Database stringlengths 6 13 | Reduced Formula stringlengths 1 23 | CIF stringlengths 760 15.5k |
|---|---|---|
agm003755282 | Dy4TmZn | data_[Dy16Tm4Zn4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Tm 1.2500 1.7500 1.0950
Zn 1.6500 1.3500 0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.7358]
_cell_length_b [13.4887]
_cell_length_c [6.1926]
_... |
agm005949729 | Rh4SmZn3 | data_[Sm3Zn9Rh12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sm 1.1700 1.8500 1.2290
Zn 1.6500 1.3500 0.8800
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.4241]
_cell_length_b [4.4241]
_cell_length_c [22.0988]
_... |
agm003131544 | OSr3Tl | data_[Sr48Tl16O16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Tl 1.6200 1.9000 1.3325
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Fd-3m]
_cell_length_a [14.0060]
_cell_length_b [14.0060]
_cell_length_c [14.0060... |
agm002657108 | CaMn2Sr | data_[Sr4Ca4Mn8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Ca 1.0000 1.8000 1.1400
Mn 1.5500 1.4000 0.6483
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [7.6226]
_cell_length_b [7.6226]
_cell_length_c [7.6226]
_c... |
oqmd-5682892 | HfRhSb | data_[Hf2Sb2Rh2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hf 1.3000 1.5500 0.8500
Sb 2.0500 1.4500 0.8300
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [4.6434]
_cell_length_b [4.6434]
_cell_length_c [5.9615]... |
agm001287214 | CaGaGePa | data_[Ca4Pa4Ga4Ge4]
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
Ga 1.8100 1.3000 0.7600
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.1601]
_cell_length_b [7.... |
agm001397881 | HfMnNbV | data_[Hf4Mn4Nb4V4]
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
Nb 1.6000 1.4500 0.8200
V 1.6300 1.3500 0.7775
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.3461]
_cell_length_b [6.34... |
mp-2713668 | Na2O12P3TaZn | data_[Na8Ta4Zn4P12O48]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Ta 1.5000 1.4500 0.8200
Zn 1.6500 1.3500 0.8800
P 2.1900 1.0000 0.5500
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a ... |
agm002221998 | Mn3Pm | data_[Pm4Mn12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Mn 1.5500 1.4000 0.6483
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [6.1644]
_cell_length_b [6.1644]
_cell_length_c [6.1644]
_cell_angle_alpha [90.0000]
_cell... |
agm001501022 | LiSnTa2Zn | data_[Li1Ta2Zn1Sn1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Ta 1.5000 1.4500 0.8200
Zn 1.6500 1.3500 0.8800
Sn 1.9600 1.4500 0.8300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.8036]
_cell_length_b [4... |
agm001298242 | AcCuHgPt | data_[Ac4Cu4Hg4Pt4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Cu 1.9000 1.3500 0.8200
Hg 2.0000 1.5000 1.2450
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.1735]
_cell_length_b [7.... |
agm001188342 | Ga4UZn | data_[U4Zn4Ga16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
U 1.3800 1.7500 0.9913
Zn 1.6500 1.3500 0.8800
Ga 1.8100 1.3000 0.7600
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.7123]
_cell_length_b [7.7123]
_cell_length_c [7.7123]
_ce... |
agm005160212 | MnPaRb2Te5 | data_[Rb8Pa4Mn4Te20]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Pa 1.5000 1.8000 1.0400
Mn 1.5500 1.4000 0.6483
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.5368]
_cell_length_b [... |
agm005888011 | Hg3NaTl3 | data_[Na4Tl12Hg12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Tl 1.6200 1.9000 1.3325
Hg 2.0000 1.5000 1.2450
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [10.5183]
_cell_length_b [11.1608]
_cell_length_c [7.0538]... |
agm006093531 | CeDy7Nd4 | data_[Ce2Nd8Dy14]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Nd 1.1400 1.8500 1.2765
Dy 1.2200 1.7500 1.1310
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.9364]
_cell_length_b [6.9855]
_cell_length_c [5.9967]
_... |
oqmd-6143357 | AuBi5Mn3 | data_[Mn3Bi5Au1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mn 1.5500 1.4000 0.6483
Bi 2.0200 1.6000 1.0350
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [P6/mmm]
_cell_length_a [5.4982]
_cell_length_b [5.4982]
_cell_length_c [8.3679]
_... |
agm004623989 | AlK3O6Y2 | data_[K6Y4Al2O12]
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
Al 1.6100 1.2500 0.6750
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.7668]
_cell_length_b [9.9923]
... |
agm003416897 | Ge3NbPr2 | data_[Pr4Nb2Ge6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pr 1.1300 1.8500 1.0600
Nb 1.6000 1.4500 0.8200
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.0909]
_cell_length_b [5.7937]
_cell_length_c [12.2953]
_c... |
agm006091663 | Cu4LaSi3 | data_[La1Cu4Si3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Cu 1.9000 1.3500 0.8200
Si 1.9000 1.1000 0.5400
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.1201]
_cell_length_b [4.1201]
_cell_length_c [7.5634]
_... |
agm004934605 | O6PdSr2Te | data_[Sr4Te2Pd2O12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Te 2.1000 1.4000 1.2933
Pd 2.2000 1.4000 0.8462
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.9500]
_cell_length_b [5.4... |
agm002419868 | BeCaK3 | data_[K3Ca1Be1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Ca 1.0000 1.8000 1.1400
Be 1.5700 1.0500 0.5900
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [6.4851]
_cell_length_b [6.4851]
_cell_length_c [6.4851]
_cel... |
agm004019763 | AuRhSr2 | data_[Sr6Rh3Au3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sr 0.9500 2.0000 1.3200
Rh 2.2800 1.3500 0.7450
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.5373]
_cell_length_b [4.5373]
_cell_length_c [23.1473]
_ce... |
agm005033034 | CePdSe3Sn | data_[Ce2Sn2Pd2Se6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Sn 1.9600 1.4500 0.8300
Pd 2.2000 1.4000 0.8462
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.5040]
_cell_length_b [4... |
agm003979833 | ClIn2Tl | data_[Tl2In4Cl2]
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
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [3.5984]
_cell_length_b [5.6347]
_cell_length_c [11.0920]
_c... |
agm003734480 | InScY4 | data_[Y8Sc2In2]
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
In 1.7800 1.5500 0.9400
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.3318]
_cell_length_b [6.6452]
_cell_length_c [8.5713]
_ce... |
agm003668140 | Er4Pd7Tl | data_[Er8Tl2Pd14]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Er 1.2400 1.7500 1.0300
Tl 1.6200 1.9000 1.3325
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.8335]
_cell_length_b [5.2108]
_cell_length_c [10.3383]
... |
agm002791224 | As2AuHg | data_[Hg4As8Au4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hg 2.0000 1.5000 1.2450
As 2.1800 1.1500 0.6600
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [5.6383]
_cell_length_b [5.6383]
_cell_length_c [13.4832]
_... |
agm2000028178 | F3Ir | data_[Ir2F6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ir 2.2000 1.3500 0.7650
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [Pma2]
_cell_length_a [5.5298]
_cell_length_b [19.0550]
_cell_length_c [4.4271]
_cell_angle_alpha [90.0000]
_cell_an... |
agm004130602 | AlLa2Mn | data_[La6Mn3Al3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Mn 1.5500 1.4000 0.6483
Al 1.6100 1.2500 0.6750
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.7207]
_cell_length_b [3.7207]
_cell_length_c [28.2124]
_c... |
agm003502200 | Cr2GeV6 | data_[V24Cr8Ge4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
V 1.6300 1.3500 0.7775
Cr 1.6600 1.4000 0.9400
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [7.6044]
_cell_length_b [7.9653]
_cell_length_c [8.1942]
_cel... |
agm002212909 | FeRu8 | data_[Fe2Ru16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Fe 1.8300 1.4000 0.8525
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [8.0761]
_cell_length_b [8.0761]
_cell_length_c [3.7970]
_cell_angle_alpha [90.0000]
_cel... |
agm004456154 | NiSc | data_[Sc8Ni8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [I-43m]
_cell_length_a [7.5294]
_cell_length_b [7.5294]
_cell_length_c [7.5294]
_cell_angle_alpha [90.0000]
_cell_... |
agm003000713 | Na2PbSr2 | data_[Na4Sr4Pb2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Sr 0.9500 2.0000 1.3200
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [8.1682]
_cell_length_b [8.1682]
_cell_length_c [5.5511]
_... |
agm003313953 | Au2Cu2Pd5 | data_[Cu4Pd10Au4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cu 1.9000 1.3500 0.8200
Pd 2.2000 1.4000 0.8462
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.7363]
_cell_length_b [3.9794]
_cell_length_c [6.2372]
_... |
mp-1077233 | AuSmSn | data_[Sm2Sn2Au2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sm 1.1700 1.8500 1.2290
Sn 1.9600 1.4500 0.8300
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [4.7364]
_cell_length_b [4.7364]
_cell_length_c [7.7381]... |
agm001917173 | LiNaNiTl | data_[Na4Li4Tl4Ni4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Li 0.9800 1.4500 0.9000
Tl 1.6200 1.9000 1.3325
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.5919]
_cell_length_b [6.... |
agm002272955 | Er2FeRh2 | data_[Er4Fe2Rh4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Er 1.2400 1.7500 1.0300
Fe 1.8300 1.4000 0.8525
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.0384]
_cell_length_b [5.7460]
_cell_length_c [8.3183]
_ce... |
agm001067632 | CeNTh | data_[Ce2Th2N2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Th 1.3000 1.8000 1.0800
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [3.5340]
_cell_length_b [5.1448]
_cell_length_c [7.2789]
_cell... |
agm005142496 | Li2MgPd5Pr2 | data_[Li4Pr4Mg2Pd10]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Pr 1.1300 1.8500 1.0600
Mg 1.3100 1.5000 0.8600
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.7878]
_cell_length_b [... |
agm005961351 | Dy5PmSm3 | data_[Pm4Sm12Dy20]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Sm 1.1700 1.8500 1.2290
Dy 1.2200 1.7500 1.1310
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [20.1758]
_cell_length_b [6.1143]
_cell_length_c [11.5271]... |
agm005103374 | AlOTi2 | data_[Ti6Al3O3]
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
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [2.9233]
_cell_length_b [2.9233]
_cell_length_c [21.2064]
_cell... |
agm002141085 | As4CaPt6 | data_[Ca1As4Pt6]
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
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [7.3599]
_cell_length_b [7.3599]
_cell_length_c [4.1784]
_c... |
oqmd-9758277 | As2B2HoNi2Y | data_[Y1Ho1Ni2B2As2]
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
Ni 1.9100 1.3500 0.7400
B 2.0400 0.8500 0.4100
As 2.1800 1.1500 0.6600
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a ... |
agm001369277 | CePdZnZr | data_[Ce4Zr4Zn4Pd4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Zr 1.3300 1.5500 0.8600
Zn 1.6500 1.3500 0.8800
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.9739]
_cell_length_b [6.... |
agm001821960 | Ac3Nb5O12 | data_[Ac24Nb40O96]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Nb 1.6000 1.4500 0.8200
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Ia-3d]
_cell_length_a [13.4792]
_cell_length_b [13.4792]
_cell_length_c [13.4792... |
agm002621633 | Ru3TlV | data_[Tl1V1Ru3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tl 1.6200 1.9000 1.3325
V 1.6300 1.3500 0.7775
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.9180]
_cell_length_b [4.9180]
_cell_length_c [4.9180]
_cel... |
agm003422423 | DyLa3Sn2 | data_[La6Dy2Sn4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Dy 1.2200 1.7500 1.1310
Sn 1.9600 1.4500 0.8300
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.4829]
_cell_length_b [5.9465]
_cell_length_c [18.9339]
_c... |
agm005731342 | Al2B10Mn | data_[Mn2Al4B20]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mn 1.5500 1.4000 0.6483
Al 1.6100 1.2500 0.6750
B 2.0400 0.8500 0.4100
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [5.7202]
_cell_length_b [11.3551]
_cell_length_c [4.1015]
_ce... |
agm005865419 | DySm8Tb2 | data_[Tb4Sm16Dy2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Sm 1.1700 1.8500 1.2290
Dy 1.2200 1.7500 1.1310
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [10.2923]
_cell_length_b [13.4790]
_cell_length_c [5.4681]
... |
agm005024847 | CdCsTe3Tm | data_[Cs2Tm2Cd2Te6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cs 0.7900 2.6000 1.8100
Tm 1.2500 1.7500 1.0950
Cd 1.6900 1.5500 1.0900
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [10.1303]
_cell_length_b [... |
agm004627545 | Ac6I3Pt2S | data_[Ac12Pt4S2I6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Pt 2.2800 1.3500 0.8050
S 2.5800 1.0000 0.8800
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8344]
_cell_length_b [13.526... |
agm003345264 | Er3Ho2Nd5 | data_[Nd20Ho8Er12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nd 1.1400 1.8500 1.2765
Ho 1.2300 1.7500 1.0410
Er 1.2400 1.7500 1.0300
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [12.2036]
_cell_length_b [17.2325]
_cell_length_c [6.4453]... |
agm005862056 | Hg2Mg4Pd | data_[Mg12Hg6Pd3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
Hg 2.0000 1.5000 1.2450
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.7024]
_cell_length_b [4.7024]
_cell_length_c [22.8930]
_... |
agm003819082 | ClCuFe2 | data_[Fe4Cu2Cl2]
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
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [2.8873]
_cell_length_b [3.9827]
_cell_length_c [11.1867]
_c... |
agm004229607 | BrC | data_[C2Br2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
C 2.5500 0.7000 0.3000
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [2.9887]
_cell_length_b [6.5774]
_cell_length_c [4.3455]
_cell_angle_alpha [90.0000]
_cell_ang... |
agm005156134 | Ba2SbSe5Te | data_[Ba8Sb4Te4Se20]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Sb 2.0500 1.4500 0.8300
Te 2.1000 1.4000 1.2933
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [5.0209]
_cell_length_b [... |
agm005199082 | AcPPmSe | data_[Ac3Pm3P3Se3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Pm 1.1300 1.8500 1.1100
P 2.1900 1.0000 0.5500
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.2156]
_cell_length_b [4.2156... |
agm003396588 | Er2Mg2Y | data_[Y2Er4Mg4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Er 1.2400 1.7500 1.0300
Mg 1.3100 1.5000 0.8600
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [8.9683]
_cell_length_b [8.9683]
_cell_length_c [3.5238]
_ce... |
agm003016104 | AgIn2Se2 | data_[In4Ag2Se4]
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
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [7.8921]
_cell_length_b [7.8921]
_cell_length_c [4.1345]
_... |
agm004362955 | Ag2BaMo | data_[Ba1Ag2Mo1]
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
Mo 2.1600 1.4500 0.7750
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.0525]
_cell_length_b [3.0525]
_cell_length_c [9.4876]
_ce... |
agm004980601 | CaMoN6P2 | data_[Ca4Mo4P8N24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Mo 2.1600 1.4500 0.7750
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 [10.0720]
_cell_length_b [10.31... |
agm004969831 | Ag2CdF6Ga | data_[Cd2Ga2Ag4F12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cd 1.6900 1.5500 1.0900
Ga 1.8100 1.3000 0.7600
Ag 1.9300 1.6000 1.0867
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.9178]
_cell_length_b [5.58... |
agm001127680 | HgNaSn2 | data_[Na1Sn2Hg1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Sn 1.9600 1.4500 0.8300
Hg 2.0000 1.5000 1.2450
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.9375]
_cell_length_b [3.9375]
_cell_length_c [6.9483]
_... |
agm002318525 | Ru2Si3Y3 | data_[Y6Si6Ru4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Si 1.9000 1.1000 0.5400
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.2515]
_cell_length_b [4.2833]
_cell_length_c [5.2727]
_cel... |
agm002075043 | CaCsH | data_[Cs1Ca1H1]
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
H 2.2000 0.2500 0.0000
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.9062]
_cell_length_b [4.3973]
_cell_length_c [6.9440]
_cell... |
agm005939495 | Ac2I8Rb | data_[Rb2Ac4I16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Ac 1.1000 1.9500 1.2600
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [10.3064]
_cell_length_b [16.0451]
_cell_length_c [6.4424]
_c... |
agm004417899 | AsRhTa2 | data_[Ta6As3Rh3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ta 1.5000 1.4500 0.8200
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 [2.9177]
_cell_length_b [2.9177]
_cell_length_c [26.9888]
_c... |
agm004611378 | Nd2S6SmTb3 | data_[Tb6Nd4Sm2S12]
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
Sm 1.1700 1.8500 1.2290
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.4086]
_cell_length_b [3.9... |
agm001515637 | K2NSiSn | data_[K2Si1Sn1N1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Si 1.9000 1.1000 0.5400
Sn 1.9600 1.4500 0.8300
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [6.4286]
_cell_length_b [6.428... |
agm004602619 | As2Se3Sm6Sn | data_[Sm12Sn2As4Se6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sm 1.1700 1.8500 1.2290
Sn 1.9600 1.4500 0.8300
As 2.1800 1.1500 0.6600
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.5234]
_cell_length_b [4... |
agm002934353 | As2NaW2 | data_[Na2As4W4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
As 2.1800 1.1500 0.6600
W 2.3600 1.3500 0.7667
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.7840]
_cell_length_b [3.7840]
_cell_length_c [14.9157]
_c... |
agm003744071 | NiPtSb4 | data_[Ni2Sb8Pt2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ni 1.9100 1.3500 0.7400
Sb 2.0500 1.4500 0.8300
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.4368]
_cell_length_b [6.4363]
_cell_length_c [6.4360]
_... |
agm2000095047 | AsBrSn2 | data_[Sn4As2Br2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sn 1.9600 1.4500 0.8300
As 2.1800 1.1500 0.6600
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [18.1886]
_cell_length_b [8.3999]
_cell_length_c [6.7008]
... |
oqmd-6237347 | AuLi8Pb2 | data_[Li24Pb6Au3]
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
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.5984]
_cell_length_b [4.5984]
_cell_length_c [30.7434]
_... |
agm004622733 | Bi6Er3Ho2Tb | data_[Tb2Ho4Er6Bi12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Ho 1.2300 1.7500 1.0410
Er 1.2400 1.7500 1.0300
Bi 2.0200 1.6000 1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.4142]
_cell_length_b [4... |
oqmd-4152351 | Br2W | data_[W2Br4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
W 2.3600 1.3500 0.7667
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [P4_2/mnm]
_cell_length_a [5.9960]
_cell_length_b [5.9960]
_cell_length_c [3.9136]
_cell_angle_alpha [90.0000]
_cell... |
agm002647272 | BBe2In | data_[Be8In4B4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Be 1.5700 1.0500 0.5900
In 1.7800 1.5500 0.9400
B 2.0400 0.8500 0.4100
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [5.8355]
_cell_length_b [5.8355]
_cell_length_c [5.8355]
_cel... |
agm005571649 | Ag2Tc2Tm7 | data_[Tm14Tc4Ag4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tm 1.2500 1.7500 1.0950
Tc 1.9000 1.3500 0.7417
Ag 1.9300 1.6000 1.0867
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [4.1183]
_cell_length_b [14.5387]
_cell_length_c [9.0685]
_... |
agm2000105659 | ClLi3Te | data_[Li6Te2Cl2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Te 2.1000 1.4000 1.2933
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [17.4438]
_cell_length_b [4.0425]
_cell_length_c [14.2785]
_... |
agm001527007 | HgPd2SiZn | data_[Zn1Si1Hg1Pd2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
Si 1.9000 1.1000 0.5400
Hg 2.0000 1.5000 1.2450
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.7507]
_cell_length_b [4... |
oqmd-3066518 | CuLiNiSi | data_[Li4Cu4Si4Ni4]
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
Si 1.9000 1.1000 0.5400
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [5.6204]
_cell_length_b [5.... |
agm004028221 | AlBrSb2 | data_[Al1Sb2Br1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Al 1.6100 1.2500 0.6750
Sb 2.0500 1.4500 0.8300
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [Pmmm]
_cell_length_a [3.3578]
_cell_length_b [5.4860]
_cell_length_c [5.6154]
_ce... |
agm001967164 | FeILa2 | data_[La6Fe3I3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Fe 1.8300 1.4000 0.8525
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.1112]
_cell_length_b [4.1112]
_cell_length_c [24.8887]
_cel... |
agm004929689 | CrCs2CuH6 | data_[Cs4Cr2Cu2H12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cs 0.7900 2.6000 1.8100
Cr 1.6600 1.4000 0.9400
Cu 1.9000 1.3500 0.8200
H 2.2000 0.2500 0.0000
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [5.2416]
_cell_length_b [5.... |
agm004984359 | H6HgNa2Pt | data_[Na8Hg4H24Pt4]
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
H 2.2000 0.2500 0.0000
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [7.9028]
_cell_length_b [7.9... |
oqmd-5896316 | CoRuSi3 | data_[Co2Si6Ru2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Co 1.8800 1.3500 0.7683
Si 1.9000 1.1000 0.5400
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [3.8179]
_cell_length_b [3.8179]
_cell_length_c [10.0517]
_c... |
agm004315156 | RuSiTc2 | data_[Si2Tc4Ru2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Si 1.9000 1.1000 0.5400
Tc 1.9000 1.3500 0.7417
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.6815]
_cell_length_b [3.6815]
_cell_length_c [8.1767]
_... |
agm005962283 | Ho3TbTm5 | data_[Tb4Ho12Tm20]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Ho 1.2300 1.7500 1.0410
Tm 1.2500 1.7500 1.0950
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.0609]
_cell_length_b [8.7005]
_cell_length_c [10.9349]... |
agm005697278 | Ag3Cl8Na3 | data_[Na9Ag9Cl24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Ag 1.9300 1.6000 1.0867
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.8708]
_cell_length_b [7.8708]
_cell_length_c [19.9891]
_... |
agm005425638 | BeSc | data_[Sc6Be6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sc 1.3600 1.6000 0.8850
Be 1.5700 1.0500 0.5900
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [3.7047]
_cell_length_b [9.4329]
_cell_length_c [5.6730]
_cell_angle_alpha [90.0000]
_cell_a... |
agm004540705 | Ba2DyI2O2 | data_[Ba4Dy2I4O4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Dy 1.2200 1.7500 1.1310
I 2.6600 1.4000 1.2733
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [4.5847]
_cell_length_b [4.584... |
agm002743299 | I2OsTc | data_[Tc4Os4I8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tc 1.9000 1.3500 0.7417
Os 2.2000 1.3000 0.6730
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [6.7533]
_cell_length_b [6.7533]
_cell_length_c [6.7533]
_cel... |
agm003637610 | HInMg2 | data_[Mg8In4H4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
In 1.7800 1.5500 0.9400
H 2.2000 0.2500 0.0000
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [6.2555]
_cell_length_b [5.3506]
_cell_length_c [8.7738]
_cell... |
agm005200162 | AcAsHoTe | data_[Ac3Ho3Te3As3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Ho 1.2300 1.7500 1.0410
Te 2.1000 1.4000 1.2933
As 2.1800 1.1500 0.6600
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.3062]
_cell_length_b [4.30... |
oqmd-9966981 | Ga2Pd2Tb | data_[Tb2Ga4Pd4]
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
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P4/nmm]
_cell_length_a [4.1419]
_cell_length_b [4.1419]
_cell_length_c [10.9230]
... |
agm006028738 | Si6Th3Zr | data_[Th18Zr6Si36]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Th 1.3000 1.8000 1.0800
Zr 1.3300 1.5500 0.8600
Si 1.9000 1.1000 0.5400
]
_symmetry_space_group_name_H-M [R-3c]
_cell_length_a [11.3957]
_cell_length_b [11.3957]
_cell_length_c [11.3271... |
agm004557426 | DyEr2Tb2Th2 | data_[Tb4Dy2Er4Th4]
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
Er 1.2400 1.7500 1.0300
Th 1.3000 1.8000 1.0800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.5149]
_cell_length_b [3.... |
agm003596135 | Dy4SmTm4 | data_[Sm2Dy8Tm8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sm 1.1700 1.8500 1.2290
Dy 1.2200 1.7500 1.1310
Tm 1.2500 1.7500 1.0950
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [10.5899]
_cell_length_b [10.5899]
_cell_length_c [4.9714]... |
agm004551040 | Ag2In2NdSm2 | data_[Nd3Sm6In6Ag6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nd 1.1400 1.8500 1.2765
Sm 1.1700 1.8500 1.2290
In 1.7800 1.5500 0.9400
Ag 1.9300 1.6000 1.0867
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.9102]
_cell_length_b [4.9... |
agm002412713 | BGeSb3 | data_[Ge1B1Sb3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ge 2.0100 1.2500 0.7700
B 2.0400 0.8500 0.4100
Sb 2.0500 1.4500 0.8300
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [5.3390]
_cell_length_b [5.3390]
_cell_length_c [5.3390]
_cel... |
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