Database stringlengths 6 13 | Reduced Formula stringlengths 1 23 | CIF stringlengths 760 15.5k |
|---|---|---|
agm001820825 | Au12I5Sb3 | data_[Sb24Au96I40]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sb 2.0500 1.4500 0.8300
Au 2.5400 1.3500 1.0700
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [Ia-3d]
_cell_length_a [16.5922]
_cell_length_b [16.5922]
_cell_length_c [16.5922... |
agm003328896 | Ac3Tb2Tl3 | data_[Ac6Tb4Tl6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Tb 1.1000 1.7500 0.9815
Tl 1.6200 1.9000 1.3325
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.0199]
_cell_length_b [5.7703]
_cell_length_c [23.9061]
_c... |
agm003578579 | BiSb3Te6 | data_[Bi2Sb6Te12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Bi 2.0200 1.6000 1.0350
Sb 2.0500 1.4500 0.8300
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [12.6089]
_cell_length_b [4.3367]
_cell_length_c [13.7395... |
agm004488234 | Ba3Pd2Rh2Sn4 | data_[Ba3Sn4Pd2Rh2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Sn 1.9600 1.4500 0.8300
Pd 2.2000 1.4000 0.8462
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [4.6158]
_cell_length_b [4.... |
oqmd-2626407 | CuIrPbPt | data_[Cu4Ir4Pt4Pb4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cu 1.9000 1.3500 0.8200
Ir 2.2000 1.3500 0.7650
Pt 2.2800 1.3500 0.8050
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.4401]
_cell_length_b [6.... |
agm006076990 | Cu4LiPd7 | data_[Li1Cu4Pd7]
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 [P-1]
_cell_length_a [4.5268]
_cell_length_b [4.9363]
_cell_length_c [7.7774]
_cel... |
agm002162749 | MnZr | data_[Zr4Mn4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zr 1.3300 1.5500 0.8600
Mn 1.5500 1.4000 0.6483
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.9305]
_cell_length_b [9.9462]
_cell_length_c [3.5614]
_cell_angle_alpha [90.0000]
_cell_a... |
agm006025552 | Ag4Sb2Sr | data_[Sr2Ag8Sb4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Ag 1.9300 1.6000 1.0867
Sb 2.0500 1.4500 0.8300
]
_symmetry_space_group_name_H-M [P4_2/mnm]
_cell_length_a [8.5476]
_cell_length_b [8.5476]
_cell_length_c [4.5511]... |
agm005618514 | Au2Rb4Tl3 | data_[Rb8Tl6Au4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Tl 1.6200 1.9000 1.3325
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.0164]
_cell_length_b [4.7365]
_cell_length_c [8.6851]
_c... |
mp-2714504 | In4Na2O24S5Si | data_[Na6In12Si3S15O72]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
In 1.7800 1.5500 0.9400
Si 1.9000 1.1000 0.5400
S 2.5800 1.0000 0.8800
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a... |
agm004130333 | CdInTc2 | data_[Cd1In1Tc2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cd 1.6900 1.5500 1.0900
In 1.7800 1.5500 0.9400
Tc 1.9000 1.3500 0.7417
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [2.8579]
_cell_length_b [4.6984]
_cell_length_c [5.3192]
_ce... |
agm004542870 | Ac2Bi2CeTe2 | data_[Ac4Ce2Bi4Te4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Ce 1.1200 1.8500 1.0800
Bi 2.0200 1.6000 1.0350
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [5.9620]
_cell_length_b [5... |
agm005088731 | AgCdI6Pa | data_[Pa2Cd2Ag2I12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pa 1.5000 1.8000 1.0400
Cd 1.6900 1.5500 1.0900
Ag 1.9300 1.6000 1.0867
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [P-31c]
_cell_length_a [7.5415]
_cell_length_b [7.5... |
oqmd-5621579 | HgNaS3Tb | data_[Na2Tb2Hg2S6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Tb 1.1000 1.7500 0.9815
Hg 2.0000 1.5000 1.2450
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.9023]
_cell_length_b [4.0... |
agm004790242 | DyGa2LiPt4 | data_[Li3Dy3Ga6Pt12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Dy 1.2200 1.7500 1.1310
Ga 1.8100 1.3000 0.7600
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.3227]
_cell_length_b [4.... |
agm004156435 | ClCuTe2 | data_[Cu1Te2Cl1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cu 1.9000 1.3500 0.8200
Te 2.1000 1.4000 1.2933
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.0160]
_cell_length_b [4.7646]
_cell_length_c [6.2931]
_cell... |
oqmd-3390076 | Be2CoRe | data_[Be8Co4Re4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Be 1.5700 1.0500 0.5900
Co 1.8800 1.3500 0.7683
Re 1.9000 1.3500 0.7125
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [5.5421]
_cell_length_b [5.5421]
_cell_length_c [5.5421]
_c... |
agm005728039 | O6PuSn | data_[Pu2Sn2O12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pu 1.2800 1.7500 0.9675
Sn 1.9600 1.4500 0.8300
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.1704]
_cell_length_b [8.6013]
_cell_length_c [5.6934]
_cel... |
agm002283442 | As2Li2V | data_[Li2V1As2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
V 1.6300 1.3500 0.7775
As 2.1800 1.1500 0.6600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [3.8112]
_cell_length_b [3.8112]
_cell_length_c [6.6244]
_cel... |
agm001186738 | ErTbV4 | data_[Tb4Er4V16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Er 1.2400 1.7500 1.0300
V 1.6300 1.3500 0.7775
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.5977]
_cell_length_b [7.5977]
_cell_length_c [7.5977]
_ce... |
agm003852645 | ScSiTc2 | data_[Sc1Si1Tc2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
Si 1.9000 1.1000 0.5400
Tc 1.9000 1.3500 0.7417
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [2.9765]
_cell_length_b [2.9765]
_cell_length_c [7.0963]
_ce... |
agm004218703 | Mg2MnPb | data_[Mg4Mn2Pb2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
Mn 1.5500 1.4000 0.6483
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [6.1774]
_cell_length_b [8.0851]
_cell_length_c [3.4762]
_ce... |
agm005801193 | K3N2Tc | data_[K12Tc4N8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Tc 1.9000 1.3500 0.7417
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [10.2643]
_cell_length_b [7.9400]
_cell_length_c [6.6229]
_cell... |
agm002639970 | BCaRh2 | data_[Ca4B4Rh8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
B 2.0400 0.8500 0.4100
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [6.0940]
_cell_length_b [6.0940]
_cell_length_c [6.0940]
_cel... |
agm001694433 | AlF2NTe | data_[Al1Te1N1F2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Al 1.6100 1.2500 0.6750
Te 2.1000 1.4000 1.2933
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 [4.6873]
_cell_length_b [4.687... |
agm003649395 | HgMg4Pm5 | data_[Pm5Mg4Hg1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Mg 1.3100 1.5000 0.8600
Hg 2.0000 1.5000 1.2450
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.8566]
_cell_length_b [3.8566]
_cell_length_c [19.2106]
... |
agm003547063 | Ba3Pd3Tl | data_[Ba6Tl2Pd6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Tl 1.6200 1.9000 1.3325
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P6_3/m]
_cell_length_a [9.6551]
_cell_length_b [9.6551]
_cell_length_c [6.4131]
_... |
agm003469388 | F5LiPb2 | data_[Li4Pb8F20]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Pb 2.3300 1.8000 1.1225
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.5866]
_cell_length_b [12.3233]
_cell_length_c [11.3367]
_c... |
agm003895215 | KMo2Y | data_[K2Y2Mo4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Y 1.2200 1.8000 1.0400
Mo 2.1600 1.4500 0.7750
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.9610]
_cell_length_b [3.9610]
_cell_length_c [10.6894]
_cel... |
agm004196306 | IrSb2Y | data_[Y2Sb4Ir2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Sb 2.0500 1.4500 0.8300
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [4.3018]
_cell_length_b [4.3018]
_cell_length_c [9.5271]
_cel... |
agm005083873 | AcLaO6U | data_[Ac2La2U2O12]
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
U 1.3800 1.7500 0.9913
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P-31c]
_cell_length_a [6.1968]
_cell_length_b [6.196... |
agm005763849 | Hg5LaTb | data_[La1Tb1Hg5]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Tb 1.1000 1.7500 0.9815
Hg 2.0000 1.5000 1.2450
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.6736]
_cell_length_b [4.6736]
_cell_length_c [8.9372]
_... |
agm002550746 | Nb3OsRe | data_[Nb3Re1Os1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nb 1.6000 1.4500 0.8200
Re 1.9000 1.3500 0.7125
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.7682]
_cell_length_b [4.7682]
_cell_length_c [4.7682]
_c... |
agm003471227 | Au5InLi2 | data_[Li4In2Au10]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
In 1.7800 1.5500 0.9400
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [5.8882]
_cell_length_b [5.8882]
_cell_length_c [8.0767]
... |
oqmd-6864837 | DyHoNi2 | data_[Dy2Ho2Ni4]
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
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.4000]
_cell_length_b [4.1639]
_cell_length_c [7.0246]
_... |
agm005122624 | Bi2SbTl | data_[Tl3Bi6Sb3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tl 1.6200 1.9000 1.3325
Bi 2.0200 1.6000 1.0350
Sb 2.0500 1.4500 0.8300
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.2561]
_cell_length_b [4.2561]
_cell_length_c [25.6822]
_ce... |
agm001142856 | CeDy2Li | data_[Li1Ce1Dy2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Ce 1.1200 1.8500 1.0800
Dy 1.2200 1.7500 1.1310
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.5811]
_cell_length_b [3.5811]
_cell_length_c [8.5975]
_... |
agm002450303 | ClIn3Se | data_[In3Se1Cl1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
In 1.7800 1.5500 0.9400
Se 2.5500 1.1500 1.0133
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [5.7121]
_cell_length_b [5.7121]
_cell_length_c [5.7121]
_c... |
agm001119190 | LuPt2Tl | data_[Lu1Tl1Pt2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Lu 1.2700 1.7500 1.0010
Tl 1.6200 1.9000 1.3325
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.4765]
_cell_length_b [3.4765]
_cell_length_c [6.6884]
_... |
agm004403348 | AgSi2Zr | data_[Zr3Si6Ag3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zr 1.3300 1.5500 0.8600
Si 1.9000 1.1000 0.5400
Ag 1.9300 1.6000 1.0867
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.0020]
_cell_length_b [3.0020]
_cell_length_c [27.2489]
_c... |
agm002872379 | IrOSe2 | data_[Ir4Se8O4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ir 2.2000 1.3500 0.7650
Se 2.5500 1.1500 1.0133
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [5.3383]
_cell_length_b [5.3383]
_cell_length_c [11.0350]
_ce... |
agm001284667 | GeNiRuTc | data_[Tc4Ni4Ge4Ru4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tc 1.9000 1.3500 0.7417
Ni 1.9100 1.3500 0.7400
Ge 2.0100 1.2500 0.7700
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [5.9723]
_cell_length_b [5.... |
agm005436475 | CoPbSe4 | data_[Co4Pb4Se16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Co 1.8800 1.3500 0.7683
Pb 2.3300 1.8000 1.1225
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [8.1936]
_cell_length_b [8.1936]
_cell_length_c [8.1936]
_... |
agm004613018 | HoLi2Pm3Te6 | data_[Li4Pm6Ho2Te12]
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
Ho 1.2300 1.7500 1.0410
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.1350]
_cell_length_b [4... |
agm001579947 | BrF2HgNa | data_[Na1Hg1Br1F2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Hg 2.0000 1.5000 1.2450
Br 2.9600 1.1500 0.8825
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.2205]
_cell_length_b [4.2... |
agm005548657 | Al8Tm | data_[Tm2Al16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tm 1.2500 1.7500 1.0950
Al 1.6100 1.2500 0.6750
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [8.8895]
_cell_length_b [8.8895]
_cell_length_c [4.0977]
_cell_angle_alpha [90.0000]
_cel... |
agm004300378 | In3Mn | data_[Mn3In9]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mn 1.5500 1.4000 0.6483
In 1.7800 1.5500 0.9400
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.2853]
_cell_length_b [3.2853]
_cell_length_c [29.1840]
_cell_angle_alpha [90.0000]
_cell_... |
agm003315213 | Er2Pr5Sm2 | data_[Pr20Sm8Er8]
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
Er 1.2400 1.7500 1.0300
]
_symmetry_space_group_name_H-M [Ima2]
_cell_length_a [15.3170]
_cell_length_b [13.0455]
_cell_length_c [6.2722]
... |
agm002674626 | Fe2IrSn | data_[Fe8Sn4Ir4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Fe 1.8300 1.4000 0.8525
Sn 1.9600 1.4500 0.8300
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [6.1576]
_cell_length_b [6.1576]
_cell_length_c [6.1576]
_c... |
agm005651138 | Ce2ScTl | data_[Ce8Sc4Tl4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Sc 1.3600 1.6000 0.8850
Tl 1.6200 1.9000 1.3325
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [6.2005]
_cell_length_b [12.3428]
_cell_length_c [5.2487]
_c... |
agm005599757 | Ce3S8Tb2 | data_[Tb4Ce6S16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Ce 1.1200 1.8500 1.0800
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.0330]
_cell_length_b [8.2560]
_cell_length_c [7.1239]
_ce... |
agm005689397 | C3Ru2Sr | data_[Sr4Ru8C12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Ru 2.2000 1.3000 0.6610
C 2.5500 0.7000 0.3000
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [7.0808]
_cell_length_b [9.9731]
_cell_length_c [5.3746]
_cel... |
agm002699466 | MgNiPb2 | data_[Mg4Ni4Pb8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
Ni 1.9100 1.3500 0.7400
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [7.0689]
_cell_length_b [7.0689]
_cell_length_c [7.0689]
_c... |
agm004992346 | FNPm2Te | data_[Pm4Te2N2F2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Te 2.1000 1.4000 1.2933
N 3.0400 0.6500 0.6300
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [4.0464]
_cell_length_b [4.0464... |
oqmd-9776329 | AlIr2Na4Si | data_[Na4Al1Si1Ir2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Al 1.6100 1.2500 0.6750
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 [4.5296]
_cell_length_b [4.... |
agm005722206 | Al11Tb4Y9 | data_[Tb8Y18Al22]
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
Al 1.6100 1.2500 0.6750
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [15.4359]
_cell_length_b [22.3553]
_cell_length_c [3.3750]
_... |
agm004259113 | CdSi2Zn | data_[Zn1Cd1Si2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
Cd 1.6900 1.5500 1.0900
Si 1.9000 1.1000 0.5400
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [2.9553]
_cell_length_b [5.0751]
_cell_length_c [4.7838]
_ce... |
agm004387696 | AlAsK | data_[K4Al4As4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Al 1.6100 1.2500 0.6750
As 2.1800 1.1500 0.6600
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.9661]
_cell_length_b [6.9661]
_cell_length_c [6.9661]
_cel... |
agm001733426 | ClCrN2Se | data_[Cr1Se1N2Cl1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cr 1.6600 1.4000 0.9400
Se 2.5500 1.1500 1.0133
N 3.0400 0.6500 0.6300
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.8290]
_cell_length_b [3.8... |
agm001467656 | BCo2PSe | data_[Co2B1P1Se1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Co 1.8800 1.3500 0.7683
B 2.0400 0.8500 0.4100
P 2.1900 1.0000 0.5500
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.1277]
_cell_length_b [4.127... |
agm001210848 | LaLuPb2 | data_[La1Lu1Pb2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Lu 1.2700 1.7500 1.0010
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.1157]
_cell_length_b [5.1157]
_cell_length_c [4.5385]
_... |
agm005533103 | Ac13Tm3 | data_[Ac26Tm6]
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
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [7.8776]
_cell_length_b [12.6122]
_cell_length_c [13.6128]
_cell_angle_alpha [90.0000]
_cel... |
agm005956825 | Nd5PmPt2 | data_[Pm4Nd20Pt8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Nd 1.1400 1.8500 1.2765
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.9754]
_cell_length_b [12.6106]
_cell_length_c [15.5300]
... |
agm005163733 | MnN5Nd2Tc | data_[Nd8Mn4Tc4N20]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nd 1.1400 1.8500 1.2765
Mn 1.5500 1.4000 0.6483
Tc 1.9000 1.3500 0.7417
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.3534]
_cell_length_b [13... |
agm005104663 | BrPr2Ru | data_[Pr6Ru3Br3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pr 1.1300 1.8500 1.0600
Ru 2.2000 1.3000 0.6610
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.1019]
_cell_length_b [4.1019]
_cell_length_c [24.0057]
_ce... |
agm004782846 | AcN4SbTm2 | data_[Ac4Tm8Sb4N16]
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
Sb 2.0500 1.4500 0.8300
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.7851]
_cell_length_b [11.9... |
agm001458116 | C2HTcZn | data_[Zn1Tc1H1C2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
Tc 1.9000 1.3500 0.7417
H 2.2000 0.2500 0.0000
C 2.5500 0.7000 0.3000
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.9887]
_cell_length_b [3.988... |
agm004251492 | Br2ScTa | data_[Sc2Ta2Br4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
Ta 1.5000 1.4500 0.8200
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [3.2309]
_cell_length_b [5.0825]
_cell_length_c [10.3144]
_c... |
agm001471782 | MgPt2ReV | data_[Mg1V1Re1Pt2]
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
Re 1.9000 1.3500 0.7125
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.5662]
_cell_length_b [4.5... |
agm003356674 | La8Nd3Tm2 | data_[La16Nd6Tm4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Nd 1.1400 1.8500 1.2765
Tm 1.2500 1.7500 1.0950
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [7.7619]
_cell_length_b [20.5918]
_cell_length_c [5.9343]
_... |
agm004609229 | HP2Te3Tm6 | data_[Tm12Te6P4H2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tm 1.2500 1.7500 1.0950
Te 2.1000 1.4000 1.2933
P 2.1900 1.0000 0.5500
H 2.2000 0.2500 0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.8468]
_cell_length_b [4.035... |
agm003906356 | ClCoTe2 | data_[Co2Te4Cl2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Co 1.8800 1.3500 0.7683
Te 2.1000 1.4000 1.2933
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.2658]
_cell_length_b [5.3936]
_cell_length_c [10.8104]
_c... |
agm004115129 | Al2MgTc | data_[Mg4Al8Tc4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
Al 1.6100 1.2500 0.6750
Tc 1.9000 1.3500 0.7417
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.2828]
_cell_length_b [6.2828]
_cell_length_c [6.2828]
_c... |
agm005756296 | I6Sn2V | data_[V2Sn4I12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
V 1.6300 1.3500 0.7775
Sn 1.9600 1.4500 0.8300
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.1496]
_cell_length_b [4.3507]
_cell_length_c [10.7573]
_cel... |
agm004573432 | AgCs2P2S6 | data_[Cs6Ag3P6S18]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cs 0.7900 2.6000 1.8100
Ag 1.9300 1.6000 1.0867
P 2.1900 1.0000 0.5500
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.1430]
_cell_length_b [7.1430... |
agm001669402 | CrHInRu2 | data_[Cr1In1H1Ru2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cr 1.6600 1.4000 0.9400
In 1.7800 1.5500 0.9400
H 2.2000 0.2500 0.0000
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.0746]
_cell_length_b [4.0... |
agm002661284 | ClRb2Tl | data_[Rb8Tl4Cl4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Tl 1.6200 1.9000 1.3325
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [8.8581]
_cell_length_b [8.8581]
_cell_length_c [8.8581]
_c... |
agm005846310 | NbRhRu3 | data_[Nb3Ru9Rh3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nb 1.6000 1.4500 0.8200
Ru 2.2000 1.3000 0.6610
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.2831]
_cell_length_b [5.2831]
_cell_length_c [12.3553]
_c... |
agm2000113934 | C2Cl5 | data_[C2Cl5]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
C 2.5500 0.7000 0.3000
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [P6mm]
_cell_length_a [6.7824]
_cell_length_b [6.7824]
_cell_length_c [17.3079]
_cell_angle_alpha [90.0000]
_cell_an... |
agm002795363 | BIrTc2 | data_[Tc8B4Ir4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tc 1.9000 1.3500 0.7417
B 2.0400 0.8500 0.4100
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [5.0010]
_cell_length_b [5.0010]
_cell_length_c [10.7258]
_ce... |
agm002256070 | BMg4Pr | data_[Pr2Mg8B2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pr 1.1300 1.8500 1.0600
Mg 1.3100 1.5000 0.8600
B 2.0400 0.8500 0.4100
]
_symmetry_space_group_name_H-M [P6/mmm]
_cell_length_a [6.1087]
_cell_length_b [6.1087]
_cell_length_c [8.1338]
_ce... |
oqmd-9982596 | F6O2RbW2 | data_[Rb2W4O4F12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
W 2.3600 1.3500 0.7667
O 3.4400 0.6000 1.2600
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.2585]
_cell_length_b [3.7861]
... |
agm003424365 | Dy3NdTh2 | data_[Nd2Dy6Th4]
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
Th 1.3000 1.8000 1.0800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [10.1099]
_cell_length_b [3.5823]
_cell_length_c [10.7237]... |
agm002982506 | CdH2Pd2 | data_[Cd2H4Pd4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cd 1.6900 1.5500 1.0900
H 2.2000 0.2500 0.0000
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [5.9601]
_cell_length_b [5.9601]
_cell_length_c [3.4525]
_ce... |
agm005670853 | Ac10Hg3Tl3 | data_[Ac10Tl3Hg3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Tl 1.6200 1.9000 1.3325
Hg 2.0000 1.5000 1.2450
]
_symmetry_space_group_name_H-M [P-62m]
_cell_length_a [9.7286]
_cell_length_b [9.7286]
_cell_length_c [7.4410]
_... |
agm003545262 | AuPb3Pd3 | data_[Pd6Pb6Au2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pd 2.2000 1.4000 0.8462
Pb 2.3300 1.8000 1.1225
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [P6_3/m]
_cell_length_a [8.4062]
_cell_length_b [8.4062]
_cell_length_c [4.8920]
_... |
agm005600257 | Ho5Nd2Tb3 | data_[Tb12Nd8Ho20]
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
Ho 1.2300 1.7500 1.0410
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.6124]
_cell_length_b [16.0073]
_cell_length_c [9.3750]... |
agm002811288 | CaCo2W | data_[Ca4Co8W4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Co 1.8800 1.3500 0.7683
W 2.3600 1.3500 0.7667
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [6.9295]
_cell_length_b [6.9295]
_cell_length_c [5.9357]
_cel... |
agm005564867 | Tc2Tl2Tm5 | data_[Tm20Tl8Tc8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tm 1.2500 1.7500 1.0950
Tl 1.6200 1.9000 1.3325
Tc 1.9000 1.3500 0.7417
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [16.9778]
_cell_length_b [7.2937]
_cell_length_c [7.3890]
_... |
agm004154152 | CoFeRu2 | data_[Fe2Co2Ru4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Fe 1.8300 1.4000 0.8525
Co 1.8800 1.3500 0.7683
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.5502]
_cell_length_b [2.6359]
_cell_length_c [4.5795]
_ce... |
agm002818791 | Ba2CoRh | data_[Ba8Co4Rh4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Co 1.8800 1.3500 0.7683
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [8.3624]
_cell_length_b [8.3624]
_cell_length_c [6.7117]
_c... |
mp-1110772 | BiI6NaRb2 | data_[Rb8Na4Bi4I24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Na 0.9300 1.8000 1.1600
Bi 2.0200 1.6000 1.0350
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [12.4433]
_cell_length_b [12... |
agm004139131 | BeCrSr | data_[Sr4Be4Cr4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Be 1.5700 1.0500 0.5900
Cr 1.6600 1.4000 0.9400
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.7423]
_cell_length_b [6.7423]
_cell_length_c [6.7423]
_c... |
agm005529864 | Ga3Sc2 | data_[Sc8Ga12]
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
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.3402]
_cell_length_b [25.9473]
_cell_length_c [4.2743]
_cell_angle_alpha [90.0000]
_cell... |
oqmd-5905057 | B4CrZn | data_[Zn1Cr1B4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
Cr 1.6600 1.4000 0.9400
B 2.0400 0.8500 0.4100
]
_symmetry_space_group_name_H-M [P6/mmm]
_cell_length_a [2.9411]
_cell_length_b [2.9411]
_cell_length_c [6.8281]
_ce... |
agm004815187 | Ac4Hg2RuSe | data_[Ac4Hg2Ru1Se1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Hg 2.0000 1.5000 1.2450
Ru 2.2000 1.3000 0.6610
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.9961]
_cell_length_b [4.3... |
agm005744244 | CeI4La | data_[La1Ce1I4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Ce 1.1200 1.8500 1.0800
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.4919]
_cell_length_b [4.2841]
_cell_length_c [8.1335]
_cell... |
agm005177514 | Ac5ErPr2Sm | data_[Ac20Pr8Sm4Er4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Pr 1.1300 1.8500 1.0600
Sm 1.1700 1.8500 1.2290
Er 1.2400 1.7500 1.0300
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [8.5184]
_cell_length_b [... |
agm001012341 | CuSiY | data_[Y4Cu4Si4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Cu 1.9000 1.3500 0.8200
Si 1.9000 1.1000 0.5400
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.5545]
_cell_length_b [5.7026]
_cell_length_c [7.5689]
_ce... |
agm005690147 | FePd2Te6 | data_[Fe2Te12Pd4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Fe 1.8300 1.4000 0.8525
Te 2.1000 1.4000 1.2933
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.8361]
_cell_length_b [3.9712]
_cell_length_c [8.7509]
_... |
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