Database stringlengths 6 13 | Reduced Formula stringlengths 1 23 | CIF stringlengths 760 15.5k |
|---|---|---|
agm001231968 | BiPbZn2 | data_[Zn2Bi1Pb1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
Bi 2.0200 1.6000 1.0350
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.0985]
_cell_length_b [5.0985]
_cell_length_c [3.7543]
_... |
agm006022139 | Au2BiCa8 | data_[Ca16Bi2Au4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Bi 2.0200 1.6000 1.0350
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.3828]
_cell_length_b [13.9693]
_cell_length_c [5.7340]
_... |
agm003798241 | HgPtSe2 | data_[Hg2Pt2Se4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hg 2.0000 1.5000 1.2450
Pt 2.2800 1.3500 0.8050
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [7.4333]
_cell_length_b [3.7361]
_cell_length_c [6.8329]
_cell... |
oqmd-6907125 | Au2DyIn3PtSc2 | data_[Dy2Sc4In6Pt2Au4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Sc 1.3600 1.6000 0.8850
In 1.7800 1.5500 0.9400
Pt 2.2800 1.3500 0.8050
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [Amm2]
_cell_lengt... |
agm005655356 | Ca2H6Y | data_[Ca8Y4H24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Y 1.2200 1.8000 1.0400
H 2.2000 0.2500 0.0000
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [7.9273]
_cell_length_b [7.9273]
_cell_length_c [7.9273]
_cell... |
agm002956673 | AlOs2Ti2 | data_[Ti4Al2Os4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ti 1.5400 1.4000 0.8517
Al 1.6100 1.2500 0.6750
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [7.2286]
_cell_length_b [7.2286]
_cell_length_c [3.0607]
_... |
agm005205105 | GePdPmTb | data_[Tb2Pm2Ge2Pd2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Pm 1.1300 1.8500 1.1100
Ge 2.0100 1.2500 0.7700
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [4.3304]
_cell_length_b [3.9... |
agm004451803 | RuY | data_[Y8Ru8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [I-43m]
_cell_length_a [8.0778]
_cell_length_b [8.0778]
_cell_length_c [8.0778]
_cell_angle_alpha [90.0000]
_cell_an... |
agm003669170 | Ho7In4Tm | data_[Ho14Tm2In8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ho 1.2300 1.7500 1.0410
Tm 1.2500 1.7500 1.0950
In 1.7800 1.5500 0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.5146]
_cell_length_b [5.6534]
_cell_length_c [10.2298]
... |
agm003849834 | AuIr2Sb | data_[Sb2Ir4Au2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sb 2.0500 1.4500 0.8300
Ir 2.2000 1.3500 0.7650
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [Cmm2]
_cell_length_a [2.8635]
_cell_length_b [5.0713]
_cell_length_c [10.0600]
_c... |
agm004299088 | CdPPb2 | data_[Cd2P2Pb4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cd 1.6900 1.5500 1.0900
P 2.1900 1.0000 0.5500
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.2830]
_cell_length_b [3.7549]
_cell_length_c [5.7171]
_cell_... |
agm005077689 | CuGaIO6 | data_[Ga2Cu2I2O12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ga 1.8100 1.3000 0.7600
Cu 1.9000 1.3500 0.8200
I 2.6600 1.4000 1.2733
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P-31c]
_cell_length_a [5.0918]
_cell_length_b [5.091... |
agm004698218 | Li3NpTe8Zr3 | data_[Li9Zr9Np3Te24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Zr 1.3300 1.5500 0.8600
Np 1.3600 1.7500 1.0000
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.1804]
_cell_length_b [8.... |
agm005624398 | Cu3LiPd2 | data_[Li2Cu6Pd4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Cu 1.9000 1.3500 0.8200
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [3.7471]
_cell_length_b [11.2396]
_cell_length_c [3.7663]
_c... |
oqmd-8993513 | KNpRbTe3 | data_[K4Rb4Np4Te12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Rb 0.8200 2.3500 1.6600
Np 1.3600 1.7500 1.0000
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.6818]
_cell_length_b [17.8... |
agm005703438 | AlAu11Pu | data_[Pu2Al2Au22]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pu 1.2800 1.7500 0.9675
Al 1.6100 1.2500 0.6750
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.5508]
_cell_length_b [13.3287]
_cell_length_c [7.2497]
_... |
agm005060964 | O4PdTaTl | data_[Ta4Tl4Pd4O16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ta 1.5000 1.4500 0.8200
Tl 1.6200 1.9000 1.3325
Pd 2.2000 1.4000 0.8462
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [5.9989]
_cell_length_b [6.14... |
agm001549921 | Ba2CuIOs | data_[Ba2Cu1Os1I1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Cu 1.9000 1.3500 0.8200
Os 2.2000 1.3000 0.6730
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [6.2183]
_cell_length_b [6.2... |
agm002693652 | Al2LiO | data_[Li4Al8O4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Al 1.6100 1.2500 0.6750
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [6.2184]
_cell_length_b [6.2184]
_cell_length_c [6.2184]
_cel... |
agm003752510 | MgNi4V | data_[Mg4V4Ni16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
V 1.6300 1.3500 0.7775
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.7339]
_cell_length_b [15.9502]
_cell_length_c [5.1000]
_ce... |
agm002057674 | Cr2CuIr | data_[Cr4Cu2Ir2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cr 1.6600 1.4000 0.9400
Cu 1.9000 1.3500 0.8200
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [2.7679]
_cell_length_b [8.5070]
_cell_length_c [4.2545]
_ce... |
oqmd-6597209 | Hg3KRuTe4 | data_[K1Hg3Te4Ru1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Hg 2.0000 1.5000 1.2450
Te 2.1000 1.4000 1.2933
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [P-43m]
_cell_length_a [7.6304]
_cell_length_b [7.63... |
agm001582415 | FeNa2SiV | data_[Na2V1Fe1Si1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
V 1.6300 1.3500 0.7775
Fe 1.8300 1.4000 0.8525
Si 1.9000 1.1000 0.5400
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.2483]
_cell_length_b [5.2... |
agm001572729 | BrMn2ReSe | data_[Mn2Re1Se1Br1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mn 1.5500 1.4000 0.6483
Re 1.9000 1.3500 0.7125
Se 2.5500 1.1500 1.0133
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.2325]
_cell_length_b [4... |
agm002044508 | AlBiRh | data_[Al2Bi2Rh2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Al 1.6100 1.2500 0.6750
Bi 2.0200 1.6000 1.0350
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [P4/nmm]
_cell_length_a [3.9293]
_cell_length_b [3.9293]
_cell_length_c [7.4780]
_... |
agm004927620 | F6NiPbTl2 | data_[Tl4Ni2Pb2F12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tl 1.6200 1.9000 1.3325
Ni 1.9100 1.3500 0.7400
Pb 2.3300 1.8000 1.1225
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [6.1371]
_cell_length_b [8.90... |
agm004598419 | S3Si2SnTm6 | data_[Tm12Si4Sn2S6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tm 1.2500 1.7500 1.0950
Si 1.9000 1.1000 0.5400
Sn 1.9600 1.4500 0.8300
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.5947]
_cell_length_b [3.9... |
agm001156626 | Bi2SrTm | data_[Sr1Tm1Bi2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Tm 1.2500 1.7500 1.0950
Bi 2.0200 1.6000 1.0350
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.8514]
_cell_length_b [3.8514]
_cell_length_c [8.6026]
_... |
agm003926011 | ReSeSi | data_[Re1Si1Se1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Re 1.9000 1.3500 0.7125
Si 1.9000 1.1000 0.5400
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [3.1789]
_cell_length_b [3.1789]
_cell_length_c [5.5502]
_ce... |
agm004500772 | Cu12Li3MnPm2 | data_[Li9Pm6Mn3Cu36]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Pm 1.1300 1.8500 1.1100
Mn 1.5500 1.4000 0.6483
Cu 1.9000 1.3500 0.8200
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.7688]
_cell_length_b [5.... |
agm003459124 | IPd2Te4 | data_[Te16Pd8I4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Te 2.1000 1.4000 1.2933
Pd 2.2000 1.4000 0.8462
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [I4_1/amd]
_cell_length_a [7.3655]
_cell_length_b [7.3655]
_cell_length_c [14.7046]... |
agm001607966 | KNa2SiZn | data_[K1Na2Zn1Si1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Na 0.9300 1.8000 1.1600
Zn 1.6500 1.3500 0.8800
Si 1.9000 1.1000 0.5400
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.6987]
_cell_length_b [5.6... |
agm001982821 | Be2CePa | data_[Ce3Pa3Be6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Pa 1.5000 1.8000 1.0400
Be 1.5700 1.0500 0.5900
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [2.9919]
_cell_length_b [2.9919]
_cell_length_c [28.7235]
_c... |
agm002640613 | BClZn2 | data_[Zn8B4Cl4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
B 2.0400 0.8500 0.4100
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [6.4162]
_cell_length_b [6.4162]
_cell_length_c [6.4162]
_cel... |
agm001372021 | AcAlLaZn | data_[Ac4La4Al4Zn4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
La 1.1000 1.9500 1.1720
Al 1.6100 1.2500 0.6750
Zn 1.6500 1.3500 0.8800
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.7301]
_cell_length_b [7.... |
agm001584867 | LaNiRbSi2 | data_[Rb1La1Si2Ni1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
La 1.1000 1.9500 1.1720
Si 1.9000 1.1000 0.5400
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.2596]
_cell_length_b [5... |
agm002851087 | MgTa2Zr | data_[Mg4Zr4Ta8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
Zr 1.3300 1.5500 0.8600
Ta 1.5000 1.4500 0.8200
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [4.0344]
_cell_length_b [4.0344]
_cell_length_c [20.4435]
_... |
agm005068663 | AgO6PaPt | data_[Pa2Ag2Pt2O12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pa 1.5000 1.8000 1.0400
Ag 1.9300 1.6000 1.0867
Pt 2.2800 1.3500 0.8050
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P-31c]
_cell_length_a [5.4946]
_cell_length_b [5.4... |
agm004692050 | K3NpSe8U3 | data_[K9Np3U9Se24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Np 1.3600 1.7500 1.0000
U 1.3800 1.7500 0.9913
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.4286]
_cell_length_b [8.4286... |
agm005613603 | Ho3Pm2Tb7 | data_[Tb7Pm2Ho3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Pm 1.1300 1.8500 1.1100
Ho 1.2300 1.7500 1.0410
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.3444]
_cell_length_b [3.5219]
_cell_length_c [17.4609]
_c... |
agm006185140 | KLi4 | data_[K1Li4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Li 0.9800 1.4500 0.9000
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [5.7245]
_cell_length_b [5.7245]
_cell_length_c [5.7245]
_cell_angle_alpha [90.0000]
_cell_an... |
agm002697491 | CsMgV2 | data_[Cs4Mg4V8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cs 0.7900 2.6000 1.8100
Mg 1.3100 1.5000 0.8600
V 1.6300 1.3500 0.7775
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [7.5145]
_cell_length_b [7.5145]
_cell_length_c [7.5145]
_cel... |
agm004315386 | BeHg2 | data_[Be4Hg8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Be 1.5700 1.0500 0.5900
Hg 2.0000 1.5000 1.2450
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [6.1416]
_cell_length_b [6.1416]
_cell_length_c [6.1416]
_cell_angle_alpha [90.0000]
_cell_... |
agm003106409 | Hf3HgN | data_[Hf6Hg2N2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hf 1.3000 1.5500 0.8500
Hg 2.0000 1.5000 1.2450
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [3.2523]
_cell_length_b [6.5350]
_cell_length_c [9.3561]
_cell... |
oqmd-7835908 | Cl2K4MgO2 | data_[K8Mg2Cl4O4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Mg 1.3100 1.5000 0.8600
Cl 3.1600 1.0000 0.7800
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8254]
_cell_length_b [10.8452... |
agm005126980 | CrHoN2 | data_[Ho3Cr3N6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ho 1.2300 1.7500 1.0410
Cr 1.6600 1.4000 0.9400
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [3.0938]
_cell_length_b [3.0938]
_cell_length_c [16.1948]
_cell... |
agm004119183 | IrSe2Te | data_[Te1Ir1Se2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Te 2.1000 1.4000 1.2933
Ir 2.2000 1.3500 0.7650
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [3.8679]
_cell_length_b [3.8679]
_cell_length_c [7.8918]
_ce... |
agm003964603 | Mo2OsTa | data_[Ta2Mo4Os2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ta 1.5000 1.4500 0.8200
Mo 2.1600 1.4500 0.7750
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [Cmm2]
_cell_length_a [3.1642]
_cell_length_b [4.5502]
_cell_length_c [8.9004]
_ce... |
agm001689749 | Cl2LaPSc | data_[La1Sc1P1Cl2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Sc 1.3600 1.6000 0.8850
P 2.1900 1.0000 0.5500
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.3416]
_cell_length_b [5.3... |
agm005012018 | DyHgNY2 | data_[Dy1Y2Hg1N1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Y 1.2200 1.8000 1.0400
Hg 2.0000 1.5000 1.2450
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.8108]
_cell_length_b [4.810... |
agm003582940 | Dy3MgNd7 | data_[Nd7Dy3Mg1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nd 1.1400 1.8500 1.2765
Dy 1.2200 1.7500 1.1310
Mg 1.3100 1.5000 0.8600
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [7.1374]
_cell_length_b [7.1374]
_cell_length_c [8.6889]
_ce... |
agm004460958 | BrNi | data_[Ni2Br2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ni 1.9100 1.3500 0.7400
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [P6_3mc]
_cell_length_a [3.8628]
_cell_length_b [3.8628]
_cell_length_c [6.5896]
_cell_angle_alpha [90.0000]
_cell... |
agm004015914 | Au2RhSc | data_[Sc3Rh3Au6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
Rh 2.2800 1.3500 0.7450
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.0820]
_cell_length_b [3.0820]
_cell_length_c [26.5010]
_c... |
agm005437655 | BaLi4Ta | data_[Ba4Li16Ta4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Li 0.9800 1.4500 0.9000
Ta 1.5000 1.4500 0.8200
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [8.1853]
_cell_length_b [8.1853]
_cell_length_c [8.1853]
_... |
agm005863728 | Ni9OsZn2 | data_[Zn2Ni9Os1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
Ni 1.9100 1.3500 0.7400
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.5871]
_cell_length_b [3.5871]
_cell_length_c [10.7505]
... |
agm002013861 | Cd2FP | data_[Cd6P3F3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cd 1.6900 1.5500 1.0900
P 2.1900 1.0000 0.5500
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.1711]
_cell_length_b [4.1711]
_cell_length_c [20.0841]
_cell_... |
agm003678559 | BiHg5Zr6 | data_[Zr12Hg10Bi2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zr 1.3300 1.5500 0.8600
Hg 2.0000 1.5000 1.2450
Bi 2.0200 1.6000 1.0350
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [4.5407]
_cell_length_b [13.6113]
_cell_length_c [8.5614]
... |
agm003971707 | Br2ScSe | data_[Sc1Se1Br2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
Se 2.5500 1.1500 1.0133
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.3258]
_cell_length_b [3.3258]
_cell_length_c [10.4070]
_c... |
oqmd-2526760 | CaMgZn | data_[Ca8Mg8Zn8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Mg 1.3100 1.5000 0.8600
Zn 1.6500 1.3500 0.8800
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [10.9232]
_cell_length_b [5.9670]
_cell_length_c [9.2605]
_cel... |
agm003425835 | Cu3Ga2La | data_[La2Ga4Cu6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Ga 1.8100 1.3000 0.7600
Cu 1.9000 1.3500 0.8200
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [4.2059]
_cell_length_b [4.2059]
_cell_length_c [13.9230... |
agm004878083 | AcO8Te2Tm | data_[Ac2Tm2Te4O16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Tm 1.2500 1.7500 1.0950
Te 2.1000 1.4000 1.2933
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [7.6019]
_cell_length_b [7.6... |
agm002622785 | BiPb3W | data_[Bi1Pb3W1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Bi 2.0200 1.6000 1.0350
Pb 2.3300 1.8000 1.1225
W 2.3600 1.3500 0.7667
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [5.4695]
_cell_length_b [5.4695]
_cell_length_c [5.4695]
_cel... |
agm002729873 | CaFe2S | data_[Ca4Fe8S4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Fe 1.8300 1.4000 0.8525
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [5.9134]
_cell_length_b [5.9134]
_cell_length_c [5.9134]
_cel... |
agm005593805 | Nd3Pm2Pr6 | data_[Pm6Pr18Nd9]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Pr 1.1300 1.8500 1.0600
Nd 1.1400 1.8500 1.2765
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.6938]
_cell_length_b [3.6938]
_cell_length_c [99.5783]
_... |
agm003534016 | Bi2FePm8 | data_[Pm16Fe2Bi4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Fe 1.8300 1.4000 0.8525
Bi 2.0200 1.6000 1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.4231]
_cell_length_b [5.5431]
_cell_length_c [6.8276]
_... |
agm001917835 | AuCrGaMn | data_[Mn4Cr4Ga4Au4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mn 1.5500 1.4000 0.6483
Cr 1.6600 1.4000 0.9400
Ga 1.8100 1.3000 0.7600
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.2595]
_cell_length_b [6.... |
agm2000059610 | BrOsSe3 | data_[Os1Se3Br1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Os 2.2000 1.3000 0.6730
Se 2.5500 1.1500 1.0133
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.8445]
_cell_length_b [19.1549]
_cell_length_c [7.4993]
_c... |
agm005977091 | RuY4Zn2 | data_[Y4Zn2Ru1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Zn 1.6500 1.3500 0.8800
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.9432]
_cell_length_b [4.9432]
_cell_length_c [7.0149]
_ce... |
agm002900240 | GeReV2 | data_[V8Re4Ge4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
V 1.6300 1.3500 0.7775
Re 1.9000 1.3500 0.7125
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [6.8893]
_cell_length_b [6.8893]
_cell_length_c [5.2229]
_cel... |
agm003615058 | HRb2Te | data_[Rb4Te2H2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Te 2.1000 1.4000 1.2933
H 2.2000 0.2500 0.0000
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [5.2654]
_cell_length_b [5.5281]
_cell_length_c [9.7344]
_cell... |
agm002698192 | Mg2SeTl | data_[Mg8Tl4Se4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
Tl 1.6200 1.9000 1.3325
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [7.2046]
_cell_length_b [7.2046]
_cell_length_c [7.2046]
_c... |
agm001524825 | FIr2NTc | data_[Tc1Ir2N1F1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tc 1.9000 1.3500 0.7417
Ir 2.2000 1.3500 0.7650
N 3.0400 0.6500 0.6300
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.0258]
_cell_length_b [4.025... |
oqmd-3293672 | GeIrLiNi | data_[Li4Ni4Ge4Ir4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Ni 1.9100 1.3500 0.7400
Ge 2.0100 1.2500 0.7700
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [5.8726]
_cell_length_b [5.... |
agm004679516 | As2Ca3PPd9 | data_[Ca3As2P1Pd9]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
As 2.1800 1.1500 0.6600
P 2.1900 1.0000 0.5500
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.6530]
_cell_length_b [6.65... |
mp-2272172 | AsHoSe | data_[Ho2As2Se2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ho 1.2300 1.7500 1.0410
As 2.1800 1.1500 0.6600
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [P4/nmm]
_cell_length_a [3.9084]
_cell_length_b [3.9084]
_cell_length_c [8.7616]
_... |
agm001381240 | AlCrLiRe | data_[Li4Al4Cr4Re4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Al 1.6100 1.2500 0.6750
Cr 1.6600 1.4000 0.9400
Re 1.9000 1.3500 0.7125
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [5.9550]
_cell_length_b [5.... |
agm003377752 | Ho4In4Y3 | data_[Y6Ho8In8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Ho 1.2300 1.7500 1.0410
In 1.7800 1.5500 0.9400
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.6426]
_cell_length_b [8.6293]
_cell_length_c [16.5821]
_cel... |
agm003684616 | B6PaRh12 | data_[Pa3B18Rh36]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pa 1.5000 1.8000 1.0400
B 2.0400 0.8500 0.4100
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [10.2714]
_cell_length_b [10.2714]
_cell_length_c [7.9182]
_... |
agm004250137 | CrSb2Te | data_[Cr1Sb2Te1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cr 1.6600 1.4000 0.9400
Sb 2.0500 1.4500 0.8300
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.2334]
_cell_length_b [3.2334]
_cell_length_c [9.2658]
_... |
agm002409780 | Ag3BHf | data_[Hf1Ag3B1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hf 1.3000 1.5500 0.8500
Ag 1.9300 1.6000 1.0867
B 2.0400 0.8500 0.4100
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [5.2834]
_cell_length_b [5.2834]
_cell_length_c [5.2834]
_cel... |
agm006037373 | Cd4KSr5 | data_[K1Sr5Cd4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Sr 0.9500 2.0000 1.3200
Cd 1.6900 1.5500 1.0900
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.1228]
_cell_length_b [4.1228]
_cell_length_c [22.6881]
_c... |
agm005760589 | B12SmSr | data_[Sr4Sm4B48]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Sm 1.1700 1.8500 1.2290
B 2.0400 0.8500 0.4100
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [8.3079]
_cell_length_b [8.3079]
_cell_length_c [8.3079]
_ce... |
agm005443807 | AsBeZn4 | data_[Be4Zn16As4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Be 1.5700 1.0500 0.5900
Zn 1.6500 1.3500 0.8800
As 2.1800 1.1500 0.6600
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.2130]
_cell_length_b [7.2130]
_cell_length_c [7.2130]
_... |
oqmd-8003626 | GaPdSc | data_[Sc2Ga2Pd2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
Ga 1.8100 1.3000 0.7600
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [4.6299]
_cell_length_b [4.6299]
_cell_length_c [5.6137]... |
agm004208461 | CuKTe | data_[K4Cu4Te4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Cu 1.9000 1.3500 0.8200
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.4220]
_cell_length_b [7.4220]
_cell_length_c [7.4220]
_cel... |
agm005028410 | NaS3TiTl | data_[Na4Ti4Tl4S12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Ti 1.5400 1.4000 0.8517
Tl 1.6200 1.9000 1.3325
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [6.9702]
_cell_length_b [13.5... |
agm1000017008 | NSc | data_[Sc6N6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [P3_2]
_cell_length_a [16.9015]
_cell_length_b [16.9015]
_cell_length_c [6.7204]
_cell_angle_alpha [90.0000]
_cell_a... |
agm006050749 | Dy6Tb4Y | data_[Tb8Dy12Y2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Dy 1.2200 1.7500 1.1310
Y 1.2200 1.8000 1.0400
]
_symmetry_space_group_name_H-M [I-42m]
_cell_length_a [6.5441]
_cell_length_b [6.5441]
_cell_length_c [17.1325]
_c... |
agm003745417 | AgDy4Ir | data_[Dy4Ag1Ir1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Ag 1.9300 1.6000 1.0867
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.8923]
_cell_length_b [4.8923]
_cell_length_c [7.0332]
_... |
agm005555212 | Au2Li2Sr3 | data_[Sr12Li8Au8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Li 0.9800 1.4500 0.9000
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [Pbcm]
_cell_length_a [6.8534]
_cell_length_b [8.0806]
_cell_length_c [14.8955]
_... |
agm005440667 | BaCoLa4 | data_[Ba4La16Co4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
La 1.1000 1.9500 1.1720
Co 1.8800 1.3500 0.7683
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [9.4534]
_cell_length_b [9.4534]
_cell_length_c [9.4534]
_... |
agm002239585 | Se3Ta2 | data_[Ta8Se12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ta 1.5000 1.4500 0.8200
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.6209]
_cell_length_b [6.5867]
_cell_length_c [7.0099]
_cell_angle_alpha [90.0000]
_cell... |
agm003396002 | La2MgSn2 | data_[La8Mg4Sn8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Mg 1.3100 1.5000 0.8600
Sn 1.9600 1.4500 0.8300
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [6.9983]
_cell_length_b [13.6193]
_cell_length_c [6.7312]
_c... |
agm002572652 | CoP3Sn | data_[Co1Sn1P3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Co 1.8800 1.3500 0.7683
Sn 1.9600 1.4500 0.8300
P 2.1900 1.0000 0.5500
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.4526]
_cell_length_b [4.4526]
_cell_length_c [4.4526]
_cel... |
agm001159635 | AlDy2Pa | data_[Dy2Pa1Al1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Pa 1.5000 1.8000 1.0400
Al 1.6100 1.2500 0.6750
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.3834]
_cell_length_b [3.3834]
_cell_length_c [9.0082]
_... |
agm004396593 | CrIrW2 | data_[Cr2Ir2W4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cr 1.6600 1.4000 0.9400
Ir 2.2000 1.3500 0.7650
W 2.3600 1.3500 0.7667
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.1750]
_cell_length_b [2.7230]
_cell_length_c [4.8128]
_cell_a... |
agm004152886 | MgNi2Ta | data_[Mg1Ta1Ni2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
Ta 1.5000 1.4500 0.8200
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.1299]
_cell_length_b [3.1299]
_cell_length_c [6.1288]
_ce... |
agm001497862 | IMo2SnTa | data_[Ta1Sn1Mo2I1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ta 1.5000 1.4500 0.8200
Sn 1.9600 1.4500 0.8300
Mo 2.1600 1.4500 0.7750
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.9943]
_cell_length_b [4.9... |
agm2000044414 | In8Te11 | data_[In8Te11]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
In 1.7800 1.5500 0.9400
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [P31m]
_cell_length_a [14.7011]
_cell_length_b [14.7011]
_cell_length_c [17.9974]
_cell_angle_alpha [90.0000]
_ce... |
agm004782828 | N4NdSbTb2 | data_[Tb8Nd4Sb4N16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Nd 1.1400 1.8500 1.2765
Sb 2.0500 1.4500 0.8300
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.3510]
_cell_length_b [13.5... |
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