Database stringlengths 6 13 | Reduced Formula stringlengths 1 23 | CIF stringlengths 760 15.5k |
|---|---|---|
agm003835860 | BrScTe2 | data_[Sc1Te2Br1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
Te 2.1000 1.4000 1.2933
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.8536]
_cell_length_b [3.8536]
_cell_length_c [7.3811]
_... |
agm003722833 | BiHf3Mn | data_[Hf12Mn4Bi4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hf 1.3000 1.5500 0.8500
Mn 1.5500 1.4000 0.6483
Bi 2.0200 1.6000 1.0350
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [6.9535]
_cell_length_b [13.3753]
_cell_length_c [4.7295]
_... |
agm004908785 | Br8Ca2CsIn | data_[Cs1Ca2In1Br8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cs 0.7900 2.6000 1.8100
Ca 1.0000 1.8000 1.1400
In 1.7800 1.5500 0.9400
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.7725]
_cell_length_b [9.3... |
agm004621323 | Ce3ErP6Th2 | data_[Ce6Er2Th4P12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Er 1.2400 1.7500 1.0300
Th 1.3000 1.8000 1.0800
P 2.1900 1.0000 0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0897]
_cell_length_b [12.2... |
agm005695903 | CrReTi | data_[Ti4Cr4Re4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ti 1.5400 1.4000 0.8517
Cr 1.6600 1.4000 0.9400
Re 1.9000 1.3500 0.7125
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [4.9042]
_cell_length_b [5.1606]
_cell_length_c [7.0706]
_ce... |
agm004076103 | LiSiSr2 | data_[Sr2Li1Si1]
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
Si 1.9000 1.1000 0.5400
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.8278]
_cell_length_b [3.8278]
_cell_length_c [8.6535]
_ce... |
agm003735490 | CoCuZn4 | data_[Zn4Co1Cu1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
Co 1.8800 1.3500 0.7683
Cu 1.9000 1.3500 0.8200
]
_symmetry_space_group_name_H-M [P6/mmm]
_cell_length_a [4.1747]
_cell_length_b [4.1747]
_cell_length_c [5.2451]
_... |
agm003957831 | IrMnSb2 | data_[Mn4Sb8Ir4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mn 1.5500 1.4000 0.6483
Sb 2.0500 1.4500 0.8300
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.8121]
_cell_length_b [6.8121]
_cell_length_c [6.8121]
_c... |
agm004289666 | La3Ru | data_[La3Ru1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [5.5893]
_cell_length_b [5.5893]
_cell_length_c [5.5893]
_cell_angle_alpha [90.0000]
_cell_... |
agm002565710 | OSc3Y | data_[Y1Sc3O1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Sc 1.3600 1.6000 0.8850
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.6490]
_cell_length_b [4.6490]
_cell_length_c [4.6490]
_cell_... |
agm005112100 | Dy2HoSe | data_[Dy6Ho3Se3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Ho 1.2300 1.7500 1.0410
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [3.7836]
_cell_length_b [3.7836]
_cell_length_c [28.1215]
_ce... |
oqmd-2315368 | BMo2Pd | data_[B4Mo8Pd4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
B 2.0400 0.8500 0.4100
Mo 2.1600 1.4500 0.7750
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.0414]
_cell_length_b [6.0414]
_cell_length_c [6.0414]
_cel... |
agm004732806 | InTb3Te8Tl4 | data_[Tb9Tl12In3Te24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Tl 1.6200 1.9000 1.3325
In 1.7800 1.5500 0.9400
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.9304]
_cell_length_b [8... |
agm001350557 | AgCaIrSc | data_[Ca4Sc4Ag4Ir4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Sc 1.3600 1.6000 0.8850
Ag 1.9300 1.6000 1.0867
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.8195]
_cell_length_b [6.... |
agm001181436 | NdTbTh4 | data_[Tb4Nd4Th16]
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
Th 1.3000 1.8000 1.0800
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [9.4097]
_cell_length_b [9.4097]
_cell_length_c [9.4097]
_... |
agm004090461 | Co2LaOs | data_[La3Co6Os3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Co 1.8800 1.3500 0.7683
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [2.8439]
_cell_length_b [2.8439]
_cell_length_c [27.6087]
_c... |
oqmd-3619066 | CoLuRu | data_[Lu4Co4Ru4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Lu 1.2700 1.7500 1.0010
Co 1.8800 1.3500 0.7683
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.1001]
_cell_length_b [6.1001]
_cell_length_c [6.1001]
_c... |
agm004161857 | Mo2PbZn | data_[Zn2Mo4Pb2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
Mo 2.1600 1.4500 0.7750
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [4.1614]
_cell_length_b [4.1614]
_cell_length_c [8.0575]
_c... |
oqmd-9643527 | Ga4ScV2 | data_[Sc2V4Ga8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
V 1.6300 1.3500 0.7775
Ga 1.8100 1.3000 0.7600
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [6.4835]
_cell_length_b [6.4835]
_cell_length_c [5.1761]
_ce... |
agm003314946 | Ce5Os2Tc2 | data_[Ce20Tc8Os8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Tc 1.9000 1.3500 0.7417
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [Ima2]
_cell_length_a [17.2433]
_cell_length_b [6.5946]
_cell_length_c [7.1960]
_... |
agm2000001544 | H3Tl | data_[Tl2H6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tl 1.6200 1.9000 1.3325
H 2.2000 0.2500 0.0000
]
_symmetry_space_group_name_H-M [Pc]
_cell_length_a [4.9831]
_cell_length_b [18.0490]
_cell_length_c [4.6727]
_cell_angle_alpha [90.0000]
_cell_angl... |
agm004991869 | AgAuIrPm2 | data_[Pm4Ag2Ir2Au2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Ag 1.9300 1.6000 1.0867
Ir 2.2000 1.3500 0.7650
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [P4/nmm]
_cell_length_a [4.1863]
_cell_length_b [4... |
agm002004856 | CeK2Rb | data_[K6Rb3Ce3]
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
Ce 1.1200 1.8500 1.0800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.0382]
_cell_length_b [4.0382]
_cell_length_c [48.9223]
_cel... |
agm002845324 | FGaLi2 | data_[Li8Ga4F4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Ga 1.8100 1.3000 0.7600
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [5.7071]
_cell_length_b [5.7071]
_cell_length_c [7.5366]
_cel... |
agm001312864 | CoDyRuTa | data_[Dy4Ta4Co4Ru4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Ta 1.5000 1.4500 0.8200
Co 1.8800 1.3500 0.7683
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.4745]
_cell_length_b [6.... |
oqmd-3683737 | CsNOTb | data_[Cs2Tb2N2O2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cs 0.7900 2.6000 1.8100
Tb 1.1000 1.7500 0.9815
N 3.0400 0.6500 0.6300
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [3.7524]
_cell_length_b [7.913... |
agm002556492 | NiPt3Zn | data_[Zn1Ni1Pt3]
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
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.5563]
_cell_length_b [4.5563]
_cell_length_c [4.5563]
_c... |
agm005807767 | Ce4ReZn | data_[Ce16Zn4Re4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Zn 1.6500 1.3500 0.8800
Re 1.9000 1.3500 0.7125
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.4102]
_cell_length_b [12.4595]
_cell_length_c [5.9210]
_... |
agm001544965 | HgIrNb2Te | data_[Nb2Hg1Te1Ir1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nb 1.6000 1.4500 0.8200
Hg 2.0000 1.5000 1.2450
Te 2.1000 1.4000 1.2933
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.0506]
_cell_length_b [5... |
agm005614992 | Mg2P3Ru5 | data_[Mg8P12Ru20]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
P 2.1900 1.0000 0.5500
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.9086]
_cell_length_b [23.5134]
_cell_length_c [6.1202]
... |
agm005936377 | Cd4Tb3Tm | data_[Tb3Tm1Cd4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Tm 1.2500 1.7500 1.0950
Cd 1.6900 1.5500 1.0900
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.2699]
_cell_length_b [5.2699]
_cell_length_c [7.5583]
_... |
agm004391801 | In2NiSc | data_[Sc1In2Ni1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
In 1.7800 1.5500 0.9400
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.2027]
_cell_length_b [3.2027]
_cell_length_c [7.8968]
_ce... |
agm005814532 | H4PaPu | data_[Pu1Pa1H4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pu 1.2800 1.7500 0.9675
Pa 1.5000 1.8000 1.0400
H 2.2000 0.2500 0.0000
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.9070]
_cell_length_b [3.9070]
_cell_length_c [4.6164]
_ce... |
agm004107456 | CdCoHg | data_[Cd1Co1Hg1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cd 1.6900 1.5500 1.0900
Co 1.8800 1.3500 0.7683
Hg 2.0000 1.5000 1.2450
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [3.0204]
_cell_length_b [3.0204]
_cell_length_c [6.9747]
_ce... |
agm005598764 | H8Pd3Pt2 | data_[H16Pd6Pt4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
H 2.2000 0.2500 0.0000
Pd 2.2000 1.4000 0.8462
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.0843]
_cell_length_b [5.4525]
_cell_length_c [5.1076]
_ce... |
agm005773650 | AuErPd14 | data_[Er1Pd14Au1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Er 1.2400 1.7500 1.0300
Pd 2.2000 1.4000 0.8462
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.6460]
_cell_length_b [5.6460]
_cell_length_c [8.0499]
... |
agm001345884 | CuDyHgIn | data_[Dy4In4Cu4Hg4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
In 1.7800 1.5500 0.9400
Cu 1.9000 1.3500 0.8200
Hg 2.0000 1.5000 1.2450
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.9907]
_cell_length_b [6.... |
agm002474860 | CuFe3Mo | data_[Fe3Cu1Mo1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Fe 1.8300 1.4000 0.8525
Cu 1.9000 1.3500 0.8200
Mo 2.1600 1.4500 0.7750
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.4294]
_cell_length_b [4.4294]
_cell_length_c [4.4294]
_c... |
agm004669256 | Al2Ba3CeO8 | data_[Ba3Ce1Al2O8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Ce 1.1200 1.8500 1.0800
Al 1.6100 1.2500 0.6750
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.9575]
_cell_length_b [5.95... |
agm003632003 | CoPaPt2 | data_[Pa2Co2Pt4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pa 1.5000 1.8000 1.0400
Co 1.8800 1.3500 0.7683
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.9537]
_cell_length_b [3.9537]
_cell_length_c [8.6752]
_... |
agm004553583 | As2PaPu2Rh2 | data_[Pu6Pa3As6Rh6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pu 1.2800 1.7500 0.9675
Pa 1.5000 1.8000 1.0400
As 2.1800 1.1500 0.6600
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.2084]
_cell_length_b [4.2... |
agm005171979 | NdPd5TmZn2 | data_[Nd1Tm1Zn2Pd5]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nd 1.1400 1.8500 1.2765
Tm 1.2500 1.7500 1.0950
Zn 1.6500 1.3500 0.8800
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.1858]
_cell_length_b [4... |
agm003503358 | Al2GeO6 | data_[Al4Ge2O12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Al 1.6100 1.2500 0.6750
Ge 2.0100 1.2500 0.7700
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P4_2/mnm]
_cell_length_a [4.4509]
_cell_length_b [4.4509]
_cell_length_c [8.6795]
... |
agm005757657 | Te6VZr2 | data_[Zr4V2Te12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zr 1.3300 1.5500 0.8600
V 1.6300 1.3500 0.7775
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.5599]
_cell_length_b [3.8658]
_cell_length_c [9.7088]
_ce... |
agm003834775 | Cr2ScZr | data_[Zr1Sc1Cr2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zr 1.3300 1.5500 0.8600
Sc 1.3600 1.6000 0.8850
Cr 1.6600 1.4000 0.9400
]
_symmetry_space_group_name_H-M [Pmmm]
_cell_length_a [3.3185]
_cell_length_b [4.6007]
_cell_length_c [4.7612]
_ce... |
agm003415435 | GaGe3Sc2 | data_[Sc8Ga4Ge12]
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
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [11.9586]
_cell_length_b [8.1062]
_cell_length_c [5.1218]
_... |
agm004981096 | AcN6P2V | data_[Ac4V4P8N24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
V 1.6300 1.3500 0.7775
P 2.1900 1.0000 0.5500
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.5549]
_cell_length_b [10.7523]... |
oqmd-3363221 | MoRuTm | data_[Tm4Mo4Ru4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tm 1.2500 1.7500 1.0950
Mo 2.1600 1.4500 0.7750
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.3280]
_cell_length_b [6.3280]
_cell_length_c [6.3280]
_c... |
agm001111549 | SbSnTh2 | data_[Th8Sn4Sb4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Th 1.3000 1.8000 1.0800
Sn 1.9600 1.4500 0.8300
Sb 2.0500 1.4500 0.8300
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [7.7427]
_cell_length_b [7.7427]
_cell_length_c [7.7427]
_c... |
agm002316299 | NiSi2V2 | data_[V8Si8Ni4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
V 1.6300 1.3500 0.7775
Si 1.9000 1.1000 0.5400
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.2938]
_cell_length_b [3.5919]
_cell_length_c [8.6847]
_cell... |
agm002574387 | Bi3IrPd | data_[Bi3Ir1Pd1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Bi 2.0200 1.6000 1.0350
Ir 2.2000 1.3500 0.7650
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [5.3071]
_cell_length_b [5.3071]
_cell_length_c [5.3071]
_c... |
agm004263496 | In2LaZr | data_[La3Zr3In6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Zr 1.3300 1.5500 0.8600
In 1.7800 1.5500 0.9400
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.3844]
_cell_length_b [3.3844]
_cell_length_c [32.1352]
_c... |
agm002729904 | CaSV2 | data_[Ca4V8S4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
V 1.6300 1.3500 0.7775
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [6.3542]
_cell_length_b [6.3542]
_cell_length_c [6.3542]
_cell_... |
agm005061037 | CaO4PaPd | data_[Ca4Pa4Pd4O16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Pa 1.5000 1.8000 1.0400
Pd 2.2000 1.4000 0.8462
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [7.0074]
_cell_length_b [7.27... |
agm001285812 | AcGeInSn | data_[Ac4In4Sn4Ge4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
In 1.7800 1.5500 0.9400
Sn 1.9600 1.4500 0.8300
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.7092]
_cell_length_b [7.... |
agm004560337 | In2KTe4Tl2 | data_[K2Tl4In4Te8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Tl 1.6200 1.9000 1.3325
In 1.7800 1.5500 0.9400
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.2670]
_cell_length_b [4.99... |
agm1000013648 | F3V | data_[V1F3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
V 1.6300 1.3500 0.7775
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [16.6917]
_cell_length_b [3.4021]
_cell_length_c [16.6917]
_cell_angle_alpha [90.0000]
_cell_angle... |
agm002863348 | INa2W | data_[Na8W4I4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
W 2.3600 1.3500 0.7667
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [8.8100]
_cell_length_b [8.8100]
_cell_length_c [6.1755]
_cell_... |
agm004501868 | Dy2MnNi12Zn3 | data_[Dy6Mn3Zn9Ni36]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Mn 1.5500 1.4000 0.6483
Zn 1.6500 1.3500 0.8800
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.9529]
_cell_length_b [5.... |
agm004304760 | BrTcTe2 | data_[Tc2Te4Br2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tc 1.9000 1.3500 0.7417
Te 2.1000 1.4000 1.2933
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.5498]
_cell_length_b [3.5016]
_cell_length_c [8.3442]
_ce... |
agm004566520 | Ga4Ge2NiTb2 | data_[Tb4Ga8Ni2Ge4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Ga 1.8100 1.3000 0.7600
Ni 1.9100 1.3500 0.7400
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [6.1091]
_cell_length_b [6... |
agm001115623 | NiTiZn2 | data_[Ti1Zn2Ni1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ti 1.5400 1.4000 0.8517
Zn 1.6500 1.3500 0.8800
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [2.9209]
_cell_length_b [2.9209]
_cell_length_c [6.4963]
_... |
agm004604824 | AuP2Se3Th6 | data_[Th12P4Au2Se6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Th 1.3000 1.8000 1.0800
P 2.1900 1.0000 0.5500
Au 2.5400 1.3500 1.0700
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.4200]
_cell_length_b [4.1... |
mp-1201524 | Na10O29S6U | data_[Na40U4S24O116]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
U 1.3800 1.7500 0.9913
S 2.5800 1.0000 0.8800
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [9.4180]
_cell_length_b [28.9911... |
agm003497625 | Al2ErNi6 | data_[Er2Al4Ni12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Er 1.2400 1.7500 1.0300
Al 1.6100 1.2500 0.6750
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [2.8236]
_cell_length_b [6.8128]
_cell_length_c [12.5789]
_... |
agm001292639 | NiTcTiZr | data_[Zr4Ti4Tc4Ni4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zr 1.3300 1.5500 0.8600
Ti 1.5400 1.4000 0.8517
Tc 1.9000 1.3500 0.7417
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.3327]
_cell_length_b [6.... |
agm006036664 | Ga4Ni2Zn | data_[Zn3Ga12Ni6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
Ga 1.8100 1.3000 0.7600
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.9482]
_cell_length_b [3.9482]
_cell_length_c [25.1540]
_... |
agm2000071323 | Ag3AlSe3 | data_[Al1Ag3Se3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Al 1.6100 1.2500 0.6750
Ag 1.9300 1.6000 1.0867
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.4094]
_cell_length_b [7.3620]
_cell_length_c [19.0686]
_c... |
agm004920660 | HoS8SmTm4 | data_[Sm3Ho3Tm12S24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sm 1.1700 1.8500 1.2290
Ho 1.2300 1.7500 1.0410
Tm 1.2500 1.7500 1.0950
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [7.9870]
_cell_length_b [7.98... |
agm004641928 | Na3NdPm2S6 | data_[Na6Pm4Nd2S12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Pm 1.1300 1.8500 1.1100
Nd 1.1400 1.8500 1.2765
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1230]
_cell_length_b [12.3... |
agm005060029 | LiNbO4Pt | data_[Li4Nb4Pt4O16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Nb 1.6000 1.4500 0.8200
Pt 2.2800 1.3500 0.8050
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [5.9190]
_cell_length_b [5.98... |
agm003347356 | Ce3Co2Ge6 | data_[Ce6Co4Ge12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Co 1.8800 1.3500 0.7683
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [4.0549]
_cell_length_b [4.0549]
_cell_length_c [27.1908]... |
agm001995090 | GeTh2Zn | data_[Th6Zn3Ge3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Th 1.3000 1.8000 1.0800
Zn 1.6500 1.3500 0.8800
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.9178]
_cell_length_b [3.9178]
_cell_length_c [29.9807]
_c... |
agm002884677 | Os2SSr | data_[Sr4Os8S4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Os 2.2000 1.3000 0.6730
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [4.8878]
_cell_length_b [4.8878]
_cell_length_c [15.8056]
_ce... |
agm004718365 | LiNd4S8Y3 | data_[Li3Nd12Y9S24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Nd 1.1400 1.8500 1.2765
Y 1.2200 1.8000 1.0400
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.9328]
_cell_length_b [7.932... |
agm003023845 | AuTc2Ti2 | data_[Ti4Tc4Au2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ti 1.5400 1.4000 0.8517
Tc 1.9000 1.3500 0.7417
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [7.1958]
_cell_length_b [7.1958]
_cell_length_c [3.1648]
_... |
oqmd-2895607 | BaOsTm | data_[Ba4Tm4Os4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Tm 1.2500 1.7500 1.0950
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.0273]
_cell_length_b [7.0273]
_cell_length_c [7.0273]
_c... |
agm001527574 | AgBaClRh2 | data_[Ba1Ag1Rh2Cl1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Ag 1.9300 1.6000 1.0867
Rh 2.2800 1.3500 0.7450
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.1358]
_cell_length_b [5... |
agm005211346 | InMgSmSr | data_[Sr1Sm1Mg1In1]
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
Mg 1.3100 1.5000 0.8600
In 1.7800 1.5500 0.9400
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.9567]
_cell_length_b [3.9... |
agm005711646 | Ba2Cd3La | data_[Ba8La4Cd12]
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
Cd 1.6900 1.5500 1.0900
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [5.8492]
_cell_length_b [17.5732]
_cell_length_c [8.2946]
_... |
oqmd-8997859 | AgAs2InSe6 | data_[In2Ag2As4Se12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
In 1.7800 1.5500 0.9400
Ag 1.9300 1.6000 1.0867
As 2.1800 1.1500 0.6600
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [P-31c]
_cell_length_a [6.6618]
_cell_length_b [6... |
oqmd-4141200 | CaPd | data_[Ca1Pd1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [3.6987]
_cell_length_b [3.6987]
_cell_length_c [3.9933]
_cell_angle_alpha [90.0000]
_cell_... |
agm004189331 | BaCdPb2 | data_[Ba1Cd1Pb2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Cd 1.6900 1.5500 1.0900
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [3.8820]
_cell_length_b [5.6042]
_cell_length_c [6.3584]
_cell... |
agm005638810 | O6Pa2Pt | data_[Pa4Pt2O12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pa 1.5000 1.8000 1.0400
Pt 2.2800 1.3500 0.8050
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.5689]
_cell_length_b [5.8667]
_cell_length_c [8.9580]
_c... |
agm005607937 | In2TbY3 | data_[Tb2Y6In4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Y 1.2200 1.8000 1.0400
In 1.7800 1.5500 0.9400
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [5.2127]
_cell_length_b [9.8118]
_cell_length_c [6.7427]
_ce... |
agm004771675 | DyEr2Pr4Sm | data_[Pr4Sm1Dy1Er2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pr 1.1300 1.8500 1.0600
Sm 1.1700 1.8500 1.2290
Dy 1.2200 1.7500 1.1310
Er 1.2400 1.7500 1.0300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.1697]
_cell_length_b [5... |
agm004774110 | Ag2BaSe4Te | data_[Ba2Ag4Te2Se8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Ag 1.9300 1.6000 1.0867
Te 2.1000 1.4000 1.2933
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [I222]
_cell_length_a [7.1434]
_cell_length_b [7.7... |
oqmd-9215524 | Au7Ge2Rb4 | data_[Rb12Ge6Au21]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Ge 2.0100 1.2500 0.7700
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [6.6818]
_cell_length_b [6.6818]
_cell_length_c [28.8101]
... |
oqmd-9100715 | Bi2KRbS4 | data_[K2Rb2Bi4S8]
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
Bi 2.0200 1.6000 1.0350
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [8.9519]
_cell_length_b [9.4925]
_... |
agm001279381 | GdPmSr | data_[Sr1Pm1Gd1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Pm 1.1300 1.8500 1.1100
Gd 1.2000 1.8000 1.0750
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [3.7770]
_cell_length_b [3.7770]
_cell_length_c [9.3836]
_ce... |
agm003286527 | In17Tl2 | data_[Tl6In51]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tl 1.6200 1.9000 1.3325
In 1.7800 1.5500 0.9400
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [10.5324]
_cell_length_b [10.5324]
_cell_length_c [17.2734]
_cell_angle_alpha [90.0000]
_ce... |
agm005941886 | HgPt2Tb8 | data_[Tb16Hg2Pt4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Hg 2.0000 1.5000 1.2450
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.6361]
_cell_length_b [13.4759]
_cell_length_c [5.5556]
_... |
agm003556983 | AuH4K3 | data_[K6H8Au2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
H 2.2000 0.2500 0.0000
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [5.9937]
_cell_length_b [8.3755]
_cell_length_c [6.0748]
_cell_a... |
agm004513974 | Ir3Pu2Si4Ti | data_[Pu2Ti1Si4Ir3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pu 1.2800 1.7500 0.9675
Ti 1.5400 1.4000 0.8517
Si 1.9000 1.1000 0.5400
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.0903]
_cell_length_b [4.... |
agm003995958 | MoOs2P | data_[Mo2P2Os4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mo 2.1600 1.4500 0.7750
P 2.1900 1.0000 0.5500
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.5393]
_cell_length_b [2.8321]
_cell_length_c [4.3522]
_cell... |
agm001541981 | BaCr2RuTe | data_[Ba1Cr2Te1Ru1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Cr 1.6600 1.4000 0.9400
Te 2.1000 1.4000 1.2933
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.8982]
_cell_length_b [4... |
agm004423765 | CdTa3 | data_[Ta3Cd1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ta 1.5000 1.4500 0.8200
Cd 1.6900 1.5500 1.0900
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [2.8123]
_cell_length_b [4.7839]
_cell_length_c [5.6761]
_cell_angle_alpha [90.0000]
_cell_a... |
agm001086311 | AgErIn2 | data_[Er4In8Ag4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Er 1.2400 1.7500 1.0300
In 1.7800 1.5500 0.9400
Ag 1.9300 1.6000 1.0867
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [7.1965]
_cell_length_b [7.1965]
_cell_length_c [7.1965]
_c... |
agm004112821 | BeCu2Sb | data_[Be1Cu2Sb1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Be 1.5700 1.0500 0.5900
Cu 1.9000 1.3500 0.8200
Sb 2.0500 1.4500 0.8300
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.2491]
_cell_length_b [3.5055]
_cell_length_c [5.1564]
_ce... |
agm001272111 | EuPbPd | data_[Eu1Pd1Pb1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Eu 1.2000 1.8500 1.1985
Pd 2.2000 1.4000 0.8462
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [4.8189]
_cell_length_b [4.8189]
_cell_length_c [3.8873]
_c... |
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