condition_column": {"Eg(eV)": "<", "irradiation time(h)": ">"}, "answer_column": {"SBET (m2 /g)": "avg"}, "condition": {"Eg(eV)": "<2.9", "irradiation time(h)": ">8.0"}, "tool": "calculate_data", "answer": 44.372, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average SBET (m²/g) for entries with Bandgap less than {} eV and irradiation time over {} hours."}
{"question": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding 95.0°C?", "refer_dataset": "table7", "column names": ["Synhesis_Temp", "Reactor_Volume"], "condition_column": {"Synhesis_Temp": ">"}, "answer_column": {"Reactor_Volume": "min"}, "condition": {"Synhesis_Temp": ">95.0"}, "tool": "calculate_data", "answer": 1000.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding {}°C?"}
{"question": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals 9.836915969848633?", "refer_dataset": "table60", "column names": ["gap", "G"], "condition_column": {"gap": "="}, "answer_column": {"G": "sum"}, "condition": {"gap": "=='9.836915969848633'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the sum of Gibbs free energy (G) when the HOMO-LUMO gap equals {}?"}
{"question": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula 'ErSbPd'?", "refer_dataset": "table66", "column names": ["formula", "scf_vbm"], "condition_column": {"formula": "="}, "answer_column": {"scf_vbm": "max"}, "condition": {"formula": "=='ErSbPd'"}, "tool": "calculate_data", "answer": 7.095, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SCF valence band maximum (scf_vbm) for surface structures with chemical formula '{}'?"}
{"question": "What is the average final_energy for materials where optb88vdw_bandgap exceeds -0.5251999999999999?", "refer_dataset": "table52", "column names": ["final_energy", "optb88vdw_bandgap"], "condition_column": {"optb88vdw_bandgap": ">"}, "answer_column": {"final_energy": "avg"}, "condition": {"optb88vdw_bandgap": ">-0.5251999999999999"}, "tool": "calculate_data", "answer": -265.80967056548894, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average final_energy for materials where optb88vdw_bandgap exceeds {}?"}
{"question": "For source_id mp-582549, what is the maximum total magnetization observed?", "refer_dataset": "table67", "column names": ["source_id", "total_magnetization"], "condition_column": {"source_id": "="}, "answer_column": {"total_magnetization": "max"}, "condition": {"source_id": "=='mp-582549'"}, "tool": "calculate_data", "answer": 0.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For source_id {}, what is the maximum total magnetization observed?"}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 13.5?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">13.5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "Find the average Eg(eV) for samples calcined at exactly 1373.0 K.", "refer_dataset": "table1", "column names": ["Calcination temperature(K)", "Eg(eV)"], "condition_column": {"Calcination temperature(K)": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Calcination temperature(K)": "=='1373.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Eg(eV) for samples calcined at exactly {} K."}
{"question": "How many organic compounds (OC) have pH values equal to 11.0?", "refer_dataset": "table9", "column names": ["OC", "pH"], "condition_column": {"pH": "="}, "answer_column": {"OC": "count"}, "condition": {"pH": "=='11.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many organic compounds (OC) have pH values equal to {}?"}
{"question": "Compute the average Catalyst dosage (g/L) for experiments where pH equals 5.9.", "refer_dataset": "table6", "column names": ["pH", "Catalyst dosage (g/L)"], "condition_column": {"pH": "="}, "answer_column": {"Catalyst dosage (g/L)": "avg"}, "condition": {"pH": "=='5.9'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Catalyst dosage (g/L) for experiments where pH equals {}."}
{"question": "How many catalysts use M1 as Zn, M2 as Mo, and achieve CH4 conversion (%) above 13.42121103%?", "refer_dataset": "table21", "column names": ["M1", "M2", "CH4 conversion (%)", "Code"], "condition_column": {"M1": "=", "M2": "=", "CH4 conversion (%)": ">"}, "answer_column": {"Code": "count"}, "condition": {"M1": "=='Zn'", "M2": "=='Mo'", "CH4 conversion (%)": ">13.42121103"}, "tool": "calculate_data", "answer": 86, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many catalysts use M1 as {}, M2 as {}, and achieve CH4 conversion (%) above {}%?"}
{"question": "What is the highest reaction energy for elements Co with adsorbed species CCH* and activation energy greater than 1.6?", "refer_dataset": "table18", "column names": ["AA", "ab", "activation_energy", "reaction_energy"], "condition_column": {"AA": "=", "ab": "=", "activation_energy": ">"}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Co'", "ab": "=='CCH*'", "activation_energy": ">1.6"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy for elements {} with adsorbed species {} and activation energy greater than {}?"}
{"question": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds 8.302193641662598?", "refer_dataset": "table60", "column names": ["gap", "Cv"], "condition_column": {"gap": ">"}, "answer_column": {"Cv": "min"}, "condition": {"gap": ">8.302193641662598"}, "tool": "calculate_data", "answer": 36.540000915527344, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest heat capacity (Cv) observed when the energy gap (gap) exceeds {}?"}
{"question": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above 791.1 K.", "refer_dataset": "table3", "column names": ["A_Tm", "RH2(µmol h-1 g-1)"], "condition_column": {"A_Tm": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "min"}, "condition": {"A_Tm": ">791.1"}, "tool": "calculate_data", "answer": 8600.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above {} K."}
{"question": "What is the median Onset potential for alloys with Ru > 88.0%, Rh > 0.0%, and Pd < 7.6%?", "refer_dataset": "table15", "column names": ["Ru", "Rh", "Pd", "Onset"], "condition_column": {"Ru": ">", "Rh": ">", "Pd": "<"}, "answer_column": {"Onset": "median"}, "condition": {"Ru": ">88.0", "Rh": ">0.0", "Pd": "<7.6"}, "tool": "calculate_data", "answer": [{"Onset": 0.490676}, {"Onset": 0.485673}, {"Onset": 0.486658}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Onset potential for alloys with Ru > {}%, Rh > {}%, and Pd < {}%?"}
{"question": "What is the maximum pH observed where Degradation efficiency (%) is greater than 5.9?", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "pH"], "condition_column": {"pH": ">"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"pH": ">5.9"}, "tool": "calculate_data", "answer": 99.1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH observed where Degradation efficiency (%) is greater than {}?"}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MO under Experimental Temperature 25°C and Light Wavelength 475 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MO'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='475'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding 0.0002352?", "refer_dataset": "table54", "column names": ["mu_b", "shear modulus"], "condition_column": {"mu_b": ">"}, "answer_column": {"shear modulus": "max"}, "condition": {"mu_b": ">0.0002352"}, "tool": "calculate_data", "answer": 347.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding {}?"}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over 0.54135950548886 and Gibbs free energy (G) under 4.40592946546656.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">0.54135950548886", "G": "<4.40592946546656"}, "tool": "calculate_data", "answer": -2.1884728792410657, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "For materials in space group symbol Pmm2, what is the minimum stress tensor value observed?", "refer_dataset": "table59", "column names": ["spacegroup_symbol", "stress"], "condition_column": {"spacegroup_symbol": "="}, "answer_column": {"stress": "min"}, "condition": {"spacegroup_symbol": "=='Pmm2'"}, "tool": "calculate_data", "answer": "[[5.985317874175124, 0.0, 0.0], [0.0, 0.4072038020669271, 0.0], [0.0, 0.0, 9.50996933423574]]", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials in space group symbol {}, what is the minimum stress tensor value observed?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than -2.8018347596875?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-2.8018347596875"}, "tool": "calculate_data", "answer": 118.93323792952678, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) less than -0.3607627800000004?", "refer_dataset": "table54", "column names": ["e_form", "bulk modulus"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<-0.3607627800000004"}, "tool": "calculate_data", "answer": 125.61594432860578, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) less than {}?"}
{"question": "Calculate the average atomic number of elements in surface -111.0 where carbon species is 3.0 and reaction energy exceeds 0.424.", "refer_dataset": "table18", "column names": ["surfaces", "b_key", "reaction_energy", "A_AtimicN"], "condition_column": {"surfaces": "=", "b_key": "=", "reaction_energy": ">"}, "answer_column": {"A_AtimicN": "avg"}, "condition": {"surfaces": "=='-111.0'", "b_key": "=='3.0'", "reaction_energy": ">0.424"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average atomic number of elements in surface {} where carbon species is {} and reaction energy exceeds {}."}
{"question": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"FiM\", SOC False, and Direct_or_indirect_HSE \"Direct\"?", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "SOC", "Direct_or_indirect_HSE", "Band_gap_HSE"], "condition_column": {"Magnetic_ordering": "=", "SOC": "=", "Direct_or_indirect_HSE": "="}, "answer_column": {"Band_gap_HSE": "max"}, "condition": {"Magnetic_ordering": "=='FiM'", "SOC": "=='False'", "Direct_or_indirect_HSE": "=='Direct'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"{}\", SOC {}, and Direct_or_indirect_HSE \"{}\"?"}
{"question": "What is the average vol for entries where method is minima-hopping?", "refer_dataset": "table58", "column names": ["method", "vol"], "condition_column": {"method": "="}, "answer_column": {"vol": "avg"}, "condition": {"method": "=='minima-hopping'"}, "tool": "calculate_data", "answer": 224.42103227513218, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average vol for entries where method is {}?"}
{"question": "What is the minimum Bandgap (Eg) observed at a loading of 0.06 g/l?", "refer_dataset": "table10", "column names": ["loading (g/l)", "Eg(eV)"], "condition_column": {"loading (g/l)": "="}, "answer_column": {"Eg(eV)": "min"}, "condition": {"loading (g/l)": "=='0.06'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Bandgap (Eg) observed at a loading of {} g/l?"}
{"question": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than 0.0016083399999999.", "refer_dataset": "table56", "column names": ["gap pbe", "e_hull"], "condition_column": {"e_hull": "<"}, "answer_column": {"gap pbe": "max"}, "condition": {"e_hull": "<0.0016083399999999"}, "tool": "calculate_data", "answer": 7.7947, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the highest bandgap (gap pbe) among materials with energy above convex hull (e_hull) lower than {}."}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than 0.91, Element B's Electronegativity (χpb) is less than 1.55, and the Tolerance Factor (t) is 0.931?", "refer_dataset": "table2", "column names": ["χpa", "χpb", "t", "Eg(eV)"], "condition_column": {"χpa": ">", "χpb": "<", "t": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"χpa": ">0.91", "χpb": "<1.55", "t": "=='0.931'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials where Element A's Electronegativity (χpa) is greater than {}, Element B's Electronegativity (χpb) is less than {}, and the Tolerance Factor (t) is {}?"}
{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 1.0, Indirect Bandgap < 0.0, and Lattice Parameter 4.1418482485?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='1.0'", "Indirect_Band": "<0.0", "Lattice": "=='4.1418482485'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
{"question": "What is the average Light Wavelength used for Calcination Temperatures above 600°C when Pollutant is Phenol?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Calcination temperature(°C)", "Pollutant"], "condition_column": {"Calcination temperature(°C)": ">", "Pollutant": "="}, "answer_column": {"Light wavelength(nm)": "avg"}, "condition": {"Calcination temperature(°C)": ">600", "Pollutant": "=='Phenol'"}, "tool": "calculate_data", "answer": 535.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Light Wavelength used for Calcination Temperatures above {}°C when Pollutant is {}?"}
{"question": "Determine the average journal impact factor for articles using 0 method in Peoples R China country with overpotential below 15.0 in neutral conditions.", "refer_dataset": "table13", "column names": ["Judge_Sol_Gel", "Country", "IF", "Neutral_OVP"], "condition_column": {"Judge_Sol_Gel": "=", "Country": "=", "Neutral_OVP": "<"}, "answer_column": {"IF": "avg"}, "condition": {"Judge_Sol_Gel": "=='0'", "Country": "=='Peoples R China'", "Neutral_OVP": "<15.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average journal impact factor for articles using {} method in {} country with overpotential below {} in neutral conditions."}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than -1.3252643452517?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<-1.3252643452517"}, "tool": "calculate_data", "answer": 2.04884424920197, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "What is the maximum Onset potential for alloys where Platinum > 2.2%, Ruthenium < 88.0%, and Palladium > 7.6%?", "refer_dataset": "table15", "column names": ["Pt", "Ru", "Pd", "Onset"], "condition_column": {"Pt": ">", "Ru": "<", "Pd": ">"}, "answer_column": {"Onset": "max"}, "condition": {"Pt": ">2.2", "Ru": "<88.0", "Pd": ">7.6"}, "tool": "calculate_data", "answer": 0.600639, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Onset potential for alloys where Platinum > {}%, Ruthenium < {}%, and Palladium > {}%?"}
{"question": "Find the average Degradation efficiency (%) for Material MIL-101 when Catalyst dosage (g/L) > 0.1, Illumination time (min) > 15, and pH < 4.1.", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Illumination time (min)", "pH", "Degradation efficiency (%)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Illumination time (min)": ">", "pH": "<"}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.1", "Illumination time (min)": ">15", "pH": "<4.1"}, "tool": "calculate_data", "answer": 25.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Degradation efficiency (%) for Material {} when Catalyst dosage (g/L) > {}, Illumination time (min) > {}, and pH < {}."}
{"question": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above 7.365 eV, the density of element B (ρb) exceeds 6.19 g/cm³, and the tolerance factor (t) is less than 0.881.", "refer_dataset": "table3", "column names": ["I1b", "ρb", "t", "A_Tb"], "condition_column": {"I1b": ">", "ρb": ">", "t": "<"}, "answer_column": {"A_Tb": "max"}, "condition": {"I1b": ">7.365", "ρb": ">6.19", "t": "<0.881"}, "tool": "calculate_data", "answer": 3520.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above {} eV, the density of element B (ρb) exceeds {} g/cm³, and the tolerance factor (t) is less than {}."}
{"question": "What is the maximum initial concentration (C0) recorded for reference number 35?", "refer_dataset": "table9", "column names": ["C0, mg/L", "Ref"], "condition_column": {"Ref": "="}, "answer_column": {"C0, mg/L": "max"}, "condition": {"Ref": "=='35'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum initial concentration (C0) recorded for reference number {}?"}
{"question": "What Light Wavelength achieves Degradation Rate above 89.0% within 20 minutes of Illumination Time for Dopant C?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Degradation rate(%)", "Illumination time(min)", "Dopant"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "Dopant": "="}, "answer_column": {"Light wavelength(nm)": ""}, "condition": {"Degradation rate(%)": ">89.0", "Illumination time(min)": "<20", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Light Wavelength achieves Degradation Rate above {}% within {} minutes of Illumination Time for Dopant {}?"}
{"question": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > -0.353, scf_vbm < 1.924, and formula contains 'BaNaBr'?", "refer_dataset": "table66", "column names": ["surf_cbm", "scf_vbm", "formula", "efermi"], "condition_column": {"surf_cbm": ">", "scf_vbm": "<", "formula": "="}, "answer_column": {"efermi": "min"}, "condition": {"surf_cbm": ">-0.353", "scf_vbm": "<1.924", "formula": "=='BaNaBr'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > {}, scf_vbm < {}, and formula contains '{}'?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -1.30193535262703.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-1.30193535262703'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the average calcination temperature (CT) for samples referenced in study [32]?", "refer_dataset": "table11", "column names": ["Ref.", "CT (℃)"], "condition_column": {"Ref.": "="}, "answer_column": {"CT (℃)": "avg"}, "condition": {"Ref.": "=='[32]'"}, "tool": "calculate_data", "answer": 650.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature (CT) for samples referenced in study {}?"}
{"question": "Find the average Degradation efficiency (%) for Material MIL-101 when Catalyst dosage (g/L) > 0.05, Illumination time (min) > 15, and pH < 4.1.", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Illumination time (min)", "pH", "Degradation efficiency (%)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Illumination time (min)": ">", "pH": "<"}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.05", "Illumination time (min)": ">15", "pH": "<4.1"}, "tool": "calculate_data", "answer": 25.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Degradation efficiency (%) for Material {} when Catalyst dosage (g/L) > {}, Illumination time (min) > {}, and pH < {}."}
{"question": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > 50.0% in under 80.0 minutes of illumination for pH = 7.0?", "refer_dataset": "table8", "column names": ["Catalyst/Pollutant mass ratio", "Degradation rate(%)", "Illumination time(min)", "pH"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "pH": "="}, "answer_column": {"Catalyst/Pollutant mass ratio": ""}, "condition": {"Degradation rate(%)": ">50.0", "Illumination time(min)": "<80.0", "pH": "=='7.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > {}% in under {} minutes of illumination for pH = {}?"}
{"question": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the Polymerized complex Sol-gel method method?", "refer_dataset": "table1", "column names": ["Preparation method", "RH2(µmol h-1 g-1)"], "condition_column": {"Preparation method": "="}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Preparation method": "=='Polymerized complex Sol-gel method'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the {} method?"}
{"question": "What is the average bulk modulus for materials with formation energy (e_form) greater than -0.0411816112500003?", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": ">"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": ">-0.0411816112500003"}, "tool": "calculate_data", "answer": 164.2151172092534, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk modulus for materials with formation energy (e_form) greater than {}?"}
{"question": "How many materials have a bandgap less than 3.0243?", "refer_dataset": "table67", "column names": ["bandgap", "material_id"], "condition_column": {"bandgap": "<"}, "answer_column": {"material_id": "count"}, "condition": {"bandgap": "<3.0243"}, "tool": "calculate_data", "answer": 4450, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many materials have a bandgap less than {}?"}
{"question": "How many Preparations use both Anion1 0.0 and Support1 13.0, with C2-yield ≥ 2.9988%?", "refer_dataset": "table20", "column names": ["Anion1", "Support1", "C2-yield", "Preparation"], "condition_column": {"Anion1": "=", "Support1": "=", "C2-yield": ">="}, "answer_column": {"Preparation": "count"}, "condition": {"Anion1": "=='0.0'", "Support1": "=='13.0'", "C2-yield": ">=2.9988"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations use both Anion1 {} and Support1 {}, with C2-yield ≥ {}%?"}
{"question": "What is the average Degradation efficiency (%) when Surface area (m2/g) > 15.95, Pore Volume (cm3/g) < 0.11, and pH is 3.45?", "refer_dataset": "table6", "column names": ["Surface area (m2/g)", "Pore Volume (cm3/g)", "pH", "Degradation efficiency (%)"], "condition_column": {"Surface area (m2/g)": ">", "Pore Volume (cm3/g)": "<", "pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Surface area (m2/g)": ">15.95", "Pore Volume (cm3/g)": "<0.11", "pH": "=='3.45'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when Surface area (m2/g) > {}, Pore Volume (cm3/g) < {}, and pH is {}?"}
{"question": "Find the average CH4-conversion% for reactions where Cation1 = 3.0, Contact-times > 5.3, and O2-pressure < 0.052.", "refer_dataset": "table20", "column names": ["Cation1", "Contact-times", "O2-pressure", "CH4-conversion%"], "condition_column": {"Cation1": "=", "Contact-times": ">", "O2-pressure": "<"}, "answer_column": {"CH4-conversion%": "avg"}, "condition": {"Cation1": "=='3.0'", "Contact-times": ">5.3", "O2-pressure": "<0.052"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average CH4-conversion% for reactions where Cation1 = {}, Contact-times > {}, and O2-pressure < {}."}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MB under Experimental Temperature 25°C and Light Wavelength 550 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MB'", "Experimental temperature(°C)": "=='25'", "Light wavelength(nm)": "=='550'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above 2, support material BaO–La2O3, and argon pressure 0.15 atm.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Support", "PAr (atm)", "C2 selectivity(%)"], "condition_column": {"CH4/O2 (mol/mol)": ">", "Support": "=", "PAr (atm)": "="}, "answer_column": {"C2 selectivity(%)": "min"}, "condition": {"CH4/O2 (mol/mol)": ">2", "Support": "=='BaO–La2O3'", "PAr (atm)": "=='0.15'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above {}, support material {}, and argon pressure {} atm."}
{"question": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN 7.0, Bn (count of B) 1.0, and Formation Energy ≤ 1.78?", "refer_dataset": "table22", "column names": ["C_AtomN", "Bn", "Formation_E", "Volume"], "condition_column": {"C_AtomN": "=", "Bn": "=", "Formation_E": "<="}, "answer_column": {"Volume": "min"}, "condition": {"C_AtomN": "=='7.0'", "Bn": "=='1.0'", "Formation_E": "<=1.78"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Unit Cell Volume for materials containing Element C_AtomN {}, Bn (count of B) {}, and Formation Energy ≤ {}?"}
{"question": "How many references document samples calcined for over 4.0 hours?", "refer_dataset": "table1", "column names": ["Calcination time(h)", "Ref"], "condition_column": {"Calcination time(h)": ">"}, "answer_column": {"Ref": "count"}, "condition": {"Calcination time(h)": ">4.0"}, "tool": "calculate_data", "answer": 116, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many references document samples calcined for over {} hours?"}
{"question": "Find the minimum activation energy for adsorbed species CCH* on surfaces with key 5 and elements of atomic number 44.", "refer_dataset": "table18", "column names": ["ab", "surfaces_key", "A_AtimicN", "activation_energy"], "condition_column": {"ab": "=", "surfaces_key": "=", "A_AtimicN": "="}, "answer_column": {"activation_energy": "min"}, "condition": {"ab": "=='CCH*'", "surfaces_key": "=='5'", "A_AtimicN": "=='44'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum activation energy for adsorbed species {} on surfaces with key {} and elements of atomic number {}."}
{"question": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds -7.219180583953857, internal energy at 0K (U0) is below -20.86277961730957, and Gibbs free energy (G) equals -19.51924514770508?", "refer_dataset": "table60", "column names": ["homo", "U0", "G", "Cv"], "condition_column": {"homo": ">", "U0": "<", "G": "="}, "answer_column": {"Cv": "min"}, "condition": {"homo": ">-7.219180583953857", "U0": "<-20.86277961730957", "G": "=='-19.51924514770508'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds {}, internal energy at 0K (U0) is below {}, and Gibbs free energy (G) equals {}?"}
{"question": "Determine the maximum reactor volume for MOF Type COMP, synthesized at over 150.0°C, with reaction pressure below 1.13 atm.", "refer_dataset": "table7", "column names": ["MOF_Type", "Synhesis_Temp", "Rxn_Pressure", "Reactor_Volume"], "condition_column": {"MOF_Type": "=", "Synhesis_Temp": ">", "Rxn_Pressure": "<"}, "answer_column": {"Reactor_Volume": "max"}, "condition": {"MOF_Type": "=='COMP'", "Synhesis_Temp": ">150.0", "Rxn_Pressure": "<1.13"}, "tool": "calculate_data", "answer": 1000.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum reactor volume for MOF Type {}, synthesized at over {}°C, with reaction pressure below {} atm."}
{"question": "Calculate the maximum loading (g/l) used under a UV light source.", "refer_dataset": "table10", "column names": ["light source", "loading (g/l)"], "condition_column": {"light source": "="}, "answer_column": {"loading (g/l)": "max"}, "condition": {"light source": "=='UV'"}, "tool": "calculate_data", "answer": 1.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum loading (g/l) used under a {} light source."}
{"question": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below 0.8739223445286077?", "refer_dataset": "table66", "column names": ["surf_en", "scf_cbm"], "condition_column": {"surf_en": "<"}, "answer_column": {"scf_cbm": "max"}, "condition": {"surf_en": "<0.8739223445286077"}, "tool": "calculate_data", "answer": 20.232, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum SCF conduction band minimum (scf_cbm) among materials with surface energy (surf_en) below {}?"}
{"question": "What is the average pH for catalysts where Year is 2008.0?", "refer_dataset": "table12", "column names": ["Year", "pH"], "condition_column": {"Year": "="}, "answer_column": {"pH": "avg"}, "condition": {"Year": "=='2008.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average pH for catalysts where Year is {}?"}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than 0.87387985863007?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<0.87387985863007"}, "tool": "calculate_data", "answer": 2.04884424920197, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "What is the average journal impact factor for research institutions located in India?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='India'"}, "tool": "calculate_data", "answer": 7.802080459770113, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "Calculate the average reaction temperature for noble metal none, synthesis time 72.0 hours, and additional components containing none.", "refer_dataset": "table7", "column names": ["Noble_Metal", "Synthesis_Time", "Additional", "Rxn_Temp"], "condition_column": {"Noble_Metal": "=", "Synthesis_Time": "=", "Additional": "="}, "answer_column": {"Rxn_Temp": "avg"}, "condition": {"Noble_Metal": "=='none'", "Synthesis_Time": "=='72.0'", "Additional": "=='none'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average reaction temperature for noble metal {}, synthesis time {} hours, and additional components containing {}."}
{"question": "What is the highest First Ionization Energy of B (I1b) observed in materials with EAa greater than 14.0, EAb less than 7.6, and ρa exceeding 3.62?", "refer_dataset": "table2", "column names": ["EAa", "EAb", "ρa", "I1b"], "condition_column": {"EAa": ">", "EAb": "<", "ρa": ">"}, "answer_column": {"I1b": "max"}, "condition": {"EAa": ">14.0", "EAb": "<7.6", "ρa": ">3.62"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest First Ionization Energy of B (I1b) observed in materials with EAa greater than {}, EAb less than {}, and ρa exceeding {}?"}
{"question": "What is the minimum loading (g/l) required when light source is UV–VIS and Reaction medium is gas-solid to achieve Yield > 1.55 μmol/g/h?", "refer_dataset": "table10", "column names": ["light source", "Reaction medium", "Yield (μmol/g/h)", "loading (g/l)"], "condition_column": {"light source": "=", "Reaction medium": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"loading (g/l)": "min"}, "condition": {"light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'", "Yield (μmol/g/h)": ">1.55"}, "tool": "calculate_data", "answer": 0.25, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum loading (g/l) required when light source is {} and Reaction medium is {} to achieve Yield > {} μmol/g/h?"}
{"question": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than 4.7 eV.", "refer_dataset": "table3", "column names": ["EAa", "Ra"], "condition_column": {"EAa": ">"}, "answer_column": {"Ra": "max"}, "condition": {"EAa": ">4.7"}, "tool": "calculate_data", "answer": 139.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than {} eV."}
{"question": "What is the highest Lattice Parameter observed when A_AtomN is 32.0, B_AtomN > 42.0, and Volume < 53.8225403795?", "refer_dataset": "table22", "column names": ["A_AtomN", "B_AtomN", "Volume", "Lattice"], "condition_column": {"A_AtomN": "=", "B_AtomN": ">", "Volume": "<"}, "answer_column": {"Lattice": "max"}, "condition": {"A_AtomN": "=='32.0'", "B_AtomN": ">42.0", "Volume": "<53.8225403795"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Lattice Parameter observed when A_AtomN is {}, B_AtomN > {}, and Volume < {}?"}
{"question": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above 2.6008476062636388.", "refer_dataset": "table66", "column names": ["avg_max", "surf_cbm"], "condition_column": {"avg_max": ">"}, "answer_column": {"surf_cbm": "min"}, "condition": {"avg_max": ">2.6008476062636388"}, "tool": "calculate_data", "answer": 7.2798, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above {}."}
{"question": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below -5.6224984835442.", "refer_dataset": "table61", "column names": ["Cv", "ZPVE"], "condition_column": {"Cv": "<"}, "answer_column": {"ZPVE": "avg"}, "condition": {"Cv": "<-5.6224984835442"}, "tool": "calculate_data", "answer": -3.6416933850357984, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Zero-point vibrational energy (ZPVE) for samples where heat capacity (Cv) is below {}."}
{"question": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above 6, support material BaO, and argon pressure 0.7 atm.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Support", "PAr (atm)", "C2 selectivity(%)"], "condition_column": {"CH4/O2 (mol/mol)": ">", "Support": "=", "PAr (atm)": "="}, "answer_column": {"C2 selectivity(%)": "min"}, "condition": {"CH4/O2 (mol/mol)": ">6", "Support": "=='BaO'", "PAr (atm)": "=='0.7'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above {}, support material {}, and argon pressure {} atm."}
{"question": "Calculate the average chem_pot for symbol Ac?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Ac'"}, "tool": "calculate_data", "answer": -0.984, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "Determine the average temperature (°C) required to achieve C2 yield (%) over 5.84049874% with M2 as Mo and PAr below 0.4 atm.", "refer_dataset": "table21", "column names": ["C2 yield (%)", "M2", "PAr (atm)", "Temp. (°C)"], "condition_column": {"C2 yield (%)": ">", "M2": "=", "PAr (atm)": "<"}, "answer_column": {"Temp. (°C)": "avg"}, "condition": {"C2 yield (%)": ">5.84049874", "M2": "=='Mo'", "PAr (atm)": "<0.4"}, "tool": "calculate_data", "answer": 806.3492063492064, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average temperature (°C) required to achieve C2 yield (%) over {}% with M2 as {} and PAr below {} atm."}
{"question": "What is the maximum yield of C2 hydrocarbons for catalysts with Support material SiO2?", "refer_dataset": "table19", "column names": ["Support", "C2 yield"], "condition_column": {"Support": "="}, "answer_column": {"C2 yield": "max"}, "condition": {"Support": "=='SiO2'"}, "tool": "calculate_data", "answer": 100.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum yield of C2 hydrocarbons for catalysts with Support material {}?"}
{"question": "For materials in space group symbol P6_3/mmc, what is the minimum stress tensor value observed?", "refer_dataset": "table59", "column names": ["spacegroup_symbol", "stress"], "condition_column": {"spacegroup_symbol": "="}, "answer_column": {"stress": "min"}, "condition": {"spacegroup_symbol": "=='P6_3/mmc'"}, "tool": "calculate_data", "answer": "[[9.664755028391601e-05, 9.721369657766716e-21, 0.0], [9.721369657766716e-21, 9.664755028333584e-05, -5.803266804017509e-32], [0.0, -2.6114700618078767e-31, 8.622667456220145e-05]]", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials in space group symbol {}, what is the minimum stress tensor value observed?"}
{"question": "Determine the average H2 selectivity when Cation1 is V, Cation3Amount > 0%, and O2 conv < 20.9%.", "refer_dataset": "table19", "column names": ["Cation1", "Cation3Amount", "O2 conv", "H2 sel"], "condition_column": {"Cation1": "=", "Cation3Amount": ">", "O2 conv": "<"}, "answer_column": {"H2 sel": "avg"}, "condition": {"Cation1": "=='V'", "Cation3Amount": ">0", "O2 conv": "<20.9"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average H2 selectivity when Cation1 is {}, Cation3Amount > {}%, and O2 conv < {}%."}
{"question": "Determine the maximum reactor volume for MOF Type COMP, synthesized at over 180.0°C, with reaction pressure below 1.13 atm.", "refer_dataset": "table7", "column names": ["MOF_Type", "Synhesis_Temp", "Rxn_Pressure", "Reactor_Volume"], "condition_column": {"MOF_Type": "=", "Synhesis_Temp": ">", "Rxn_Pressure": "<"}, "answer_column": {"Reactor_Volume": "max"}, "condition": {"MOF_Type": "=='COMP'", "Synhesis_Temp": ">180.0", "Rxn_Pressure": "<1.13"}, "tool": "calculate_data", "answer": 80.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum reactor volume for MOF Type {}, synthesized at over {}°C, with reaction pressure below {} atm."}
{"question": "How many organic compounds (OC) have pH values equal to 6.5?", "refer_dataset": "table9", "column names": ["OC", "pH"], "condition_column": {"pH": "="}, "answer_column": {"OC": "count"}, "condition": {"pH": "=='6.5'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many organic compounds (OC) have pH values equal to {}?"}
{"question": "What Light Wavelength achieves Degradation Rate above 30.0% within 20 minutes of Illumination Time for Dopant C?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Degradation rate(%)", "Illumination time(min)", "Dopant"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "Dopant": "="}, "answer_column": {"Light wavelength(nm)": ""}, "condition": {"Degradation rate(%)": ">30.0", "Illumination time(min)": "<20", "Dopant": "=='C'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Light Wavelength achieves Degradation Rate above {}% within {} minutes of Illumination Time for Dopant {}?"}
{"question": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of 0.1, Illumination time (min) > 20.0, and Antibiotic dosage (mg/L) < 50.0.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Illumination time (min)", "Antibiotic dosage (mg/L)", "Degradation efficiency (%)"], "condition_column": {"Catalyst dosage (g/L)": "=", "Illumination time (min)": ">", "Antibiotic dosage (mg/L)": "<"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"Catalyst dosage (g/L)": "=='0.1'", "Illumination time (min)": ">20.0", "Antibiotic dosage (mg/L)": "<50.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum Degradation efficiency (%) for Catalyst dosage (g/L) of {}, Illumination time (min) > {}, and Antibiotic dosage (mg/L) < {}."}
{"question": "What is the minimum initial concentration (C0) recorded when light intensity (I) is 3.15 mW/cm², nanoparticle dose (D) is 0.5 g/L, and reference (Ref) is 20.0?", "refer_dataset": "table9", "column names": ["I, mW/cm2", "D, g/L", "Ref", "C0, mg/L"], "condition_column": {"I, mW/cm2": "=", "D, g/L": "=", "Ref": "="}, "answer_column": {"C0, mg/L": "min"}, "condition": {"I, mW/cm2": "=='3.15'", "D, g/L": "=='0.5'", "Ref": "=='20.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum initial concentration (C0) recorded when light intensity (I) is {} mW/cm², nanoparticle dose (D) is {} g/L, and reference (Ref) is {}?"}
{"question": "What is the average Power(W) for materials where X is O, A mole is greater than 0.463, and Wave length(<nm) below 420.0?", "refer_dataset": "table4", "column names": ["X", "A mole", "Wave length(<nm)", "Power(W)"], "condition_column": {"X": "=", "A mole": ">", "Wave length(<nm)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"X": "=='O'", "A mole": ">0.463", "Wave length(<nm)": "<420.0"}, "tool": "calculate_data", "answer": 360.8481012658228, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where X is {}, A mole is greater than {}, and Wave length(<nm) below {}?"}
{"question": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below 0.1396000000000001?", "refer_dataset": "table56", "column names": ["elastic anisotropy", "gap pbe"], "condition_column": {"gap pbe": "<"}, "answer_column": {"elastic anisotropy": "max"}, "condition": {"gap pbe": "<0.1396000000000001"}, "tool": "calculate_data", "answer": 401.4952807290347, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest elastic anisotropy observed in materials with bandgap (gap pbe) below {}?"}
{"question": "What is the minimum loading (g/l) required when light source is UV–VIS and Reaction medium is gas-solid to achieve Yield > 14.25 μmol/g/h?", "refer_dataset": "table10", "column names": ["light source", "Reaction medium", "Yield (μmol/g/h)", "loading (g/l)"], "condition_column": {"light source": "=", "Reaction medium": "=", "Yield (μmol/g/h)": ">"}, "answer_column": {"loading (g/l)": "min"}, "condition": {"light source": "=='UV–VIS'", "Reaction medium": "=='gas-solid'", "Yield (μmol/g/h)": ">14.25"}, "tool": "calculate_data", "answer": 0.25, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum loading (g/l) required when light source is {} and Reaction medium is {} to achieve Yield > {} μmol/g/h?"}
{"question": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than -29.481576919555664?", "refer_dataset": "table60", "column names": ["H", "U0"], "condition_column": {"H": ">"}, "answer_column": {"U0": "max"}, "condition": {"H": ">-29.481576919555664"}, "tool": "calculate_data", "answer": -9.240361213684082, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than {}?"}
{"question": "What is the highest reaction energy for elements Cu with adsorbed species CH* and activation energy greater than 2.21?", "refer_dataset": "table18", "column names": ["AA", "ab", "activation_energy", "reaction_energy"], "condition_column": {"AA": "=", "ab": "=", "activation_energy": ">"}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Cu'", "ab": "=='CH*'", "activation_energy": ">2.21"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy for elements {} with adsorbed species {} and activation energy greater than {}?"}
{"question": "What is the average Onset potential for alloys where Platinum percentage exceeds 2.3%?", "refer_dataset": "table15", "column names": ["Pt", "Onset"], "condition_column": {"Pt": ">"}, "answer_column": {"Onset": "avg"}, "condition": {"Pt": ">2.3"}, "tool": "calculate_data", "answer": 0.4975363111111121, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Onset potential for alloys where Platinum percentage exceeds {}%?"}
{"question": "What is the average energy per atom for compounds in the formula MgF2 with an indirect gap below 4.588?", "refer_dataset": "table59", "column names": ["formula", "indir_gap", "energy_per_atom"], "condition_column": {"formula": "=", "indir_gap": "<"}, "answer_column": {"energy_per_atom": "avg"}, "condition": {"formula": "=='MgF2'", "indir_gap": "<4.588"}, "tool": "calculate_data", "answer": -1006.4838500000001, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average energy per atom for compounds in the formula {} with an indirect gap below {}?"}
{"question": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding 125.0°C?", "refer_dataset": "table7", "column names": ["Synhesis_Temp", "Reactor_Volume"], "condition_column": {"Synhesis_Temp": ">"}, "answer_column": {"Reactor_Volume": "min"}, "condition": {"Synhesis_Temp": ">125.0"}, "tool": "calculate_data", "answer": 1000.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding {}°C?"}
{"question": "What is the average irradiation time (h) for experiments using a UV–VIS light source?", "refer_dataset": "table10", "column names": ["light source", "irradiation time(h)"], "condition_column": {"light source": "="}, "answer_column": {"irradiation time(h)": "avg"}, "condition": {"light source": "=='UV–VIS'"}, "tool": "calculate_data", "answer": 5.098360655737705, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average irradiation time (h) for experiments using a {} light source?"}
{"question": "Find the average Dopant/Ti mole ratio used for Pollutant MB under Experimental Temperature 0°C and Light Wavelength 545 nm.", "refer_dataset": "table8", "column names": ["Dopant/Ti mole ratio", "Pollutant", "Experimental temperature(°C)", "Light wavelength(nm)"], "condition_column": {"Pollutant": "=", "Experimental temperature(°C)": "=", "Light wavelength(nm)": "="}, "answer_column": {"Dopant/Ti mole ratio": "avg"}, "condition": {"Pollutant": "=='MB'", "Experimental temperature(°C)": "=='0'", "Light wavelength(nm)": "=='545'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Dopant/Ti mole ratio used for Pollutant {} under Experimental Temperature {}°C and Light Wavelength {} nm."}
{"question": "What is the average Power(W) for materials where BandGap(eV) is less than 2.57?", "refer_dataset": "table4", "column names": ["BandGap(eV)", "Power(W)"], "condition_column": {"BandGap(eV)": "<"}, "answer_column": {"Power(W)": "avg"}, "condition": {"BandGap(eV)": "<2.57"}, "tool": "calculate_data", "answer": 328.2435897435897, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Power(W) for materials where BandGap(eV) is less than {}?"}
{"question": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to 82.71614631594176?", "refer_dataset": "table54", "column names": ["bulk modulus", "gap pbe"], "condition_column": {"bulk modulus": "="}, "answer_column": {"gap pbe": "avg"}, "condition": {"bulk modulus": "=='82.71614631594176'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average band gap (gap pbe) for materials with bulk modulus equal to {}?"}
{"question": "Find the average CH4-conversion% for reactions where Cation1 = 83.0, Contact-times > 0.04, and O2-pressure < 0.084.", "refer_dataset": "table20", "column names": ["Cation1", "Contact-times", "O2-pressure", "CH4-conversion%"], "condition_column": {"Cation1": "=", "Contact-times": ">", "O2-pressure": "<"}, "answer_column": {"CH4-conversion%": "avg"}, "condition": {"Cation1": "=='83.0'", "Contact-times": ">0.04", "O2-pressure": "<0.084"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average CH4-conversion% for reactions where Cation1 = {}, Contact-times > {}, and O2-pressure < {}."}
{"question": "Calculate the minimum Alcohol% for composites with A1 substitution nan, X1 equal to nan, and Surface Area(m2/g) above 2.4.", "refer_dataset": "table4", "column names": ["A1", "X1", "Surface Area(m2/g)", "Alcohol%"], "condition_column": {"A1": "=", "X1": "=", "Surface Area(m2/g)": ">"}, "answer_column": {"Alcohol%": "min"}, "condition": {"A1": "=='nan'", "X1": "=='nan'", "Surface Area(m2/g)": ">2.4"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum Alcohol% for composites with A1 substitution {}, X1 equal to {}, and Surface Area(m2/g) above {}."}
{"question": "What is the average calcination temperature (CT) for samples referenced in study [35]?", "refer_dataset": "table11", "column names": ["Ref.", "CT (℃)"], "condition_column": {"Ref.": "="}, "answer_column": {"CT (℃)": "avg"}, "condition": {"Ref.": "=='[35]'"}, "tool": "calculate_data", "answer": 700.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature (CT) for samples referenced in study {}?"}
{"question": "What is the average journal impact factor for research institutions located in Saudi Arabia?", "refer_dataset": "table13", "column names": ["Country", "IF"], "condition_column": {"Country": "="}, "answer_column": {"IF": "avg"}, "condition": {"Country": "=='Saudi Arabia'"}, "tool": "calculate_data", "answer": 5.999, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average journal impact factor for research institutions located in {}?"}
{"question": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below 849.83 K, the electron affinity of element A (EAa) exceeds 8.6 eV, and the hydrogen production rate (RH2) is higher than 4.1 µmol h⁻¹ g⁻¹.", "refer_dataset": "table3", "column names": ["A_Tm", "EAa", "RH2(µmol h-1 g-1)", "χpb"], "condition_column": {"A_Tm": "<", "EAa": ">", "RH2(µmol h-1 g-1)": ">"}, "answer_column": {"χpb": "median"}, "condition": {"A_Tm": "<849.83", "EAa": ">8.6", "RH2(µmol h-1 g-1)": ">4.1"}, "tool": "calculate_data", "answer": [{"χpb": 1.54}, {"χpb": 1.55}, {"χpb": 1.55}, {"χpb": 1.56}, {"χpb": 1.54}, {"χpb": 1.57}, {"χpb": 1.6}, {"χpb": 1.63}, {"χpb": 1.66}, {"χpb": 1.69}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.55}, {"χpb": 1.55}, {"χpb": 1.55}, {"χpb": 1.6}, {"χpb": 1.6}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.52}, {"χpb": 1.53}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.54}, {"χpb": 1.55}, {"χpb": 1.12}, {"χpb": 1.12}, {"χpb": 1.12}, {"χpb": 1.12}, {"χpb": 1.51}, {"χpb": 1.58}, {"χpb": 1.55}, {"χpb": 1.54}, {"χpb": 1.54}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Pauling electronegativity of element B (χpb) when the melting temperature of element A (A_Tm) is below {} K, the electron affinity of element A (EAa) exceeds {} eV, and the hydrogen production rate (RH2) is higher than {} µmol h⁻¹ g⁻¹."}
{"question": "Determine the average bulk modulus for materials where formation energy (e_form) is less than 0.0079532756249998.", "refer_dataset": "table56", "column names": ["bulk modulus", "e_form"], "condition_column": {"e_form": "<"}, "answer_column": {"bulk modulus": "avg"}, "condition": {"e_form": "<0.0079532756249998"}, "tool": "calculate_data", "answer": 152.60733512641485, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average bulk modulus for materials where formation energy (e_form) is less than {}."}
{"question": "What is the average overpotential in neutral conditions for studies using the nan method published in journals with an impact factor above 16.744?", "refer_dataset": "table13", "column names": ["Judge_Phys_Chem_Deposition", "Neutral_OVP", "IF"], "condition_column": {"Neutral_OVP": "=", "IF": ">"}, "answer_column": {"Judge_Phys_Chem_Deposition": "avg"}, "condition": {"Neutral_OVP": "=='nan'", "IF": ">16.744"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average overpotential in neutral conditions for studies using the {} method published in journals with an impact factor above {}?"}
{"question": "How many preparation methods resulted in SSA > 12.46 m²/g and AH < 4.0 hours?", "refer_dataset": "table11", "column names": ["SSA (m2 g -1 )", "AH (h)", "PM"], "condition_column": {"SSA (m2 g -1 )": ">", "AH (h)": "<"}, "answer_column": {"PM": "count"}, "condition": {"SSA (m2 g -1 )": ">12.46", "AH (h)": "<4.0"}, "tool": "calculate_data", "answer": 12, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many preparation methods resulted in SSA > {} m²/g and AH < {} hours?"}
{"question": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is 3.6918493473?", "refer_dataset": "table22", "column names": ["Lattice", "D_AtomN"], "condition_column": {"Lattice": "="}, "answer_column": {"D_AtomN": "median"}, "condition": {"Lattice": "=='3.6918493473'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Atomic Number of Element D (D_AtomN) when Lattice Parameter is {}?"}
{"question": "What is the average bulk_energy for bulk_formula Ni?", "refer_dataset": "table68", "column names": ["bulk_formula", "bulk_energy"], "condition_column": {"bulk_formula": "="}, "answer_column": {"bulk_energy": "avg"}, "condition": {"bulk_formula": "=='Ni'"}, "tool": "calculate_data", "answer": -149.05944, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average bulk_energy for bulk_formula {}?"}
{"question": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is Mo and C2 yield (%) exceeds 1.683193931%?", "refer_dataset": "table21", "column names": ["M2", "C2 yield (%)", "CH4 conversion (%)"], "condition_column": {"M2": "=", "C2 yield (%)": ">"}, "answer_column": {"CH4 conversion (%)": "min"}, "condition": {"M2": "=='Mo'", "C2 yield (%)": ">1.683193931"}, "tool": "calculate_data", "answer": 48.26126007, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum CH4 conversion (%) when the secondary metal component (M2) is {} and C2 yield (%) exceeds {}%?"}
{"question": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below 1.58?", "refer_dataset": "table3", "column names": ["χpb", "ρb"], "condition_column": {"χpb": "<"}, "answer_column": {"ρb": "avg"}, "condition": {"χpb": "<1.58"}, "tool": "calculate_data", "answer": 7.187924528301882, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average density of element B (ρb) for materials where the Pauling electronegativity of element B (χpb) is below {}?"}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 25.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">25.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.7, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "What is the average reaction energy for elements with atomic number greater than 30?", "refer_dataset": "table18", "column names": ["A_AtimicN", "reaction_energy"], "condition_column": {"A_AtimicN": ">"}, "answer_column": {"reaction_energy": "avg"}, "condition": {"A_AtimicN": ">30"}, "tool": "calculate_data", "answer": 0.029404946236559044, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average reaction energy for elements with atomic number greater than {}?"}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is Eu, Support is BaO, and CH4/O2 ratio is 4?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='Eu'", "Support": "=='BaO'", "CH4/O2 (mol/mol)": "=='4'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -1.30193535262703 and Gibbs free energy (G) under 4.57570144279915.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-1.30193535262703", "G": "<4.57570144279915"}, "tool": "calculate_data", "answer": -1.971845559650529, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "Identify materials where enthalpy (H) is greater than -33.105018615722656, energy gap (gap) is less than 9.347110748291016, and R² spatial extent is above 187.1015014648437. What is their maximum internal energy (U)?", "refer_dataset": "table60", "column names": ["H", "gap", "r2", "U"], "condition_column": {"H": ">", "gap": "<", "r2": ">"}, "answer_column": {"U": "max"}, "condition": {"H": ">-33.105018615722656", "gap": "<9.347110748291016", "r2": ">187.1015014648437"}, "tool": "calculate_data", "answer": -18.64750099182129, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify materials where enthalpy (H) is greater than {}, energy gap (gap) is less than {}, and R² spatial extent is above {}. What is their maximum internal energy (U)?"}
{"question": "What is the maximum pH observed where Degradation efficiency (%) is greater than 2.2?", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "pH"], "condition_column": {"pH": ">"}, "answer_column": {"Degradation efficiency (%)": "max"}, "condition": {"pH": ">2.2"}, "tool": "calculate_data", "answer": 99.6, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH observed where Degradation efficiency (%) is greater than {}?"}
{"question": "For materials in space group symbol P-6m2, what is the minimum stress tensor value observed?", "refer_dataset": "table59", "column names": ["spacegroup_symbol", "stress"], "condition_column": {"spacegroup_symbol": "="}, "answer_column": {"stress": "min"}, "condition": {"spacegroup_symbol": "=='P-6m2'"}, "tool": "calculate_data", "answer": "[[9.760614108498151e-05, -1.9442739315533424e-20, -6.419555958282301e-33], [0.0, 9.760614108576202e-05, 7.412664721213945e-33], [-6.419555958282301e-33, 7.412664721213945e-33, 0.00022778295392866463]]", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials in space group symbol {}, what is the minimum stress tensor value observed?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than 2.014?", "refer_dataset": "table2", "column names": ["Ra/Rb", "Eg(eV)"], "condition_column": {"Ra/Rb": ">"}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Ra/Rb": ">2.014"}, "tool": "calculate_data", "answer": 2.7225, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than {}?"}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 4.59587971770934?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">4.59587971770934"}, "tool": "calculate_data", "answer": -3.2827275827762, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "What is the maximum CH4 conversion (%) recorded when M1 is Zn, temperature exceeds 900°C, and total flow is below 15 mL/min?", "refer_dataset": "table21", "column names": ["M1", "Temp. (°C)", "Total flow(mL/min)", "CH4 conversion (%)"], "condition_column": {"M1": "=", "Temp. (°C)": ">", "Total flow(mL/min)": "<"}, "answer_column": {"CH4 conversion (%)": "max"}, "condition": {"M1": "=='Zn'", "Temp. (°C)": ">900", "Total flow(mL/min)": "<15"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum CH4 conversion (%) recorded when M1 is {}, temperature exceeds {}°C, and total flow is below {} mL/min?"}
{"question": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > 0.0159, scf_vbm < 5.176, and formula contains 'AlAs'?", "refer_dataset": "table66", "column names": ["surf_cbm", "scf_vbm", "formula", "efermi"], "condition_column": {"surf_cbm": ">", "scf_vbm": "<", "formula": "="}, "answer_column": {"efermi": "min"}, "condition": {"surf_cbm": ">0.0159", "scf_vbm": "<5.176", "formula": "=='AlAs'"}, "tool": "calculate_data", "answer": -0.7571358, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fermi energy (efermi) among materials where surf_cbm > {}, scf_vbm < {}, and formula contains '{}'?"}
{"question": "What is the minimum elastic anisotropy for materials with energy above convex hull (e_hull) greater than 0.016793421850286?", "refer_dataset": "table54", "column names": ["e_hull", "elastic anisotropy"], "condition_column": {"e_hull": ">"}, "answer_column": {"elastic anisotropy": "min"}, "condition": {"e_hull": ">0.016793421850286"}, "tool": "calculate_data", "answer": 401.4952807290347, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum elastic anisotropy for materials with energy above convex hull (e_hull) greater than {}?"}
{"question": "What is the minimum e_hull value for materials with bulk modulus exceeding 152.18624906952934?", "refer_dataset": "table56", "column names": ["e_hull", "bulk modulus"], "condition_column": {"bulk modulus": ">"}, "answer_column": {"e_hull": "min"}, "condition": {"bulk modulus": ">152.18624906952934"}, "tool": "calculate_data", "answer": 1.4979131938099997, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum e_hull value for materials with bulk modulus exceeding {}?"}
{"question": "What is the average Degradation efficiency (%) when pH is 3.45?", "refer_dataset": "table6", "column names": ["pH", "Degradation efficiency (%)"], "condition_column": {"pH": "="}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"pH": "=='3.45'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Degradation efficiency (%) when pH is {}?"}
{"question": "Determine the average LUMO energy for materials with polarizability (alpha) less than 35.529998779296875?", "refer_dataset": "table60", "column names": ["alpha", "lumo"], "condition_column": {"alpha": "<"}, "answer_column": {"lumo": "avg"}, "condition": {"alpha": "<35.529998779296875"}, "tool": "calculate_data", "answer": 0.34290880740930635, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average LUMO energy for materials with polarizability (alpha) less than {}?"}
{"question": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above 0.55853852.", "refer_dataset": "table66", "column names": ["efermi", "final_energy"], "condition_column": {"efermi": ">"}, "answer_column": {"final_energy": "min"}, "condition": {"efermi": ">0.55853852"}, "tool": "calculate_data", "answer": 47.1431938, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above {}."}
{"question": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals 4.0015537?", "refer_dataset": "table67", "column names": ["exfoliation_energy_per_atom", "total_magnetization"], "condition_column": {"total_magnetization": "="}, "answer_column": {"exfoliation_energy_per_atom": "max"}, "condition": {"total_magnetization": "=='4.0015537'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest exfoliation_energy_per_atom among materials where total_magnetization equals {}?"}
{"question": "What is the maximum PLD observed in compounds with a topology of cds and synthesized status True?", "refer_dataset": "table62", "column names": ["topology", "synthesized", "pld"], "condition_column": {"topology": "=", "synthesized": "="}, "answer_column": {"pld": "max"}, "condition": {"topology": "=='cds'", "synthesized": "=='True'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum PLD observed in compounds with a topology of {} and synthesized status {}?"}
{"question": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than 41.505 eV.", "refer_dataset": "table3", "column names": ["EAa", "Ra"], "condition_column": {"EAa": ">"}, "answer_column": {"Ra": "max"}, "condition": {"EAa": ">41.505"}, "tool": "calculate_data", "answer": 139.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum atomic radius of element A (Ra) when the electron affinity of element A (EAa) is greater than {} eV."}
{"question": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is nan and Alcohol% exceeds 10.0?", "refer_dataset": "table4", "column names": ["Sac. Agent2", "Alcohol%", "ProdRate(μmol/g)"], "condition_column": {"Sac. Agent2": "=", "Alcohol%": ">"}, "answer_column": {"ProdRate(μmol/g)": "max"}, "condition": {"Sac. Agent2": "=='nan'", "Alcohol%": ">10.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest ProdRate(μmol/g) when Sac. Agent2 is {} and Alcohol% exceeds {}?"}
{"question": "Find the average Degradation efficiency (%) for Material MIL-101 when Catalyst dosage (g/L) > 0.1, Illumination time (min) > 5, and pH < 4.1.", "refer_dataset": "table6", "column names": ["Material", "Catalyst dosage (g/L)", "Illumination time (min)", "pH", "Degradation efficiency (%)"], "condition_column": {"Material": "=", "Catalyst dosage (g/L)": ">", "Illumination time (min)": ">", "pH": "<"}, "answer_column": {"Degradation efficiency (%)": "avg"}, "condition": {"Material": "=='MIL-101'", "Catalyst dosage (g/L)": ">0.1", "Illumination time (min)": ">5", "pH": "<4.1"}, "tool": "calculate_data", "answer": 20.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Degradation efficiency (%) for Material {} when Catalyst dosage (g/L) > {}, Illumination time (min) > {}, and pH < {}."}
{"question": "Calculate the maximum formation energy per atom for materials with space group number 187.", "refer_dataset": "table59", "column names": ["spacegroup_number", "f_enp"], "condition_column": {"spacegroup_number": "="}, "answer_column": {"f_enp": "max"}, "condition": {"spacegroup_number": "=='187'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum formation energy per atom for materials with space group number {}."}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -0.83800212145904 and Gibbs free energy (G) under 4.21956907244036.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-0.83800212145904", "G": "<4.21956907244036"}, "tool": "calculate_data", "answer": -2.054542781950207, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "What is the maximum pH recorded for Pollutant Phenol under Light Wavelength 365 nm?", "refer_dataset": "table8", "column names": ["Pollutant", "Light wavelength(nm)", "pH"], "condition_column": {"Pollutant": "=", "Light wavelength(nm)": "<"}, "answer_column": {"pH": "max"}, "condition": {"Pollutant": "=='Phenol'", "Light wavelength(nm)": "<365"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH recorded for Pollutant {} under Light Wavelength {} nm?"}
{"question": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx 139.", "refer_dataset": "table63", "column names": ["Space_group_rlx", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "="}, "answer_column": {"Band_gap_GGA": "max"}, "condition": {"Space_group_rlx": "=='139'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Band_gap_GGA in materials from Space_group_rlx {}."}
{"question": "What is the average Surface Area(m2/g) for materials with A equal to Sb, B equal to Ti, and Wave length(<nm) below 365.0?", "refer_dataset": "table4", "column names": ["A", "B", "Wave length(<nm)", "Surface Area(m2/g)"], "condition_column": {"A": "=", "B": "=", "Wave length(<nm)": "<"}, "answer_column": {"Surface Area(m2/g)": "avg"}, "condition": {"A": "=='Sb'", "B": "=='Ti'", "Wave length(<nm)": "<365.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Area(m2/g) for materials with A equal to {}, B equal to {}, and Wave length(<nm) below {}?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than -1.71824475676759?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">-1.71824475676759"}, "tool": "calculate_data", "answer": -0.05110147674321974, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "Calculate the average A_AtomN for materials where Element B is H, Cn exceeds 1, and Formation Energy is below 1.02?", "refer_dataset": "table22", "column names": ["B", "Cn", "Formation_E", "A_AtomN"], "condition_column": {"B": "=", "Cn": ">", "Formation_E": "<"}, "answer_column": {"A_AtomN": "avg"}, "condition": {"B": "=='H'", "Cn": ">1", "Formation_E": "<1.02"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average A_AtomN for materials where Element B is {}, Cn exceeds {}, and Formation Energy is below {}?"}
{"question": "What is the maximum CH4 conversion (%) recorded when M1 is Zn, temperature exceeds 750°C, and total flow is below 15 mL/min?", "refer_dataset": "table21", "column names": ["M1", "Temp. (°C)", "Total flow(mL/min)", "CH4 conversion (%)"], "condition_column": {"M1": "=", "Temp. (°C)": ">", "Total flow(mL/min)": "<"}, "answer_column": {"CH4 conversion (%)": "max"}, "condition": {"M1": "=='Zn'", "Temp. (°C)": ">750", "Total flow(mL/min)": "<15"}, "tool": "calculate_data", "answer": 52.27734552, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum CH4 conversion (%) recorded when M1 is {}, temperature exceeds {}°C, and total flow is below {} mL/min?"}
{"question": "Identify compounds where crystal system is cubic and formation energy per atom is less than 0.2582. What is their average final energy?", "refer_dataset": "table59", "column names": ["crystal_system", "f_enp", "final_energy"], "condition_column": {"crystal_system": "=", "f_enp": "<"}, "answer_column": {"final_energy": "avg"}, "condition": {"crystal_system": "=='cubic'", "f_enp": "<0.2582"}, "tool": "calculate_data", "answer": -122.29887622103318, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Identify compounds where crystal system is {} and formation energy per atom is less than {}. What is their average final energy?"}
{"question": "List references (Ref) where initial concentration (C0) is greater than 25.0 mg/L.", "refer_dataset": "table9", "column names": ["Ref", "C0, mg/L"], "condition_column": {"C0, mg/L": ">"}, "answer_column": {"Ref": ""}, "condition": {"C0, mg/L": ">25.0"}, "tool": "calculate_data", "answer": [{"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 17}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 22}, {"Ref": 25}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 26}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 28}, {"Ref": 30}, {"Ref": 30}, {"Ref": 30}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 33}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 34}, {"Ref": 35}, {"Ref": 35}, {"Ref": 36}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 37}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 38}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 40}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}, {"Ref": 41}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List references (Ref) where initial concentration (C0) is greater than {} mg/L."}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is 0.54135950548886.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='0.54135950548886'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is KOH?", "refer_dataset": "table4", "column names": ["Sac. Agent1", "Surface Area(m2/g)"], "condition_column": {"Sac. Agent1": "="}, "answer_column": {"Surface Area(m2/g)": "max"}, "condition": {"Sac. Agent1": "=='KOH'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is {}?"}
{"question": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above 6.040620368786964.", "refer_dataset": "table66", "column names": ["avg_max", "surf_cbm"], "condition_column": {"avg_max": ">"}, "answer_column": {"surf_cbm": "min"}, "condition": {"avg_max": ">6.040620368786964"}, "tool": "calculate_data", "answer": 4.9916, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above {}."}
{"question": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding 85.0°C?", "refer_dataset": "table7", "column names": ["Synhesis_Temp", "Reactor_Volume"], "condition_column": {"Synhesis_Temp": ">"}, "answer_column": {"Reactor_Volume": "min"}, "condition": {"Synhesis_Temp": ">85.0"}, "tool": "calculate_data", "answer": 1000.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum reactor volume required for experiments with synthesis temperatures exceeding {}°C?"}
{"question": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > 0.65611?", "refer_dataset": "table63", "column names": ["Band_gap_HSE_optical", "Band_gap_GGA"], "condition_column": {"Band_gap_HSE_optical": ">"}, "answer_column": {"Band_gap_GGA": "min"}, "condition": {"Band_gap_HSE_optical": ">0.65611"}, "tool": "calculate_data", "answer": 9.123469, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Band_gap_GGA when Band_gap_HSE_optical > {}?"}
{"question": "Retrieve the ID with the highest Tc for materials where formula contains Nb0.2V0.8 and Tc exceeds 4.03.", "refer_dataset": "table65", "column names": ["id", "formula", "Tc"], "condition_column": {"formula": "=", "Tc": ">"}, "answer_column": {"id": "max"}, "condition": {"formula": "=='Nb0.2V0.8'", "Tc": ">4.03"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Retrieve the ID with the highest Tc for materials where formula contains {} and Tc exceeds {}."}
{"question": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than 142.63 g/mol.", "refer_dataset": "table3", "column names": ["M", "χpa"], "condition_column": {"M": ">"}, "answer_column": {"χpa": "max"}, "condition": {"M": ">142.63"}, "tool": "calculate_data", "answer": 1.81, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than {} g/mol."}
{"question": "Calculate the minimum CH4-pressure when C2-selectivity is greater than 42.9%?", "refer_dataset": "table20", "column names": ["CH4-pressure", "C2-selectivity"], "condition_column": {"C2-selectivity": ">"}, "answer_column": {"CH4-pressure": "min"}, "condition": {"C2-selectivity": ">42.9"}, "tool": "calculate_data", "answer": 2.7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum CH4-pressure when C2-selectivity is greater than {}%?"}
{"question": "What is the average Surface Energy (surf_en) for materials with the chemical formula 'BaGaSb'?", "refer_dataset": "table66", "column names": ["formula", "surf_en"], "condition_column": {"formula": "="}, "answer_column": {"surf_en": "avg"}, "condition": {"formula": "=='BaGaSb'"}, "tool": "calculate_data", "answer": -0.6812256643469425, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Energy (surf_en) for materials with the chemical formula '{}'?"}
{"question": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"NM\", SOC True, and Direct_or_indirect_HSE \"Direct\"?", "refer_dataset": "table63", "column names": ["Magnetic_ordering", "SOC", "Direct_or_indirect_HSE", "Band_gap_HSE"], "condition_column": {"Magnetic_ordering": "=", "SOC": "=", "Direct_or_indirect_HSE": "="}, "answer_column": {"Band_gap_HSE": "max"}, "condition": {"Magnetic_ordering": "=='NM'", "SOC": "=='True'", "Direct_or_indirect_HSE": "=='Direct'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Band_gap_HSE for materials with Magnetic_ordering \"{}\", SOC {}, and Direct_or_indirect_HSE \"{}\"?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -7.47598993754859.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-7.47598993754859"}, "tool": "calculate_data", "answer": 6.53867256157596, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "How many Preparations use both Anion1 0.0 and Support1 13.0, with C2-yield ≥ 0.0%?", "refer_dataset": "table20", "column names": ["Anion1", "Support1", "C2-yield", "Preparation"], "condition_column": {"Anion1": "=", "Support1": "=", "C2-yield": ">="}, "answer_column": {"Preparation": "count"}, "condition": {"Anion1": "=='0.0'", "Support1": "=='13.0'", "C2-yield": ">=0.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations use both Anion1 {} and Support1 {}, with C2-yield ≥ {}%?"}
{"question": "Determine the average journal impact factor for articles using 0 method in Peoples R China country with overpotential below 120.0 in neutral conditions.", "refer_dataset": "table13", "column names": ["Judge_Sol_Gel", "Country", "IF", "Neutral_OVP"], "condition_column": {"Judge_Sol_Gel": "=", "Country": "=", "Neutral_OVP": "<"}, "answer_column": {"IF": "avg"}, "condition": {"Judge_Sol_Gel": "=='0'", "Country": "=='Peoples R China'", "Neutral_OVP": "<120.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average journal impact factor for articles using {} method in {} country with overpotential below {} in neutral conditions."}
{"question": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is Na2S?", "refer_dataset": "table4", "column names": ["Sac. Agent1", "Surface Area(m2/g)"], "condition_column": {"Sac. Agent1": "="}, "answer_column": {"Surface Area(m2/g)": "max"}, "condition": {"Sac. Agent1": "=='Na2S'"}, "tool": "calculate_data", "answer": 206.5, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is {}?"}
{"question": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds -7.126661777496338, internal energy at 0K (U0) is below -33.006595611572266, and Gibbs free energy (G) equals -30.76029586791992?", "refer_dataset": "table60", "column names": ["homo", "U0", "G", "Cv"], "condition_column": {"homo": ">", "U0": "<", "G": "="}, "answer_column": {"Cv": "min"}, "condition": {"homo": ">-7.126661777496338", "U0": "<-33.006595611572266", "G": "=='-30.76029586791992'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum heat capacity (Cv) for materials where HOMO energy exceeds {}, internal energy at 0K (U0) is below {}, and Gibbs free energy (G) equals {}?"}
{"question": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above 4, support material BaO, and argon pressure 0.7 atm.", "refer_dataset": "table21", "column names": ["CH4/O2 (mol/mol)", "Support", "PAr (atm)", "C2 selectivity(%)"], "condition_column": {"CH4/O2 (mol/mol)": ">", "Support": "=", "PAr (atm)": "="}, "answer_column": {"C2 selectivity(%)": "min"}, "condition": {"CH4/O2 (mol/mol)": ">4", "Support": "=='BaO'", "PAr (atm)": "=='0.7'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum C2 selectivity(%) for experiments with CH4/O2 ratio above {}, support material {}, and argon pressure {} atm."}
{"question": "What is the maximum chem_pot where wycoff position is a and bulk_energy is above -664.97328?", "refer_dataset": "table68", "column names": ["wycoff", "bulk_energy", "chem_pot"], "condition_column": {"wycoff": "=", "bulk_energy": ">"}, "answer_column": {"chem_pot": "max"}, "condition": {"wycoff": "=='a'", "bulk_energy": ">-664.97328"}, "tool": "calculate_data", "answer": 2.52891025, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum chem_pot where wycoff position is {} and bulk_energy is above {}?"}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 1.0414.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<1.0414"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "What is the maximum Tc for materials with formula containing Pr0.91La1Ce0.09Cu1O4?", "refer_dataset": "table65", "column names": ["formula", "Tc"], "condition_column": {"formula": "="}, "answer_column": {"Tc": "max"}, "condition": {"formula": "=='Pr0.91La1Ce0.09Cu1O4'"}, "tool": "calculate_data", "answer": 24.6, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Tc for materials with formula containing {}?"}
{"question": "What is the average number of atoms per structure in materials with a crystal system of tetragonal and space group symbol P4/mmm?", "refer_dataset": "table59", "column names": ["crystal_system", "spacegroup_symbol", "natoms"], "condition_column": {"crystal_system": "=", "spacegroup_symbol": "="}, "answer_column": {"natoms": "avg"}, "condition": {"crystal_system": "=='tetragonal'", "spacegroup_symbol": "=='P4/mmm'"}, "tool": "calculate_data", "answer": 2.2589285714285716, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average number of atoms per structure in materials with a crystal system of {} and space group symbol {}?"}
{"question": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than 0.405690829361882.", "refer_dataset": "table57", "column names": ["_oqmd_delta_e", "_oqmd_stability"], "condition_column": {"_oqmd_delta_e": ">"}, "answer_column": {"_oqmd_stability": "min"}, "condition": {"_oqmd_delta_e": ">0.405690829361882"}, "tool": "calculate_data", "answer": 4.152984231249998, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum _oqmd_stability value where _oqmd_delta_e is greater than {}."}
{"question": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is Ethyl acetate, temperature (T) is 40°C, and initial concentration (C0) is below 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "C0, mg/L", "-log(k), min-1"], "condition_column": {"OC": "=", "T, oC": "=", "C0, mg/L": "<"}, "answer_column": {"-log(k), min-1": "max"}, "condition": {"OC": "=='Ethyl acetate'", "T, oC": "=='40'", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the highest reaction rate (-log(k)) observed when organic compound (OC) is {}, temperature (T) is {}°C, and initial concentration (C0) is below {} mg/L."}
{"question": "Calculate the average Band_gap_GGA for Space_group_rlx 33, SOC False, and Magnetic_ordering \"FM\".", "refer_dataset": "table63", "column names": ["Space_group_rlx", "SOC", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Space_group_rlx": "=", "SOC": "=", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "avg"}, "condition": {"Space_group_rlx": "=='33'", "SOC": "=='False'", "Magnetic_ordering": "=='FM'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average Band_gap_GGA for Space_group_rlx {}, SOC {}, and Magnetic_ordering \"{}\"."}
{"question": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > 12.0 when Surface area (m2/g) > 180.41 and Material is MIL-101.", "refer_dataset": "table6", "column names": ["Degradation efficiency (%)", "Surface area (m2/g)", "Material", "Catalyst dosage (g/L)"], "condition_column": {"Degradation efficiency (%)": ">", "Surface area (m2/g)": ">", "Material": "="}, "answer_column": {"Catalyst dosage (g/L)": "min"}, "condition": {"Degradation efficiency (%)": ">12.0", "Surface area (m2/g)": ">180.41", "Material": "=='MIL-101'"}, "tool": "calculate_data", "answer": 0.7, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum Catalyst dosage (g/L) required for Degradation efficiency (%) > {} when Surface area (m2/g) > {} and Material is {}."}
{"question": "What is the highest argon partial pressure (atm) in catalysts where M3 is W, Support is La2O3, and CH4/O2 ratio is 2?", "refer_dataset": "table21", "column names": ["M3", "Support", "CH4/O2 (mol/mol)", "PAr (atm)"], "condition_column": {"M3": "=", "Support": "=", "CH4/O2 (mol/mol)": "="}, "answer_column": {"PAr (atm)": "max"}, "condition": {"M3": "=='W'", "Support": "=='La2O3'", "CH4/O2 (mol/mol)": "=='2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest argon partial pressure (atm) in catalysts where M3 is {}, Support is {}, and CH4/O2 ratio is {}?"}
{"question": "What is the highest Lattice Parameter observed when A_AtomN is 12.0, B_AtomN > 83.0, and Volume < 68.0188498248?", "refer_dataset": "table22", "column names": ["A_AtomN", "B_AtomN", "Volume", "Lattice"], "condition_column": {"A_AtomN": "=", "B_AtomN": ">", "Volume": "<"}, "answer_column": {"Lattice": "max"}, "condition": {"A_AtomN": "=='12.0'", "B_AtomN": ">83.0", "Volume": "<68.0188498248"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Lattice Parameter observed when A_AtomN is {}, B_AtomN > {}, and Volume < {}?"}
{"question": "What is the average formation energy (ef) for bulk_formula Ru and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Ru'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 2.7113, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than 1.95 g/cm³?", "refer_dataset": "table3", "column names": ["ρa", "EAb"], "condition_column": {"ρa": "<"}, "answer_column": {"EAb": "max"}, "condition": {"ρa": "<1.95"}, "tool": "calculate_data", "answer": 86.2, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest electron affinity of element B (EAb) when the density of element A (ρa) is less than {} g/cm³?"}
{"question": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding 6.11e-05?", "refer_dataset": "table54", "column names": ["mu_b", "shear modulus"], "condition_column": {"mu_b": ">"}, "answer_column": {"shear modulus": "max"}, "condition": {"mu_b": ">6.11e-05"}, "tool": "calculate_data", "answer": 347.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus among materials with magnetic moment (mu_b) exceeding {}?"}
{"question": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above 6.27417471410908?", "refer_dataset": "table61", "column names": ["G", "Cv"], "condition_column": {"G": ">"}, "answer_column": {"Cv": "min"}, "condition": {"G": ">6.27417471410908"}, "tool": "calculate_data", "answer": -6.29834488537368, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum heat capacity (Cv) for samples with Gibbs free energy (G) above {}?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Direct\", Band_gap_HSE_optical < 3.055806, and Magnetic_ordering \"NM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Direct'", "Band_gap_HSE_optical": "<3.055806", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 1.137147}, {"Band_gap_GGA": 1.07639}, {"Band_gap_GGA": 0.684651}, {"Band_gap_GGA": 0.29665}, {"Band_gap_GGA": 1.253241}, {"Band_gap_GGA": 1.521543}, {"Band_gap_GGA": 1.6843169999999996}, {"Band_gap_GGA": 1.080963}, {"Band_gap_GGA": 0.041666}, {"Band_gap_GGA": 1.958661}, {"Band_gap_GGA": 1.015877}, {"Band_gap_GGA": 0.522174}, {"Band_gap_GGA": 1.465159}, {"Band_gap_GGA": 1.460508}, {"Band_gap_GGA": 1.461365}, {"Band_gap_GGA": 1.254096}, {"Band_gap_GGA": 1.0671210000000002}, {"Band_gap_GGA": 1.321603}, {"Band_gap_GGA": 0.905913}, {"Band_gap_GGA": 0.908602}, {"Band_gap_GGA": 0.2437109999999998}, {"Band_gap_GGA": 0.227571}, {"Band_gap_GGA": 1.265602}, {"Band_gap_GGA": 1.200399}, {"Band_gap_GGA": 0.673361}, {"Band_gap_GGA": 1.338733}, {"Band_gap_GGA": 1.352438}, {"Band_gap_GGA": 1.398201}, {"Band_gap_GGA": 1.366053}, {"Band_gap_GGA": 0.287844}, {"Band_gap_GGA": 0.421518}, {"Band_gap_GGA": 0.059662}, {"Band_gap_GGA": 0.284829}, {"Band_gap_GGA": 0.473079}, {"Band_gap_GGA": 1.378346}, {"Band_gap_GGA": 0.178726}, {"Band_gap_GGA": 1.2108659999999998}, {"Band_gap_GGA": 1.547412}, {"Band_gap_GGA": 1.557226}, {"Band_gap_GGA": 0.1042529999999999}, {"Band_gap_GGA": 1.372531}, {"Band_gap_GGA": 0.7822870000000002}, {"Band_gap_GGA": 1.2304019999999998}, {"Band_gap_GGA": 0.8669199999999999}, {"Band_gap_GGA": 0.6606369999999995}, {"Band_gap_GGA": 0.480542}, {"Band_gap_GGA": 1.102893}, {"Band_gap_GGA": 0.798446}, {"Band_gap_GGA": 0.508781}, {"Band_gap_GGA": 0.73837}, {"Band_gap_GGA": 1.797742}, {"Band_gap_GGA": 0.867832}, {"Band_gap_GGA": 0.371746}, {"Band_gap_GGA": 1.616284}, {"Band_gap_GGA": 0.662986}, {"Band_gap_GGA": 1.175465}, {"Band_gap_GGA": 1.176696}, {"Band_gap_GGA": 1.049262}, {"Band_gap_GGA": 0.207128}, {"Band_gap_GGA": 0.927172}, {"Band_gap_GGA": 0.436412}, {"Band_gap_GGA": 0.796822}, {"Band_gap_GGA": 1.961104}, {"Band_gap_GGA": 0.240682}, {"Band_gap_GGA": 0.302014}, {"Band_gap_GGA": 1.197415}, {"Band_gap_GGA": 0.03858}, {"Band_gap_GGA": 0.152983}, {"Band_gap_GGA": 1.324563}, {"Band_gap_GGA": 0.710765}, {"Band_gap_GGA": 0.952427}, {"Band_gap_GGA": 1.04623}, {"Band_gap_GGA": 0.106556}, {"Band_gap_GGA": 0.138406}, {"Band_gap_GGA": 0.010467}, {"Band_gap_GGA": 0.7083599999999999}, {"Band_gap_GGA": 0.9607050000000004}, {"Band_gap_GGA": 0.902245}, {"Band_gap_GGA": 0.464569}, {"Band_gap_GGA": 0.458572}, {"Band_gap_GGA": 0.2903539999999998}, {"Band_gap_GGA": 0.648889}, {"Band_gap_GGA": 2.16183}, {"Band_gap_GGA": 1.281879}, {"Band_gap_GGA": 1.265878}, {"Band_gap_GGA": 0.379631}, {"Band_gap_GGA": 0.288977}, {"Band_gap_GGA": 1.225844}, {"Band_gap_GGA": 0.533118}, {"Band_gap_GGA": 1.11578}, {"Band_gap_GGA": 1.064508}, {"Band_gap_GGA": 1.1433990000000005}, {"Band_gap_GGA": 1.5065129999999995}, {"Band_gap_GGA": 1.710372}, {"Band_gap_GGA": 1.2426060000000003}, {"Band_gap_GGA": 0.135669}, {"Band_gap_GGA": 1.986926}, {"Band_gap_GGA": 1.590846}, {"Band_gap_GGA": 0.242306}, {"Band_gap_GGA": 1.319377}, {"Band_gap_GGA": 1.401464}, {"Band_gap_GGA": 1.062955}, {"Band_gap_GGA": 1.3102009999999995}, {"Band_gap_GGA": 1.684232}, {"Band_gap_GGA": 0.924117}, {"Band_gap_GGA": 1.627636}, {"Band_gap_GGA": 0.699347}, {"Band_gap_GGA": 0.962178}, {"Band_gap_GGA": 0.455467}, {"Band_gap_GGA": 0.5743109999999998}, {"Band_gap_GGA": 1.65122}, {"Band_gap_GGA": 1.0781509999999996}, {"Band_gap_GGA": 1.823492}, {"Band_gap_GGA": 0.678164}, {"Band_gap_GGA": 0.8268}, {"Band_gap_GGA": 1.299365}, {"Band_gap_GGA": 0.240142}, {"Band_gap_GGA": 0.680582}, {"Band_gap_GGA": 0.914581}, {"Band_gap_GGA": 0.183234}, {"Band_gap_GGA": 0.1812}, {"Band_gap_GGA": 1.240243}, {"Band_gap_GGA": 0.124343}, {"Band_gap_GGA": 0.943776}, {"Band_gap_GGA": 0.723736}, {"Band_gap_GGA": 0.525212}, {"Band_gap_GGA": 0.664029}, {"Band_gap_GGA": 0.717893}, {"Band_gap_GGA": 0.1012110000000001}, {"Band_gap_GGA": 1.02982}, {"Band_gap_GGA": 1.015464}, {"Band_gap_GGA": 1.065708}, {"Band_gap_GGA": 0.841825}, {"Band_gap_GGA": 0.7109800000000002}, {"Band_gap_GGA": 0.11566}, {"Band_gap_GGA": 0.163075}, {"Band_gap_GGA": 0.095012}, {"Band_gap_GGA": 0.576212}, {"Band_gap_GGA": 0.0501729999999991}, {"Band_gap_GGA": 1.161835}, {"Band_gap_GGA": 0.680086}, {"Band_gap_GGA": 0.1281699999999999}, {"Band_gap_GGA": 0.3171189999999999}, {"Band_gap_GGA": 0.3831039999999999}, {"Band_gap_GGA": 0.456402}, {"Band_gap_GGA": 0.617981}, {"Band_gap_GGA": 0.203862}, {"Band_gap_GGA": 0.670807}, {"Band_gap_GGA": 0.8609260000000001}, {"Band_gap_GGA": 0.471341}, {"Band_gap_GGA": 0.343373}, {"Band_gap_GGA": 0.525407}, {"Band_gap_GGA": 0.1007060000000001}, {"Band_gap_GGA": 1.488245}, {"Band_gap_GGA": 0.808349}, {"Band_gap_GGA": 0.735533}, {"Band_gap_GGA": 0.1350280000000001}, {"Band_gap_GGA": 0.525745}, {"Band_gap_GGA": 0.335461}, {"Band_gap_GGA": 0.202096}, {"Band_gap_GGA": 0.604702}, {"Band_gap_GGA": 0.485755}, {"Band_gap_GGA": 1.21075}, {"Band_gap_GGA": 0.873205}, {"Band_gap_GGA": 1.436761}, {"Band_gap_GGA": 1.112092}, {"Band_gap_GGA": 0.0156169999999997}, {"Band_gap_GGA": 0.296561}, {"Band_gap_GGA": 0.131433}, {"Band_gap_GGA": 0.53058}, {"Band_gap_GGA": 0.367797}, {"Band_gap_GGA": 0.175978}, {"Band_gap_GGA": 0.067083}, {"Band_gap_GGA": 0.50262}, {"Band_gap_GGA": 0.516517}, {"Band_gap_GGA": 0.274882}, {"Band_gap_GGA": 0.412032}, {"Band_gap_GGA": 0.162911}, {"Band_gap_GGA": 0.8009390000000001}, {"Band_gap_GGA": 0.1764369999999999}, {"Band_gap_GGA": 0.792818}, {"Band_gap_GGA": 1.8717}, {"Band_gap_GGA": 0.522287}, {"Band_gap_GGA": 0.441558}, {"Band_gap_GGA": 0.832407}, {"Band_gap_GGA": 1.095194}, {"Band_gap_GGA": 1.037218}, {"Band_gap_GGA": 1.078919}, {"Band_gap_GGA": 1.976483}, {"Band_gap_GGA": 1.244346}, {"Band_gap_GGA": 1.007073}, {"Band_gap_GGA": 1.038516}, {"Band_gap_GGA": 1.543938}, {"Band_gap_GGA": 1.884591}, {"Band_gap_GGA": 1.219491}, {"Band_gap_GGA": 1.996937}, {"Band_gap_GGA": 1.337492}, {"Band_gap_GGA": 0.927868}, {"Band_gap_GGA": 1.178519}, {"Band_gap_GGA": 1.423682}, {"Band_gap_GGA": 1.432506}, {"Band_gap_GGA": 2.059993}, {"Band_gap_GGA": 1.043368}, {"Band_gap_GGA": 0.8569}, {"Band_gap_GGA": 1.104767}, {"Band_gap_GGA": 1.194038}, {"Band_gap_GGA": 1.073826}, {"Band_gap_GGA": 1.643153}, {"Band_gap_GGA": 1.93811}, {"Band_gap_GGA": 1.954799}, {"Band_gap_GGA": 1.193137}, {"Band_gap_GGA": 1.400351}, {"Band_gap_GGA": 1.8763}, {"Band_gap_GGA": 0.1617000000000001}, {"Band_gap_GGA": 0.892632}, {"Band_gap_GGA": 0.2272}, {"Band_gap_GGA": 0.2496929999999997}, {"Band_gap_GGA": 1.15759}, {"Band_gap_GGA": 0.276941}, {"Band_gap_GGA": 1.586851}, {"Band_gap_GGA": 0.673759}, {"Band_gap_GGA": 1.965518}, {"Band_gap_GGA": 1.766701}, {"Band_gap_GGA": 1.296259}, {"Band_gap_GGA": 1.306961}, {"Band_gap_GGA": 1.110984}, {"Band_gap_GGA": 1.151854}, {"Band_gap_GGA": 0.933413}, {"Band_gap_GGA": 0.055628}, {"Band_gap_GGA": 1.871042}, {"Band_gap_GGA": 0.7006599999999992}, {"Band_gap_GGA": 0.850873}, {"Band_gap_GGA": 0.5459970000000007}, {"Band_gap_GGA": 0.8194119999999998}, {"Band_gap_GGA": 0.8477640000000006}, {"Band_gap_GGA": 0.096644}, {"Band_gap_GGA": 1.526263}, {"Band_gap_GGA": 1.236846}, {"Band_gap_GGA": 0.3041240000000007}, {"Band_gap_GGA": 2.034853}, {"Band_gap_GGA": 1.515163}, {"Band_gap_GGA": 0.678898}, {"Band_gap_GGA": 1.6424029999999998}, {"Band_gap_GGA": 1.330456}, {"Band_gap_GGA": 0.7683299999999997}, {"Band_gap_GGA": 0.296747}, {"Band_gap_GGA": 0.856754}, {"Band_gap_GGA": 1.639888}, {"Band_gap_GGA": 0.3624319999999996}, 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{"Band_gap_GGA": 1.457538}, {"Band_gap_GGA": 1.997233}, {"Band_gap_GGA": 0.949497}, {"Band_gap_GGA": 2.147805}, {"Band_gap_GGA": 2.14552}, {"Band_gap_GGA": 0.903644}, {"Band_gap_GGA": 1.743149}, {"Band_gap_GGA": 1.666143}, {"Band_gap_GGA": 1.549965}, {"Band_gap_GGA": 1.769321}, {"Band_gap_GGA": 1.573899}, {"Band_gap_GGA": 1.51003}, {"Band_gap_GGA": 0.654414}, {"Band_gap_GGA": 0.662021}, {"Band_gap_GGA": 1.732283}, {"Band_gap_GGA": 1.634283}, {"Band_gap_GGA": 1.634473}, {"Band_gap_GGA": 1.315377}, {"Band_gap_GGA": 1.717215}, {"Band_gap_GGA": 1.175897}, {"Band_gap_GGA": 1.015622}, {"Band_gap_GGA": 1.607063}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "Find the maximum C_AtomN in compounds with An (count of A) of 1.0, Indirect Bandgap < 0.0, and Lattice Parameter 4.0820322165?", "refer_dataset": "table22", "column names": ["An", "Indirect_Band", "Lattice", "C_AtomN"], "condition_column": {"An": "=", "Indirect_Band": "<", "Lattice": "="}, "answer_column": {"C_AtomN": "max"}, "condition": {"An": "=='1.0'", "Indirect_Band": "<0.0", "Lattice": "=='4.0820322165'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum C_AtomN in compounds with An (count of A) of {}, Indirect Bandgap < {}, and Lattice Parameter {}?"}
{"question": "List references (Ref) where initial concentration (C0) is greater than 192.35 mg/L.", "refer_dataset": "table9", "column names": ["Ref", "C0, mg/L"], "condition_column": {"C0, mg/L": ">"}, "answer_column": {"Ref": ""}, "condition": {"C0, mg/L": ">192.35"}, "tool": "calculate_data", "answer": [{"Ref": 26}, {"Ref": 26}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 27}, {"Ref": 40}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List references (Ref) where initial concentration (C0) is greater than {} mg/L."}
{"question": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than 2.55032827947553.", "refer_dataset": "table61", "column names": ["gap", "U"], "condition_column": {"gap": "<"}, "answer_column": {"U": "median"}, "condition": {"gap": "<2.55032827947553"}, "tool": "calculate_data", "answer": [{"U": 6.19311549745637}, {"U": 6.46228747900917}, {"U": 5.74085587987803}, {"U": 5.85213296706841}, {"U": 5.33647867089936}, {"U": 4.54692058907546}, {"U": 4.88454826774226}, {"U": 4.65046636299255}, {"U": 5.08173202918497}, {"U": 4.1619487412596}, {"U": 4.19426139798513}, {"U": 3.45857429185193}, {"U": 3.89538957257374}, {"U": 4.35309690497966}, {"U": 2.9854853300983}, {"U": 4.54103914731197}, {"U": 4.90660040833929}, {"U": 5.29113330359351}, {"U": 4.67922298140616}, {"U": 5.0469006208557}, {"U": 4.79314423521788}, {"U": 3.3592377594635}, {"U": 3.38768867877168}, {"U": 3.72489046894116}, {"U": 4.25325871252077}, {"U": 4.18815002868934}, {"U": 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1.11634693821948}, {"U": 0.79919587399094}, {"U": 1.55600757215339}, {"U": -0.42890717067269}, {"U": 0.07262748476338}, {"U": 0.34407261351043}, {"U": 0.07937376758584}, {"U": 0.84422770375275}, {"U": 0.34704076892728}, {"U": 0.85138942382106}, {"U": 1.1259411870669}, {"U": 0.02619257449201}, {"U": 0.80389893715144}, {"U": 0.52441679602566}, {"U": 1.2975141567878}, {"U": 0.78476008290106}, {"U": 1.2910160911877}, {"U": 1.57086141330198}, {"U": 0.7496203626535}, {"U": 0.74223655349151}, {"U": 1.04178248462256}, {"U": 1.21094382806727}, {"U": 1.50703300777535}, {"U": 1.20157689393926}, {"U": 1.50274538186069}, {"U": 1.08239082220064}, {"U": 1.38215361679965}, {"U": 1.55350188461399}, {"U": 1.85065186634606}, {"U": 1.54432307301241}, {"U": 1.84653407326775}, {"U": 0.74761633518455}, {"U": 1.2066170099596}, {"U": 1.04861499026963}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median internal energy (U) for molecules where the HOMO-LUMO gap (gap) is greater than {}."}
{"question": "What is the average Cation1-mol for Cation1 42?", "refer_dataset": "table20", "column names": ["Cation1", "Cation1-mol"], "condition_column": {"Cation1": "="}, "answer_column": {"Cation1-mol": "avg"}, "condition": {"Cation1": "=='42'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Cation1-mol for Cation1 {}?"}
{"question": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds 0.25.", "refer_dataset": "table6", "column names": ["Catalyst dosage (g/L)", "Pore Volume (cm3/g)"], "condition_column": {"Catalyst dosage (g/L)": ">"}, "answer_column": {"Pore Volume (cm3/g)": "avg"}, "condition": {"Catalyst dosage (g/L)": ">0.25"}, "tool": "calculate_data", "answer": 0.4301308900523555, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average Pore Volume (cm3/g) where Catalyst dosage (g/L) exceeds {}."}
{"question": "Calculate the average nanoparticle dose (D) for organic compound Ethanol under light intensity (I) > 0.176 mW/cm² and initial concentration (C0) < 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2", "C0, mg/L", "D, g/L"], "condition_column": {"OC": "=", "I, mW/cm2": ">", "C0, mg/L": "<"}, "answer_column": {"D, g/L": "avg"}, "condition": {"OC": "=='Ethanol'", "I, mW/cm2": ">0.176", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average nanoparticle dose (D) for organic compound {} under light intensity (I) > {} mW/cm² and initial concentration (C0) < {} mg/L."}
{"question": "What is the average formation energy (ef) for bulk_formula Cl and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Cl'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 1.10018, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > 89.0% in under 20.0 minutes of illumination for pH = 7.0?", "refer_dataset": "table8", "column names": ["Catalyst/Pollutant mass ratio", "Degradation rate(%)", "Illumination time(min)", "pH"], "condition_column": {"Degradation rate(%)": ">", "Illumination time(min)": "<", "pH": "="}, "answer_column": {"Catalyst/Pollutant mass ratio": ""}, "condition": {"Degradation rate(%)": ">89.0", "Illumination time(min)": "<20.0", "pH": "=='7.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What Catalyst/Pollutant mass ratio achieves Degradation Rate > {}% in under {} minutes of illumination for pH = {}?"}
{"question": "Compute the average Catalyst dosage (g/L) for experiments where pH equals 4.1.", "refer_dataset": "table6", "column names": ["pH", "Catalyst dosage (g/L)"], "condition_column": {"pH": "="}, "answer_column": {"Catalyst dosage (g/L)": "avg"}, "condition": {"pH": "=='4.1'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average Catalyst dosage (g/L) for experiments where pH equals {}."}
{"question": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above -0.9288966.", "refer_dataset": "table66", "column names": ["efermi", "final_energy"], "condition_column": {"efermi": ">"}, "answer_column": {"final_energy": "min"}, "condition": {"efermi": ">-0.9288966"}, "tool": "calculate_data", "answer": 485.35742061, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above {}."}
{"question": "Determine the average journal impact factor for articles using 0 method in Peoples R China country with overpotential below 157.0 in neutral conditions.", "refer_dataset": "table13", "column names": ["Judge_Sol_Gel", "Country", "IF", "Neutral_OVP"], "condition_column": {"Judge_Sol_Gel": "=", "Country": "=", "Neutral_OVP": "<"}, "answer_column": {"IF": "avg"}, "condition": {"Judge_Sol_Gel": "=='0'", "Country": "=='Peoples R China'", "Neutral_OVP": "<157.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average journal impact factor for articles using {} method in {} country with overpotential below {} in neutral conditions."}
{"question": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above 7.902 eV, the density of element B (ρb) exceeds 7.87 g/cm³, and the tolerance factor (t) is less than 0.89.", "refer_dataset": "table3", "column names": ["I1b", "ρb", "t", "A_Tb"], "condition_column": {"I1b": ">", "ρb": ">", "t": "<"}, "answer_column": {"A_Tb": "max"}, "condition": {"I1b": ">7.902", "ρb": ">7.87", "t": "<0.89"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above {} eV, the density of element B (ρb) exceeds {} g/cm³, and the tolerance factor (t) is less than {}."}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 3.97094210092494?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='3.97094210092494'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than 1.866?", "refer_dataset": "table2", "column names": ["Ra/Rb", "Eg(eV)"], "condition_column": {"Ra/Rb": ">"}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Ra/Rb": ">1.866"}, "tool": "calculate_data", "answer": 3.1197959183673465, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Bandgap Energy (Eg(eV)) for materials with a Radius Ratio (Ra/Rb) greater than {}?"}
{"question": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above 0.6905?", "refer_dataset": "table9", "column names": ["T, oC", "-log(k), min-1"], "condition_column": {"-log(k), min-1": ">"}, "answer_column": {"T, oC": "avg"}, "condition": {"-log(k), min-1": ">0.6905"}, "tool": "calculate_data", "answer": 27.825136612021858, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average temperature (T) for experiments with a reaction rate (-log(k)) above {}?"}
{"question": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than -1.77790756800166?", "refer_dataset": "table61", "column names": ["mu", "HOMO"], "condition_column": {"mu": ">"}, "answer_column": {"HOMO": "avg"}, "condition": {"mu": ">-1.77790756800166"}, "tool": "calculate_data", "answer": -0.075911168682299, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average HOMO energy for molecules with a dipole moment (mu) greater than {}?"}
{"question": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is -0.83800212145904.", "refer_dataset": "table61", "column names": ["mu", "omega1"], "condition_column": {"mu": "="}, "answer_column": {"omega1": "median"}, "condition": {"mu": "=='-0.83800212145904'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median primary vibrational frequency (omega1) when the dipole moment (mu) is {}."}
{"question": "What is the median Anion2-mol when CH4-pressure is 0.65?", "refer_dataset": "table20", "column names": ["Anion2-mol", "CH4-pressure"], "condition_column": {"CH4-pressure": "="}, "answer_column": {"Anion2-mol": "median"}, "condition": {"CH4-pressure": "=='0.65'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Anion2-mol when CH4-pressure is {}?"}
{"question": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to 6.08579953020717?", "refer_dataset": "table61", "column names": ["H", "gap"], "condition_column": {"H": "="}, "answer_column": {"gap": "min"}, "condition": {"H": "=='6.08579953020717'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum HOMO-LUMO gap (gap) for molecules with enthalpy (H) equal to {}?"}
{"question": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than 0.141497318749999?", "refer_dataset": "table57", "column names": ["_oqmd_stability", "_oqmd_band_gap"], "condition_column": {"_oqmd_stability": ">"}, "answer_column": {"_oqmd_band_gap": "avg"}, "condition": {"_oqmd_stability": ">0.141497318749999"}, "tool": "calculate_data", "answer": 0.01091218549580661, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average _oqmd_band_gap for materials with _oqmd_stability greater than {}?"}
{"question": "What is the average Yield (μmol/g/h) for experiments with Bandgap < 2.7 eV, light source UV, and Reaction medium liquid-solid?", "refer_dataset": "table10", "column names": ["Eg(eV)", "light source", "Reaction medium", "Yield (μmol/g/h)"], "condition_column": {"Eg(eV)": "<", "light source": "=", "Reaction medium": "="}, "answer_column": {"Yield (μmol/g/h)": "avg"}, "condition": {"Eg(eV)": "<2.7", "light source": "=='UV'", "Reaction medium": "=='liquid-solid'"}, "tool": "calculate_data", "answer": 94.66166666666668, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Yield (μmol/g/h) for experiments with Bandgap < {} eV, light source {}, and Reaction medium {}?"}
{"question": "What is the maximum bandgap observed in materials from source_id mp-30033?", "refer_dataset": "table67", "column names": ["source_id", "bandgap"], "condition_column": {"source_id": "="}, "answer_column": {"bandgap": "max"}, "condition": {"source_id": "=='mp-30033'"}, "tool": "calculate_data", "answer": 0.0431000000000003, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bandgap observed in materials from source_id {}?"}
{"question": "What is the minimum nanoparticle dose (D) used for organic compound Umbelliferone?", "refer_dataset": "table9", "column names": ["D, g/L", "OC"], "condition_column": {"OC": "="}, "answer_column": {"D, g/L": "min"}, "condition": {"OC": "=='Umbelliferone'"}, "tool": "calculate_data", "answer": 1.875, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum nanoparticle dose (D) used for organic compound {}?"}
{"question": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"Direct\", Band_gap_HSE_optical < 2.166236, and Magnetic_ordering \"NM\"?", "refer_dataset": "table63", "column names": ["Direct_or_indirect", "Band_gap_HSE_optical", "Magnetic_ordering", "Band_gap_GGA"], "condition_column": {"Direct_or_indirect": "=", "Band_gap_HSE_optical": "<", "Magnetic_ordering": "="}, "answer_column": {"Band_gap_GGA": "median"}, "condition": {"Direct_or_indirect": "=='Direct'", "Band_gap_HSE_optical": "<2.166236", "Magnetic_ordering": "=='NM'"}, "tool": "calculate_data", "answer": [{"Band_gap_GGA": 1.07639}, {"Band_gap_GGA": 0.684651}, {"Band_gap_GGA": 0.29665}, {"Band_gap_GGA": 1.080963}, {"Band_gap_GGA": 0.041666}, {"Band_gap_GGA": 1.015877}, {"Band_gap_GGA": 1.0671210000000002}, {"Band_gap_GGA": 1.321603}, {"Band_gap_GGA": 0.905913}, {"Band_gap_GGA": 0.908602}, {"Band_gap_GGA": 0.2437109999999998}, {"Band_gap_GGA": 0.227571}, {"Band_gap_GGA": 0.673361}, {"Band_gap_GGA": 0.287844}, {"Band_gap_GGA": 0.421518}, {"Band_gap_GGA": 0.059662}, {"Band_gap_GGA": 0.284829}, {"Band_gap_GGA": 0.473079}, {"Band_gap_GGA": 0.178726}, {"Band_gap_GGA": 1.2108659999999998}, {"Band_gap_GGA": 0.1042529999999999}, {"Band_gap_GGA": 0.7822870000000002}, {"Band_gap_GGA": 1.2304019999999998}, {"Band_gap_GGA": 0.8669199999999999}, {"Band_gap_GGA": 0.6606369999999995}, {"Band_gap_GGA": 0.480542}, {"Band_gap_GGA": 0.508781}, {"Band_gap_GGA": 0.73837}, {"Band_gap_GGA": 0.867832}, {"Band_gap_GGA": 0.371746}, {"Band_gap_GGA": 0.662986}, {"Band_gap_GGA": 1.176696}, {"Band_gap_GGA": 1.049262}, {"Band_gap_GGA": 0.207128}, {"Band_gap_GGA": 0.927172}, {"Band_gap_GGA": 0.436412}, {"Band_gap_GGA": 0.796822}, {"Band_gap_GGA": 0.240682}, {"Band_gap_GGA": 0.302014}, {"Band_gap_GGA": 1.197415}, {"Band_gap_GGA": 0.03858}, {"Band_gap_GGA": 0.152983}, {"Band_gap_GGA": 0.710765}, {"Band_gap_GGA": 0.952427}, {"Band_gap_GGA": 0.106556}, {"Band_gap_GGA": 0.138406}, {"Band_gap_GGA": 0.010467}, {"Band_gap_GGA": 0.7083599999999999}, {"Band_gap_GGA": 0.9607050000000004}, {"Band_gap_GGA": 0.902245}, {"Band_gap_GGA": 0.464569}, {"Band_gap_GGA": 0.458572}, {"Band_gap_GGA": 0.2903539999999998}, {"Band_gap_GGA": 0.648889}, {"Band_gap_GGA": 1.281879}, {"Band_gap_GGA": 1.265878}, {"Band_gap_GGA": 0.379631}, {"Band_gap_GGA": 0.288977}, {"Band_gap_GGA": 1.225844}, {"Band_gap_GGA": 0.533118}, {"Band_gap_GGA": 1.11578}, {"Band_gap_GGA": 1.064508}, {"Band_gap_GGA": 1.1433990000000005}, {"Band_gap_GGA": 1.2426060000000003}, {"Band_gap_GGA": 0.135669}, {"Band_gap_GGA": 0.242306}, {"Band_gap_GGA": 1.062955}, {"Band_gap_GGA": 1.3102009999999995}, {"Band_gap_GGA": 0.924117}, {"Band_gap_GGA": 0.699347}, {"Band_gap_GGA": 0.962178}, {"Band_gap_GGA": 0.455467}, {"Band_gap_GGA": 0.5743109999999998}, {"Band_gap_GGA": 1.0781509999999996}, {"Band_gap_GGA": 0.678164}, {"Band_gap_GGA": 0.8268}, {"Band_gap_GGA": 0.240142}, {"Band_gap_GGA": 0.914581}, {"Band_gap_GGA": 0.183234}, {"Band_gap_GGA": 0.1812}, {"Band_gap_GGA": 0.124343}, {"Band_gap_GGA": 0.943776}, {"Band_gap_GGA": 0.723736}, {"Band_gap_GGA": 0.525212}, {"Band_gap_GGA": 0.664029}, {"Band_gap_GGA": 0.717893}, {"Band_gap_GGA": 0.1012110000000001}, {"Band_gap_GGA": 1.02982}, {"Band_gap_GGA": 1.015464}, {"Band_gap_GGA": 1.065708}, {"Band_gap_GGA": 0.841825}, {"Band_gap_GGA": 0.7109800000000002}, {"Band_gap_GGA": 0.11566}, {"Band_gap_GGA": 0.163075}, {"Band_gap_GGA": 0.095012}, {"Band_gap_GGA": 0.576212}, {"Band_gap_GGA": 0.0501729999999991}, {"Band_gap_GGA": 1.161835}, {"Band_gap_GGA": 0.680086}, {"Band_gap_GGA": 0.1281699999999999}, {"Band_gap_GGA": 0.3171189999999999}, {"Band_gap_GGA": 0.3831039999999999}, {"Band_gap_GGA": 0.456402}, {"Band_gap_GGA": 0.617981}, {"Band_gap_GGA": 0.203862}, {"Band_gap_GGA": 0.670807}, {"Band_gap_GGA": 0.8609260000000001}, {"Band_gap_GGA": 0.471341}, {"Band_gap_GGA": 0.343373}, {"Band_gap_GGA": 0.525407}, {"Band_gap_GGA": 0.1007060000000001}, {"Band_gap_GGA": 1.488245}, {"Band_gap_GGA": 0.808349}, {"Band_gap_GGA": 0.735533}, {"Band_gap_GGA": 0.1350280000000001}, {"Band_gap_GGA": 0.525745}, {"Band_gap_GGA": 0.335461}, {"Band_gap_GGA": 0.202096}, {"Band_gap_GGA": 0.604702}, {"Band_gap_GGA": 0.485755}, {"Band_gap_GGA": 1.21075}, {"Band_gap_GGA": 1.436761}, {"Band_gap_GGA": 1.112092}, {"Band_gap_GGA": 0.0156169999999997}, {"Band_gap_GGA": 0.296561}, {"Band_gap_GGA": 0.131433}, {"Band_gap_GGA": 0.53058}, {"Band_gap_GGA": 0.367797}, {"Band_gap_GGA": 0.175978}, {"Band_gap_GGA": 0.067083}, {"Band_gap_GGA": 0.50262}, {"Band_gap_GGA": 0.516517}, {"Band_gap_GGA": 0.274882}, {"Band_gap_GGA": 0.412032}, {"Band_gap_GGA": 0.162911}, {"Band_gap_GGA": 0.8009390000000001}, {"Band_gap_GGA": 0.1764369999999999}, {"Band_gap_GGA": 0.792818}, {"Band_gap_GGA": 0.522287}, {"Band_gap_GGA": 0.441558}, {"Band_gap_GGA": 0.832407}, {"Band_gap_GGA": 1.095194}, {"Band_gap_GGA": 1.037218}, {"Band_gap_GGA": 1.078919}, {"Band_gap_GGA": 1.244346}, {"Band_gap_GGA": 1.007073}, {"Band_gap_GGA": 1.038516}, {"Band_gap_GGA": 1.219491}, {"Band_gap_GGA": 0.927868}, {"Band_gap_GGA": 1.178519}, {"Band_gap_GGA": 1.043368}, {"Band_gap_GGA": 0.8569}, {"Band_gap_GGA": 1.194038}, {"Band_gap_GGA": 1.073826}, {"Band_gap_GGA": 1.193137}, {"Band_gap_GGA": 0.1617000000000001}, {"Band_gap_GGA": 0.2272}, {"Band_gap_GGA": 0.2496929999999997}, {"Band_gap_GGA": 1.15759}, {"Band_gap_GGA": 0.276941}, {"Band_gap_GGA": 0.673759}, {"Band_gap_GGA": 1.296259}, {"Band_gap_GGA": 1.306961}, {"Band_gap_GGA": 1.110984}, {"Band_gap_GGA": 1.151854}, {"Band_gap_GGA": 0.933413}, {"Band_gap_GGA": 0.055628}, {"Band_gap_GGA": 0.7006599999999992}, {"Band_gap_GGA": 0.850873}, {"Band_gap_GGA": 0.5459970000000007}, {"Band_gap_GGA": 0.8194119999999998}, {"Band_gap_GGA": 0.8477640000000006}, {"Band_gap_GGA": 0.096644}, {"Band_gap_GGA": 1.236846}, {"Band_gap_GGA": 0.3041240000000007}, {"Band_gap_GGA": 0.678898}, {"Band_gap_GGA": 0.7683299999999997}, {"Band_gap_GGA": 0.296747}, {"Band_gap_GGA": 0.856754}, {"Band_gap_GGA": 0.3624319999999996}, {"Band_gap_GGA": 1.047733}, {"Band_gap_GGA": 0.4508980000000004}, {"Band_gap_GGA": 1.084781}, {"Band_gap_GGA": 1.3680070000000004}, {"Band_gap_GGA": 0.176768}, {"Band_gap_GGA": 1.062833}, {"Band_gap_GGA": 1.198334}, {"Band_gap_GGA": 1.053353}, {"Band_gap_GGA": 0.426338}, {"Band_gap_GGA": 0.076361}, {"Band_gap_GGA": 1.076875}, {"Band_gap_GGA": 0.684893}, {"Band_gap_GGA": 0.0880399999999999}, {"Band_gap_GGA": 0.594777}, {"Band_gap_GGA": 1.234772}, {"Band_gap_GGA": 0.052264}, {"Band_gap_GGA": 1.312658}, {"Band_gap_GGA": 0.6760039999999998}, {"Band_gap_GGA": 0.2383199999999998}, {"Band_gap_GGA": 1.1011969999999995}, {"Band_gap_GGA": 0.6758519999999999}, {"Band_gap_GGA": 0.481597}, {"Band_gap_GGA": 0.3921559999999999}, {"Band_gap_GGA": 0.5060239999999996}, {"Band_gap_GGA": 1.0181210000000005}, {"Band_gap_GGA": 0.574063}, {"Band_gap_GGA": 1.189558}, {"Band_gap_GGA": 0.531585}, {"Band_gap_GGA": 1.504866}, {"Band_gap_GGA": 0.213682}, {"Band_gap_GGA": 0.143524}, {"Band_gap_GGA": 0.885293}, {"Band_gap_GGA": 0.770421}, {"Band_gap_GGA": 0.984483}, {"Band_gap_GGA": 0.086018}, {"Band_gap_GGA": 0.3410599999999997}, {"Band_gap_GGA": 0.950668}, {"Band_gap_GGA": 0.874589}, {"Band_gap_GGA": 0.924818}, {"Band_gap_GGA": 0.848794}, {"Band_gap_GGA": 0.865236}, {"Band_gap_GGA": 0.86826}, {"Band_gap_GGA": 0.026395}, {"Band_gap_GGA": 0.177484}, {"Band_gap_GGA": 0.596343}, {"Band_gap_GGA": 0.903043}, {"Band_gap_GGA": 0.763741}, {"Band_gap_GGA": 1.114779}, {"Band_gap_GGA": 0.9474099999999996}, {"Band_gap_GGA": 1.1733320000000005}, {"Band_gap_GGA": 0.687912}, {"Band_gap_GGA": 0.622552}, {"Band_gap_GGA": 0.191293}, {"Band_gap_GGA": 0.089123}, {"Band_gap_GGA": 0.08064}, {"Band_gap_GGA": 0.853173}, {"Band_gap_GGA": 0.139055}, {"Band_gap_GGA": 0.688163}, {"Band_gap_GGA": 0.701328}, {"Band_gap_GGA": 1.223435}, {"Band_gap_GGA": 1.059131}, {"Band_gap_GGA": 0.887956}, {"Band_gap_GGA": 1.124759}, {"Band_gap_GGA": 0.871742}, {"Band_gap_GGA": 0.514311}, {"Band_gap_GGA": 0.290651}, {"Band_gap_GGA": 0.229379}, {"Band_gap_GGA": 0.076168}, {"Band_gap_GGA": 0.053609}, {"Band_gap_GGA": 0.910269}, {"Band_gap_GGA": 0.998991}, {"Band_gap_GGA": 0.481838}, {"Band_gap_GGA": 1.36553}, {"Band_gap_GGA": 0.7076389999999999}, {"Band_gap_GGA": 0.566589}, {"Band_gap_GGA": 1.22023}, {"Band_gap_GGA": 0.738553}, {"Band_gap_GGA": 0.764115}, {"Band_gap_GGA": 0.598213}, {"Band_gap_GGA": 0.863919}, {"Band_gap_GGA": 0.615373}, {"Band_gap_GGA": 0.323051}, {"Band_gap_GGA": 0.209953}, {"Band_gap_GGA": 0.817623}, {"Band_gap_GGA": 0.557067}, {"Band_gap_GGA": 1.229463}, {"Band_gap_GGA": 0.419048}, {"Band_gap_GGA": 1.308224}, {"Band_gap_GGA": 0.066141}, {"Band_gap_GGA": 0.337935}, {"Band_gap_GGA": 0.160178}, {"Band_gap_GGA": 1.080185}, {"Band_gap_GGA": 0.229184}, {"Band_gap_GGA": 0.062749}, {"Band_gap_GGA": 0.107766}, {"Band_gap_GGA": 0.0562809999999998}, {"Band_gap_GGA": 1.036323}, {"Band_gap_GGA": 0.7615030000000003}, {"Band_gap_GGA": 0.067216}, {"Band_gap_GGA": 0.847272}, {"Band_gap_GGA": 0.694658}, {"Band_gap_GGA": 0.019902}, {"Band_gap_GGA": 0.314184}, {"Band_gap_GGA": 0.643368}, {"Band_gap_GGA": 0.486282}, {"Band_gap_GGA": 1.03743}, {"Band_gap_GGA": 0.584094}, {"Band_gap_GGA": 0.949039}, {"Band_gap_GGA": 0.724597}, {"Band_gap_GGA": 0.837015}, {"Band_gap_GGA": 1.119125}, {"Band_gap_GGA": 0.6241520000000003}, {"Band_gap_GGA": 0.6734}, {"Band_gap_GGA": 1.36233}, {"Band_gap_GGA": 0.233836}, {"Band_gap_GGA": 1.078913}, {"Band_gap_GGA": 0.943632}, {"Band_gap_GGA": 1.1217720000000002}, {"Band_gap_GGA": 0.466457}, {"Band_gap_GGA": 0.477402}, {"Band_gap_GGA": 0.515604}, {"Band_gap_GGA": 0.616294}, {"Band_gap_GGA": 0.873755}, {"Band_gap_GGA": 0.844649}, {"Band_gap_GGA": 0.16959}, {"Band_gap_GGA": 0.665825}, {"Band_gap_GGA": 0.525486}, {"Band_gap_GGA": 0.70457}, {"Band_gap_GGA": 0.498645}, {"Band_gap_GGA": 0.064657}, {"Band_gap_GGA": 0.707323}, {"Band_gap_GGA": 0.780584}, {"Band_gap_GGA": 0.3010500000000005}, {"Band_gap_GGA": 1.088248}, {"Band_gap_GGA": 0.593264}, {"Band_gap_GGA": 1.031638}, {"Band_gap_GGA": 1.069505}, {"Band_gap_GGA": 1.123257}, {"Band_gap_GGA": 1.325181}, {"Band_gap_GGA": 0.8734719999999996}, {"Band_gap_GGA": 0.611021}, {"Band_gap_GGA": 1.004588}, {"Band_gap_GGA": 0.357758}, {"Band_gap_GGA": 0.949497}, {"Band_gap_GGA": 0.903644}, {"Band_gap_GGA": 0.654414}, {"Band_gap_GGA": 1.015622}], "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median Band_gap_GGA for materials where Direct_or_indirect is \"{}\", Band_gap_HSE_optical < {}, and Magnetic_ordering \"{}\"?"}
{"question": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > 0.2, Mg < 0.4, and La = 0.1?", "refer_dataset": "table16", "column names": ["Ca", "Mg", "La", "J.uAcm2_0.80_fromCV"], "condition_column": {"Ca": ">", "Mg": "<", "La": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "max"}, "condition": {"Ca": ">0.2", "Mg": "<0.4", "La": "=='0.1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > {}, Mg < {}, and La = {}?"}
{"question": "For materials with B_AtomN 74, what is the average count of D atoms (Dn)?", "refer_dataset": "table22", "column names": ["B_AtomN", "D_AtomN"], "condition_column": {"B_AtomN": "="}, "answer_column": {"D_AtomN": "avg"}, "condition": {"B_AtomN": "=='74'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "For materials with B_AtomN {}, what is the average count of D atoms (Dn)?"}
{"question": "What is the average formation energy (ef) for bulk_formula Ac and material_type 3D?", "refer_dataset": "table68", "column names": ["bulk_formula", "material_type", "ef"], "condition_column": {"bulk_formula": "=", "material_type": "="}, "answer_column": {"ef": "avg"}, "condition": {"bulk_formula": "=='Ac'", "material_type": "=='3D'"}, "tool": "calculate_data", "answer": 1.66106, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average formation energy (ef) for bulk_formula {} and material_type {}?"}
{"question": "Determine the total number of organic compounds (OC) where temperature (T) exceeds 40.0°C, pH is 3.6, and reaction rate (-log(k)) is less than 0.7992.", "refer_dataset": "table9", "column names": ["OC", "T, oC", "pH", "-log(k), min-1"], "condition_column": {"T, oC": ">", "pH": "=", "-log(k), min-1": "<"}, "answer_column": {"OC": "count"}, "condition": {"T, oC": ">40.0", "pH": "=='3.6'", "-log(k), min-1": "<0.7992"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total number of organic compounds (OC) where temperature (T) exceeds {}°C, pH is {}, and reaction rate (-log(k)) is less than {}."}
{"question": "What is the average calcination temperature (CT) for samples referenced in study [34]?", "refer_dataset": "table11", "column names": ["Ref.", "CT (℃)"], "condition_column": {"Ref.": "="}, "answer_column": {"CT (℃)": "avg"}, "condition": {"Ref.": "=='[34]'"}, "tool": "calculate_data", "answer": 720.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average calcination temperature (CT) for samples referenced in study {}?"}
{"question": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above 7.043 eV, the density of element B (ρb) exceeds 5.18 g/cm³, and the tolerance factor (t) is less than 0.881.", "refer_dataset": "table3", "column names": ["I1b", "ρb", "t", "A_Tb"], "condition_column": {"I1b": ">", "ρb": ">", "t": "<"}, "answer_column": {"A_Tb": "max"}, "condition": {"I1b": ">7.043", "ρb": ">5.18", "t": "<0.881"}, "tool": "calculate_data", "answer": 3520.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum boiling temperature of element A (A_Tb) for materials where the first ionization energy of element B (I1b) is above {} eV, the density of element B (ρb) exceeds {} g/cm³, and the tolerance factor (t) is less than {}."}
{"question": "Calculate the average SBET (m²/g) for entries with Bandgap less than 2.79 eV and irradiation time over 4.0 hours.", "refer_dataset": "table10", "column names": ["Eg(eV)", "irradiation time(h)", "SBET (m2 /g)"], "condition_column": {"Eg(eV)": "<", "irradiation time(h)": ">"}, "answer_column": {"SBET (m2 /g)": "avg"}, "condition": {"Eg(eV)": "<2.79", "irradiation time(h)": ">4.0"}, "tool": "calculate_data", "answer": 32.519999999999996, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average SBET (m²/g) for entries with Bandgap less than {} eV and irradiation time over {} hours."}
{"question": "What is the minimum Fe concentration in samples where Ca concentration is equal to 0.4?", "refer_dataset": "table16", "column names": ["Fe", "Ca"], "condition_column": {"Ca": "="}, "answer_column": {"Fe": "min"}, "condition": {"Ca": "=='0.4'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fe concentration in samples where Ca concentration is equal to {}?"}
{"question": "Determine the total Yield (μmol/g/h) for photocatalysts containing a Bi type of PbBiO2Br/GO.", "refer_dataset": "table10", "column names": ["Bi type in photocatalyst", "Yield (μmol/g/h)"], "condition_column": {"Bi type in photocatalyst": "="}, "answer_column": {"Yield (μmol/g/h)": "count"}, "condition": {"Bi type in photocatalyst": "=='PbBiO2Br/GO'"}, "tool": "calculate_data", "answer": 1, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the total Yield (μmol/g/h) for photocatalysts containing a Bi type of {}."}
{"question": "How many atoms do structures with a final energy greater than -14.36159120353881 typically have?", "refer_dataset": "table59", "column names": ["final_energy", "natoms"], "condition_column": {"final_energy": ">"}, "answer_column": {"natoms": "count"}, "condition": {"final_energy": ">-14.36159120353881"}, "tool": "calculate_data", "answer": 485, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many atoms do structures with a final energy greater than {} typically have?"}
{"question": "Find the minimum synthesis temperature for experiments with Zn2GeO4/ZIF-8 nanorods photocatalyst(s), reaction time under 6.0 hours, and CH3OH as the major product.", "refer_dataset": "table7", "column names": ["Photocatalyst(s)", "Rxn_Time", "MAJORgas", "Synhesis_Temp"], "condition_column": {"Photocatalyst(s)": "=", "Rxn_Time": "<", "MAJORgas": "="}, "answer_column": {"Synhesis_Temp": "min"}, "condition": {"Photocatalyst(s)": "=='Zn2GeO4/ZIF-8 nanorods'", "Rxn_Time": "<6.0", "MAJORgas": "=='CH3OH'"}, "tool": "calculate_data", "answer": 60.0, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the minimum synthesis temperature for experiments with {} photocatalyst(s), reaction time under {} hours, and {} as the major product."}
{"question": "What is the minimum total energy for materials with an LCD of 2.13507?", "refer_dataset": "table62", "column names": ["lcd", "energy_total"], "condition_column": {"lcd": "="}, "answer_column": {"energy_total": "min"}, "condition": {"lcd": "=='2.13507'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum total energy for materials with an LCD of {}?"}
{"question": "Find the average Eg(eV) for samples calcined at exactly 1173.0 K.", "refer_dataset": "table1", "column names": ["Calcination temperature(K)", "Eg(eV)"], "condition_column": {"Calcination temperature(K)": "="}, "answer_column": {"Eg(eV)": "avg"}, "condition": {"Calcination temperature(K)": "=='1173.0'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Eg(eV) for samples calcined at exactly {} K."}
{"question": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is 50?", "refer_dataset": "table6", "column names": ["Illumination time (min)", "Antibiotic dosage (mg/L)"], "condition_column": {"Illumination time (min)": "="}, "answer_column": {"Antibiotic dosage (mg/L)": "min"}, "condition": {"Illumination time (min)": "=='50'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the lowest Antibiotic dosage (mg/L) when Illumination time (min) is {}?"}
{"question": "What is the highest reaction energy for elements Pd with adsorbed species CH* and activation energy greater than 1.38?", "refer_dataset": "table18", "column names": ["AA", "ab", "activation_energy", "reaction_energy"], "condition_column": {"AA": "=", "ab": "=", "activation_energy": ">"}, "answer_column": {"reaction_energy": "max"}, "condition": {"AA": "=='Pd'", "ab": "=='CH*'", "activation_energy": ">1.38"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest reaction energy for elements {} with adsorbed species {} and activation energy greater than {}?"}
{"question": "List organic compounds (OC) with light intensity (I) greater than 10.0 mW/cm².", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2"], "condition_column": {"I, mW/cm2": ">"}, "answer_column": {"OC": ""}, "condition": {"I, mW/cm2": ">10.0"}, "tool": "calculate_data", "answer": [{"OC": "Atrazine"}, {"OC": "Cyanazine"}, {"OC": "Irgarol"}, {"OC": "Prometryne"}, {"OC": "Propazine"}, {"OC": "Dichlofenthion"}, {"OC": "Bromophos ethyl"}, {"OC": "Bromophos methyl"}, {"OC": "Parathion ethyl"}, {"OC": "Parathion methyl"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}, {"OC": "Monuron"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "List organic compounds (OC) with light intensity (I) greater than {} mW/cm²."}
{"question": "What is the number of articles from Saudi Arabia country that triggered an OER data warning?", "refer_dataset": "table13", "column names": ["Country", "Warning_OER.1"], "condition_column": {"Country": "="}, "answer_column": {"Warning_OER.1": "count"}, "condition": {"Country": "=='Saudi Arabia'"}, "tool": "calculate_data", "answer": 7, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the number of articles from {} country that triggered an OER data warning?"}
{"question": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than 233.24 g/mol.", "refer_dataset": "table3", "column names": ["M", "χpa"], "condition_column": {"M": ">"}, "answer_column": {"χpa": "max"}, "condition": {"M": ">233.24"}, "tool": "calculate_data", "answer": 1.49, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the maximum Pauling electronegativity of element A (χpa) for materials with a molar mass (M) greater than {} g/mol."}
{"question": "What is the maximum pH recorded for Pollutant MB under Light Wavelength 425 nm?", "refer_dataset": "table8", "column names": ["Pollutant", "Light wavelength(nm)", "pH"], "condition_column": {"Pollutant": "=", "Light wavelength(nm)": "<"}, "answer_column": {"pH": "max"}, "condition": {"Pollutant": "=='MB'", "Light wavelength(nm)": "<425"}, "tool": "calculate_data", "answer": 13.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum pH recorded for Pollutant {} under Light Wavelength {} nm?"}
{"question": "How many materials have a bandgap less than 0.3897000000000004?", "refer_dataset": "table67", "column names": ["bandgap", "material_id"], "condition_column": {"bandgap": "<"}, "answer_column": {"material_id": "count"}, "condition": {"bandgap": "<0.3897000000000004"}, "tool": "calculate_data", "answer": 2676, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many materials have a bandgap less than {}?"}
{"question": "What is the highest Rhodium percentage observed in alloys with Onset potential below 0.534961V?", "refer_dataset": "table15", "column names": ["Rh", "Onset"], "condition_column": {"Onset": "<"}, "answer_column": {"Rh": "max"}, "condition": {"Onset": "<0.534961"}, "tool": "calculate_data", "answer": 51.9, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest Rhodium percentage observed in alloys with Onset potential below {}V?"}
{"question": "What is the maximum shear modulus recorded for materials with the chemical formula MnB2?", "refer_dataset": "table56", "column names": ["shear modulus", "formula"], "condition_column": {"formula": "="}, "answer_column": {"shear modulus": "max"}, "condition": {"formula": "=='MnB2'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum shear modulus recorded for materials with the chemical formula {}?"}
{"question": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > 0.5, Mg < 0.0, and La = 0.1?", "refer_dataset": "table16", "column names": ["Ca", "Mg", "La", "J.uAcm2_0.80_fromCV"], "condition_column": {"Ca": ">", "Mg": "<", "La": "="}, "answer_column": {"J.uAcm2_0.80_fromCV": "max"}, "condition": {"Ca": ">0.5", "Mg": "<0.0", "La": "=='0.1'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum J.uAcm2_0.80_fromCV for samples with Ca > {}, Mg < {}, and La = {}?"}
{"question": "Determine the minimum CT needed for molecular formulas containing LaMg0.2Cr0.8O3 when aged longer than 5 hours.", "refer_dataset": "table11", "column names": ["Molecular formulas", "AH (h)", "CT (℃)"], "condition_column": {"Molecular formulas": "=", "AH (h)": ">"}, "answer_column": {"CT (℃)": "min"}, "condition": {"Molecular formulas": "=='LaMg0.2Cr0.8O3'", "AH (h)": ">5"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum CT needed for molecular formulas containing {} when aged longer than {} hours."}
{"question": "What is the minimum Fe concentration in samples where Ca concentration is equal to 0.5?", "refer_dataset": "table16", "column names": ["Fe", "Ca"], "condition_column": {"Ca": "="}, "answer_column": {"Fe": "min"}, "condition": {"Ca": "=='0.5'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum Fe concentration in samples where Ca concentration is equal to {}?"}
{"question": "What is the maximum light intensity (I) recorded for organic compound 4-Chlorophenol with nanoparticle dose (D) ≥ 1.875 g/L and reaction rate (-log(k)) > 0.4278?", "refer_dataset": "table9", "column names": ["OC", "D, g/L", "-log(k), min-1", "I, mW/cm2"], "condition_column": {"OC": "=", "D, g/L": ">=", "-log(k), min-1": ">"}, "answer_column": {"I, mW/cm2": "max"}, "condition": {"OC": "=='4-Chlorophenol'", "D, g/L": ">=1.875", "-log(k), min-1": ">0.4278"}, "tool": "calculate_data", "answer": 0.176, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum light intensity (I) recorded for organic compound {} with nanoparticle dose (D) ≥ {} g/L and reaction rate (-log(k)) > {}?"}
{"question": "Calculate the average nanoparticle dose (D) for organic compound Methanol under light intensity (I) > 0.176 mW/cm² and initial concentration (C0) < 1.0 mg/L.", "refer_dataset": "table9", "column names": ["OC", "I, mW/cm2", "C0, mg/L", "D, g/L"], "condition_column": {"OC": "=", "I, mW/cm2": ">", "C0, mg/L": "<"}, "answer_column": {"D, g/L": "avg"}, "condition": {"OC": "=='Methanol'", "I, mW/cm2": ">0.176", "C0, mg/L": "<1.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average nanoparticle dose (D) for organic compound {} under light intensity (I) > {} mW/cm² and initial concentration (C0) < {} mg/L."}
{"question": "Determine the average ethane yield (C2H6y) for M1 = Mn, Support_ID = 13, and M3_mol > 0.185.", "refer_dataset": "table17", "column names": ["M1", "Support_ID", "M3_mol", "C2H6y"], "condition_column": {"M1": "=", "Support_ID": "=", "M3_mol": ">"}, "answer_column": {"C2H6y": "avg"}, "condition": {"M1": "=='Mn'", "Support_ID": "=='13'", "M3_mol": ">0.185"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average ethane yield (C2H6y) for M1 = {}, Support_ID = {}, and M3_mol > {}."}
{"question": "Determine the average journal impact factor for articles using 0 method in Peoples R China country with overpotential below 18.0 in neutral conditions.", "refer_dataset": "table13", "column names": ["Judge_Sol_Gel", "Country", "IF", "Neutral_OVP"], "condition_column": {"Judge_Sol_Gel": "=", "Country": "=", "Neutral_OVP": "<"}, "answer_column": {"IF": "avg"}, "condition": {"Judge_Sol_Gel": "=='0'", "Country": "=='Peoples R China'", "Neutral_OVP": "<18.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the average journal impact factor for articles using {} method in {} country with overpotential below {} in neutral conditions."}
{"question": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above 2.70629021.", "refer_dataset": "table66", "column names": ["efermi", "final_energy"], "condition_column": {"efermi": ">"}, "answer_column": {"final_energy": "min"}, "condition": {"efermi": ">2.70629021"}, "tool": "calculate_data", "answer": 7.86028015, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum final energy (final_energy) where the Fermi energy level (efermi) is above {}."}
{"question": "Calculate the average chem_pot for symbol Hg?", "refer_dataset": "table68", "column names": ["symbol", "chem_pot"], "condition_column": {"symbol": "="}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Hg'"}, "tool": "calculate_data", "answer": 2.2457254, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {}?"}
{"question": "What is the minimum initial concentration (C0) recorded when light intensity (I) is 0.855 mW/cm², nanoparticle dose (D) is 1.0 g/L, and reference (Ref) is 21.0?", "refer_dataset": "table9", "column names": ["I, mW/cm2", "D, g/L", "Ref", "C0, mg/L"], "condition_column": {"I, mW/cm2": "=", "D, g/L": "=", "Ref": "="}, "answer_column": {"C0, mg/L": "min"}, "condition": {"I, mW/cm2": "=='0.855'", "D, g/L": "=='1.0'", "Ref": "=='21.0'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum initial concentration (C0) recorded when light intensity (I) is {} mW/cm², nanoparticle dose (D) is {} g/L, and reference (Ref) is {}?"}
{"question": "What is the minimum M1 atom number required to achieve C2s greater than 27.22?", "refer_dataset": "table17", "column names": ["M1_atom_number", "C2s"], "condition_column": {"C2s": ">"}, "answer_column": {"M1_atom_number": "min"}, "condition": {"C2s": ">27.22"}, "tool": "calculate_data", "answer": 25, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum M1 atom number required to achieve C2s greater than {}?"}
{"question": "What is the maximum bulk modulus for materials where e_hull < 0.0083145710714278, gap pbe > 0.2395, and mu_b > -0.0002943?", "refer_dataset": "table54", "column names": ["e_hull", "gap pbe", "mu_b", "bulk modulus"], "condition_column": {"e_hull": "<", "gap pbe": ">", "mu_b": ">"}, "answer_column": {"bulk modulus": "max"}, "condition": {"e_hull": "<0.0083145710714278", "gap pbe": ">0.2395", "mu_b": ">-0.0002943"}, "tool": "calculate_data", "answer": 231.8769887517088, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum bulk modulus for materials where e_hull < {}, gap pbe > {}, and mu_b > {}?"}
{"question": "What is the minimum nanoparticle dose (D) used for organic compound 2-Chlorophenol?", "refer_dataset": "table9", "column names": ["D, g/L", "OC"], "condition_column": {"OC": "="}, "answer_column": {"D, g/L": "min"}, "condition": {"OC": "=='2-Chlorophenol'"}, "tool": "calculate_data", "answer": 1.875, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum nanoparticle dose (D) used for organic compound {}?"}
{"question": "How many preparation methods resulted in SSA > 1.05 m²/g and AH < 2.0 hours?", "refer_dataset": "table11", "column names": ["SSA (m2 g -1 )", "AH (h)", "PM"], "condition_column": {"SSA (m2 g -1 )": ">", "AH (h)": "<"}, "answer_column": {"PM": "count"}, "condition": {"SSA (m2 g -1 )": ">1.05", "AH (h)": "<2.0"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many preparation methods resulted in SSA > {} m²/g and AH < {} hours?"}
{"question": "Calculate the total number of Preparations with Cation2-mol above 33.0%.", "refer_dataset": "table20", "column names": ["Cation2-mol", "Preparation"], "condition_column": {"Cation2-mol": ">"}, "answer_column": {"Preparation": "count"}, "condition": {"Cation2-mol": ">33.0"}, "tool": "calculate_data", "answer": 883, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the total number of Preparations with Cation2-mol above {}%."}
{"question": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is CH2O?", "refer_dataset": "table4", "column names": ["Sac. Agent1", "Surface Area(m2/g)"], "condition_column": {"Sac. Agent1": "="}, "answer_column": {"Surface Area(m2/g)": "max"}, "condition": {"Sac. Agent1": "=='CH2O'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Surface Area(m2/g) for materials where Sac. Agent1 is {}?"}
{"question": "What is the median cycle5 performance for perovskites listed under reference [A104]?", "refer_dataset": "table5", "column names": ["Ref", "cycle5"], "condition_column": {"Ref": "="}, "answer_column": {"cycle5": "median"}, "condition": {"Ref": "=='[A104]'"}, "tool": "calculate_data", "answer": [{"cycle5": "-"}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the median cycle5 performance for perovskites listed under reference {}?"}
{"question": "What is the maximum light intensity (I) recorded for organic compound Biphthalate with nanoparticle dose (D) ≥ 1.875 g/L and reaction rate (-log(k)) > 0.6068?", "refer_dataset": "table9", "column names": ["OC", "D, g/L", "-log(k), min-1", "I, mW/cm2"], "condition_column": {"OC": "=", "D, g/L": ">=", "-log(k), min-1": ">"}, "answer_column": {"I, mW/cm2": "max"}, "condition": {"OC": "=='Biphthalate'", "D, g/L": ">=1.875", "-log(k), min-1": ">0.6068"}, "tool": "calculate_data", "answer": 0.176, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum light intensity (I) recorded for organic compound {} with nanoparticle dose (D) ≥ {} g/L and reaction rate (-log(k)) > {}?"}
{"question": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than 0.679008593?", "refer_dataset": "table51", "column names": ["b3lyp_homo", "b3lyp_scharber_voc"], "condition_column": {"b3lyp_scharber_voc": ">"}, "answer_column": {"b3lyp_homo": "avg"}, "condition": {"b3lyp_scharber_voc": ">0.679008593"}, "tool": "calculate_data", "answer": -0.20357746478873173, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average B3LYP HOMO energy level for entries where B3LYP Scharber open-circuit voltage is greater than {}?"}
{"question": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above 911.356?", "refer_dataset": "table16", "column names": ["Ca", "J.uAcm2_0.80_fromCV"], "condition_column": {"J.uAcm2_0.80_fromCV": ">"}, "answer_column": {"Ca": "avg"}, "condition": {"J.uAcm2_0.80_fromCV": ">911.356"}, "tool": "calculate_data", "answer": 0.10824742268041233, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Ca concentration when J.uAcm2_0.80_fromCV is above {}?"}
{"question": "Find the median Fe concentration when La > 0.3, Ni = 0.0, and J.uAcm2_0.63_secondCA > 3433.329?", "refer_dataset": "table16", "column names": ["La", "Ni", "J.uAcm2_0.63_secondCA", "Fe"], "condition_column": {"La": ">", "Ni": "=", "J.uAcm2_0.63_secondCA": ">"}, "answer_column": {"Fe": "median"}, "condition": {"La": ">0.3", "Ni": "=='0.0'", "J.uAcm2_0.63_secondCA": ">3433.329"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the median Fe concentration when La > {}, Ni = {}, and J.uAcm2_0.63_secondCA > {}?"}
{"question": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than -8.43892288823109.", "refer_dataset": "table61", "column names": ["alpha", "G"], "condition_column": {"alpha": "<"}, "answer_column": {"G": "max"}, "condition": {"alpha": "<-8.43892288823109"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the maximum Gibbs free energy (G) when the electronic polarizability (alpha) is less than {}."}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over -0.37519962361434 and Gibbs free energy (G) under 5.90378031726968.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">-0.37519962361434", "G": "<5.90378031726968"}, "tool": "calculate_data", "answer": -2.1840698733101873, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above 907.43 K.", "refer_dataset": "table3", "column names": ["A_Tm", "RH2(µmol h-1 g-1)"], "condition_column": {"A_Tm": ">"}, "answer_column": {"RH2(µmol h-1 g-1)": "min"}, "condition": {"A_Tm": ">907.43"}, "tool": "calculate_data", "answer": 8600.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Determine the minimum hydrogen production rate (RH2) for materials with a melting temperature of element A (A_Tm) above {} K."}
{"question": "How many atoms do structures with a final energy greater than -14.36044560069136 typically have?", "refer_dataset": "table59", "column names": ["final_energy", "natoms"], "condition_column": {"final_energy": ">"}, "answer_column": {"natoms": "count"}, "condition": {"final_energy": ">-14.36044560069136"}, "tool": "calculate_data", "answer": 482, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many atoms do structures with a final energy greater than {} typically have?"}
{"question": "How many Preparations have Contact-times shorter than 4.4 hours?", "refer_dataset": "table20", "column names": ["Contact-times", "Preparation"], "condition_column": {"Contact-times": "<"}, "answer_column": {"Preparation": "count"}, "condition": {"Contact-times": "<4.4"}, "tool": "calculate_data", "answer": 1723, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many Preparations have Contact-times shorter than {} hours?"}
{"question": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the Spray pyrolysis method?", "refer_dataset": "table1", "column names": ["Preparation method", "RH2(µmol h-1 g-1)"], "condition_column": {"Preparation method": "="}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Preparation method": "=='Spray pyrolysis'"}, "tool": "calculate_data", "answer": 1355.0, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the {} method?"}
{"question": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than -31.42509651184082?", "refer_dataset": "table60", "column names": ["H", "U0"], "condition_column": {"H": ">"}, "answer_column": {"U0": "max"}, "condition": {"H": ">-31.42509651184082"}, "tool": "calculate_data", "answer": -9.240361213684082, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the maximum internal energy at 0K (U0) for materials with enthalpy (H) greater than {}?"}
{"question": "What is the average Light Wavelength used for Calcination Temperatures above 550°C when Pollutant is MB?", "refer_dataset": "table8", "column names": ["Light wavelength(nm)", "Calcination temperature(°C)", "Pollutant"], "condition_column": {"Calcination temperature(°C)": ">", "Pollutant": "="}, "answer_column": {"Light wavelength(nm)": "avg"}, "condition": {"Calcination temperature(°C)": ">550", "Pollutant": "=='MB'"}, "tool": "calculate_data", "answer": 396.5068493150685, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Light Wavelength used for Calcination Temperatures above {}°C when Pollutant is {}?"}
{"question": "Calculate the minimum Alcohol% for composites with A1 substitution nan, X1 equal to nan, and Surface Area(m2/g) above 1.9.", "refer_dataset": "table4", "column names": ["A1", "X1", "Surface Area(m2/g)", "Alcohol%"], "condition_column": {"A1": "=", "X1": "=", "Surface Area(m2/g)": ">"}, "answer_column": {"Alcohol%": "min"}, "condition": {"A1": "=='nan'", "X1": "=='nan'", "Surface Area(m2/g)": ">1.9"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the minimum Alcohol% for composites with A1 substitution {}, X1 equal to {}, and Surface Area(m2/g) above {}."}
{"question": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds 47.62 kJ/mol.", "refer_dataset": "table3", "column names": ["ΔfusHa", "B_Tm"], "condition_column": {"ΔfusHa": ">"}, "answer_column": {"B_Tm": "min"}, "condition": {"ΔfusHa": ">47.62"}, "tool": "calculate_data", "answer": 2952.29, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the lowest melting temperature of element B (B_Tm) where the enthalpy of fusion for element A (ΔfusHa) exceeds {} kJ/mol."}
{"question": "What is the maximum ethane selectivity when O2 conv exceeds 8.0%?", "refer_dataset": "table19", "column names": ["O2 conv", "C2H6 sel"], "condition_column": {"O2 conv": ">"}, "answer_column": {"C2H6 sel": "max"}, "condition": {"O2 conv": ">8.0"}, "tool": "calculate_data", "answer": 55.8, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum ethane selectivity when O2 conv exceeds {}%?"}
{"question": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over 0.14680008939016 and Gibbs free energy (G) under 6.14002915286456.", "refer_dataset": "table61", "column names": ["mu", "G", "alpha"], "condition_column": {"mu": ">", "G": "<"}, "answer_column": {"alpha": "avg"}, "condition": {"mu": ">0.14680008939016", "G": "<6.14002915286456"}, "tool": "calculate_data", "answer": -2.193316019024466, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Compute the average electronic polarizability (alpha) for samples with dipole moment (mu) over {} and Gibbs free energy (G) under {}."}
{"question": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above 5.587706947713036.", "refer_dataset": "table66", "column names": ["avg_max", "surf_cbm"], "condition_column": {"avg_max": ">"}, "answer_column": {"surf_cbm": "min"}, "condition": {"avg_max": ">5.587706947713036"}, "tool": "calculate_data", "answer": 4.9916, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average surface conduction band minimum (surf_cbm) for materials where avg_max is above {}."}
{"question": "How many unique surfaces are recorded for the element Fe?", "refer_dataset": "table18", "column names": ["AA", "surfaces"], "condition_column": {"AA": "="}, "answer_column": {"surfaces": "count"}, "condition": {"AA": "=='Fe'"}, "tool": "calculate_data", "answer": 15, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "How many unique surfaces are recorded for the element {}?"}
{"question": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than 5.04?", "refer_dataset": "table2", "column names": ["ρb", "t"], "condition_column": {"ρb": "<"}, "answer_column": {"t": "avg"}, "condition": {"ρb": "<5.04"}, "tool": "calculate_data", "answer": 0.8831750000000002, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Tolerance Factor (t) for materials with Element B's Density (ρb) less than {}?"}
{"question": "What is the highest SSA observed when CT exceeds 700°C and preparation method is 3?", "refer_dataset": "table11", "column names": ["CT (℃)", "PM", "SSA (m2 g -1 )"], "condition_column": {"CT (℃)": ">", "PM": "="}, "answer_column": {"SSA (m2 g -1 )": "avg"}, "condition": {"CT (℃)": ">700", "PM": "=='3'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest SSA observed when CT exceeds {}°C and preparation method is {}?"}
{"question": "What is the maximum initial concentration (C0) recorded for reference number 18?", "refer_dataset": "table9", "column names": ["C0, mg/L", "Ref"], "condition_column": {"Ref": "="}, "answer_column": {"C0, mg/L": "max"}, "condition": {"Ref": "=='18'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum initial concentration (C0) recorded for reference number {}?"}
{"question": "What is the average Surface Energy (surf_en) for materials with the chemical formula 'BN'?", "refer_dataset": "table66", "column names": ["formula", "surf_en"], "condition_column": {"formula": "="}, "answer_column": {"surf_en": "avg"}, "condition": {"formula": "=='BN'"}, "tool": "calculate_data", "answer": 2.488431885456789, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the average Surface Energy (surf_en) for materials with the chemical formula '{}'?"}
{"question": "Calculate the average chem_pot for symbol Sm when ef is greater than 1.74367?", "refer_dataset": "table68", "column names": ["symbol", "ef", "chem_pot"], "condition_column": {"symbol": "=", "ef": ">"}, "answer_column": {"chem_pot": "avg"}, "condition": {"symbol": "=='Sm'", "ef": ">1.74367"}, "tool": "calculate_data", "answer": -2.034658875, "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the average chem_pot for symbol {} when ef is greater than {}?"}
{"question": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the nan method?", "refer_dataset": "table1", "column names": ["Preparation method", "RH2(µmol h-1 g-1)"], "condition_column": {"Preparation method": "="}, "answer_column": {"RH2(µmol h-1 g-1)": "max"}, "condition": {"Preparation method": "=='nan'"}, "tool": "calculate_data", "answer": "", "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum hydrogen production rate (RH₂) for samples prepared via the {} method?"}
{"question": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > 1.899581, synthesized as True, and sourced from CSD?", "refer_dataset": "table62", "column names": ["bandgap", "synthesized", "source", "pld"], "condition_column": {"bandgap": ">", "synthesized": "=", "source": "="}, "answer_column": {"pld": "min"}, "condition": {"bandgap": ">1.899581", "synthesized": "=='True'", "source": "=='CSD'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the minimum pore limiting diameter (PLD) for materials with bandgap > {}, synthesized as {}, and sourced from {}?"}
{"question": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than 0.26683847374409?", "refer_dataset": "table61", "column names": ["omega1", "ZPVE"], "condition_column": {"omega1": "<"}, "answer_column": {"ZPVE": "max"}, "condition": {"omega1": "<0.26683847374409"}, "tool": "calculate_data", "answer": 2.04884424920197, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the maximum Zero-point vibrational energy (ZPVE) when the primary vibrational frequency (omega1) is less than {}?"}
{"question": "What is the highest density for materials with pretty_formula equal to Cs2CuSbBr6?", "refer_dataset": "table55", "column names": ["density", "pretty_formula"], "condition_column": {"pretty_formula": "="}, "answer_column": {"density": "max"}, "condition": {"pretty_formula": "=='Cs2CuSbBr6'"}, "tool": "calculate_data", "answer": 4.546462851936821, "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "What is the highest density for materials with pretty_formula equal to {}?"}
{"question": "Calculate the median Palladium percentage for alloys where Gold percentage is under 2.2%.", "refer_dataset": "table15", "column names": ["Pd", "Au"], "condition_column": {"Au": "<"}, "answer_column": {"Pd": "median"}, "condition": {"Au": "<2.2"}, "tool": "calculate_data", "answer": [{"Pd": 12.8}, {"Pd": 8.7}, {"Pd": 9.6}, {"Pd": 8.0}, {"Pd": 10.2}, {"Pd": 20.1}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 2.4}, {"Pd": 7.5}, {"Pd": 39.7}, {"Pd": 42.7}, {"Pd": 40.2}, {"Pd": 9.7}, {"Pd": 9.8}, {"Pd": 9.1}, {"Pd": 8.6}, {"Pd": 3.1}, {"Pd": 3.3}, {"Pd": 3.3}, {"Pd": 2.6}, {"Pd": 1.1}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 5.2}, {"Pd": 5.0}, {"Pd": 9.8}, {"Pd": 47.1}, {"Pd": 49.8}, {"Pd": 72.8}, {"Pd": 72.0}, {"Pd": 70.7}, {"Pd": 10.2}, {"Pd": 9.6}, {"Pd": 10.2}, {"Pd": 4.0}, {"Pd": 2.4}, {"Pd": 10.2}, {"Pd": 10.2}, {"Pd": 8.0}, {"Pd": 29.2}, {"Pd": 32.1}, {"Pd": 28.2}, {"Pd": 1.9}, {"Pd": 15.3}, {"Pd": 10.7}, {"Pd": 10.2}, {"Pd": 1.6}, {"Pd": 1.9}, {"Pd": 3.0}, {"Pd": 7.5}, {"Pd": 4.1}, {"Pd": 1.7}, {"Pd": 3.3}, {"Pd": 97.9}, {"Pd": 97.7}, {"Pd": 98.1}, {"Pd": 3.1}, {"Pd": 4.0}, {"Pd": 3.3}, {"Pd": 2.6}, {"Pd": 1.7}, {"Pd": 0.3}, {"Pd": 0.5}, {"Pd": 0.0}, {"Pd": 46.6}, {"Pd": 44.6}, {"Pd": 8.6}, {"Pd": 49.8}, {"Pd": 48.2}, {"Pd": 8.0}, {"Pd": 9.6}, {"Pd": 10.2}, {"Pd": 2.4}, {"Pd": 2.1}, {"Pd": 19.3}, {"Pd": 23.3}, {"Pd": 12.9}, {"Pd": 44.6}, {"Pd": 46.6}, {"Pd": 45.4}, {"Pd": 48.9}, {"Pd": 39.3}, {"Pd": 38.6}, {"Pd": 1.7}, {"Pd": 4.1}, {"Pd": 10.2}, {"Pd": 15.3}, {"Pd": 13.1}, {"Pd": 29.2}, {"Pd": 28.2}, {"Pd": 26.8}, {"Pd": 98.1}, {"Pd": 98.8}, {"Pd": 97.9}, {"Pd": 20.1}, {"Pd": 29.2}, {"Pd": 26.8}, {"Pd": 32.1}, {"Pd": 45.4}, {"Pd": 46.6}, {"Pd": 0.0}, {"Pd": 0.5}, {"Pd": 0.2}, {"Pd": 98.1}, {"Pd": 97.7}, {"Pd": 98.8}, {"Pd": 4.6}, {"Pd": 5.6}, {"Pd": 2.9}, {"Pd": 28.2}, {"Pd": 32.1}, {"Pd": 26.8}, {"Pd": 48.2}, {"Pd": 47.1}, {"Pd": 49.8}, {"Pd": 9.8}, {"Pd": 11.9}, {"Pd": 5.0}, {"Pd": 0.2}, {"Pd": 0.3}, {"Pd": 0.0}, {"Pd": 2.5}, {"Pd": 4.4}, {"Pd": 44.6}, {"Pd": 45.4}, {"Pd": 19.3}, {"Pd": 12.9}, {"Pd": 16.5}, {"Pd": 3.1}, {"Pd": 4.0}, {"Pd": 2.4}, {"Pd": 75.8}, {"Pd": 70.7}, {"Pd": 72.0}, {"Pd": 1.9}, {"Pd": 0.0}, {"Pd": 1.1}, {"Pd": 0.0}, {"Pd": 97.9}, {"Pd": 97.7}, {"Pd": 98.8}, {"Pd": 1.6}, {"Pd": 3.0}, {"Pd": 5.6}, {"Pd": 5.0}, {"Pd": 4.2}, {"Pd": 5.5}, {"Pd": 5.0}, {"Pd": 11.9}, {"Pd": 5.2}, {"Pd": 35.9}, {"Pd": 1.9}, {"Pd": 3.0}, {"Pd": 5.6}, {"Pd": 9.7}, {"Pd": 9.1}, {"Pd": 10.7}, {"Pd": 40.2}, {"Pd": 43.1}, {"Pd": 39.7}, {"Pd": 10.7}, {"Pd": 13.1}, {"Pd": 10.2}, {"Pd": 8.1}, {"Pd": 12.8}, {"Pd": 4.2}, {"Pd": 5.0}, {"Pd": 4.9}, {"Pd": 4.4}, {"Pd": 9.8}, {"Pd": 11.9}, {"Pd": 5.2}, {"Pd": 35.9}, {"Pd": 1.7}, {"Pd": 3.3}, {"Pd": 6.4}, {"Pd": 5.6}, {"Pd": 4.6}, {"Pd": 5.5}, {"Pd": 4.9}, {"Pd": 5.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 4.1}, {"Pd": 4.1}, {"Pd": 2.4}, {"Pd": 3.1}, {"Pd": 4.2}, {"Pd": 5.5}, {"Pd": 4.9}, {"Pd": 2.1}, {"Pd": 9.1}, {"Pd": 10.7}, {"Pd": 9.8}, {"Pd": 35.9}, {"Pd": 2.6}, {"Pd": 1.7}, {"Pd": 3.3}, {"Pd": 9.8}, {"Pd": 10.7}, {"Pd": 9.7}, {"Pd": 48.2}, {"Pd": 47.1}, {"Pd": 16.5}, {"Pd": 23.3}, {"Pd": 12.9}, {"Pd": 43.1}, {"Pd": 42.7}, {"Pd": 40.2}, {"Pd": 3.1}, {"Pd": 4.6}, {"Pd": 6.4}, {"Pd": 2.9}, {"Pd": 70.7}, {"Pd": 72.8}, {"Pd": 75.8}, {"Pd": 8.7}, {"Pd": 8.1}, {"Pd": 12.8}, {"Pd": 47.0}, {"Pd": 48.9}, {"Pd": 38.6}, {"Pd": 3.3}, {"Pd": 3.3}, {"Pd": 1.7}, {"Pd": 7.5}, {"Pd": 39.7}, {"Pd": 42.7}, {"Pd": 43.1}, {"Pd": 20.1}, {"Pd": 2.4}, {"Pd": 2.1}, {"Pd": 3.3}, {"Pd": 4.1}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 2.5}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 4.1}, {"Pd": 72.8}, {"Pd": 72.0}, {"Pd": 75.8}, {"Pd": 23.3}, {"Pd": 16.5}, {"Pd": 19.3}, {"Pd": 47.0}, {"Pd": 48.9}, {"Pd": 39.3}, {"Pd": 38.6}, {"Pd": 39.3}, {"Pd": 47.0}, {"Pd": 1.9}, {"Pd": 8.7}, {"Pd": 8.1}, {"Pd": 5.6}, {"Pd": 6.4}, {"Pd": 2.9}, {"Pd": 8.6}, {"Pd": 3.1}, {"Pd": 5.6}, {"Pd": 1.9}, {"Pd": 1.6}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 1.1}, {"Pd": 0.3}, {"Pd": 0.5}, {"Pd": 0.2}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 0.0}, {"Pd": 2.5}, {"Pd": 4.4}, {"Pd": 15.3}, {"Pd": 13.1}, {"Pd": 10.7}], "level": "simple", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Calculate the median Palladium percentage for alloys where Gold percentage is under {}%."}
{"question": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is 50.0, pH > 4.1, and Catalyst dosage (g/L) is 0.2.", "refer_dataset": "table6", "column names": ["Antibiotic dosage (mg/L)", "pH", "Catalyst dosage (g/L)", "Illumination time (min)"], "condition_column": {"Antibiotic dosage (mg/L)": "=", "pH": ">", "Catalyst dosage (g/L)": "="}, "answer_column": {"Illumination time (min)": "avg"}, "condition": {"Antibiotic dosage (mg/L)": "=='50.0'", "pH": ">4.1", "Catalyst dosage (g/L)": "=='0.2'"}, "tool": "calculate_data", "answer": "", "level": "complex", "question description": "Obtain the correct answer through the calculation of table data.", "refer_template": "Find the average Illumination time (min) when Antibiotic dosage (mg/L) is {}, pH > {}, and Catalyst dosage (g/L) is {}."}