Database stringlengths 6 13 | Reduced Formula stringlengths 1 23 | CIF stringlengths 760 15.5k |
|---|---|---|
agm002054673 | BrClTe | data_[Te2Br2Cl2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Te 2.1000 1.4000 1.2933
Br 2.9600 1.1500 0.8825
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [5.3089]
_cell_length_b [3.7851]
_cell_length_c [10.5891]
_c... |
agm004012033 | FeSiW2 | data_[Fe2Si2W4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Fe 1.8300 1.4000 0.8525
Si 1.9000 1.1000 0.5400
W 2.3600 1.3500 0.7667
]
_symmetry_space_group_name_H-M [Cmm2]
_cell_length_a [3.2465]
_cell_length_b [4.3540]
_cell_length_c [7.9838]
_cell... |
agm001722662 | HIN2Pb | data_[H1Pb1I1N2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
H 2.2000 0.2500 0.0000
Pb 2.3300 1.8000 1.1225
I 2.6600 1.4000 1.2733
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.2376]
_cell_length_b [5.2376]... |
agm006050438 | Ho4PmPr15 | data_[Pm1Pr15Ho4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Pr 1.1300 1.8500 1.0600
Ho 1.2300 1.7500 1.0410
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.2027]
_cell_length_b [5.2027]
_cell_length_c [25.8882]... |
agm005797392 | BiLi3Tl2 | data_[Li6Tl4Bi2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Tl 1.6200 1.9000 1.3325
Bi 2.0200 1.6000 1.0350
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [4.9950]
_cell_length_b [4.9950]
_cell_length_c [12.4384]
_... |
agm004077947 | BeIrPt2 | data_[Be1Ir1Pt2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Be 1.5700 1.0500 0.5900
Ir 2.2000 1.3500 0.7650
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [Pmmm]
_cell_length_a [2.7475]
_cell_length_b [3.7510]
_cell_length_c [5.4312]
_ce... |
agm003663378 | PrSc4Tm6 | data_[Pr1Tm6Sc4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pr 1.1300 1.8500 1.0600
Tm 1.2500 1.7500 1.0950
Sc 1.3600 1.6000 0.8850
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [8.6580]
_cell_length_b [8.6580]
_cell_length_c [5.1949]
_c... |
agm004368930 | KNi | data_[K2Ni2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Ni 1.9100 1.3500 0.7400
]
_symmetry_space_group_name_H-M [P4/nmm]
_cell_length_a [3.3395]
_cell_length_b [3.3395]
_cell_length_c [9.7288]
_cell_angle_alpha [90.0000]
_cell_a... |
agm002273410 | FeRbSr2 | data_[Rb4Sr8Fe4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Sr 0.9500 2.0000 1.3200
Fe 1.8300 1.4000 0.8525
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [8.6423]
_cell_length_b [8.6423]
_cell_length_c [8.6423]
_c... |
agm004784190 | LaN4Nd2Tc | data_[La4Nd8Tc4N16]
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
Tc 1.9000 1.3500 0.7417
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.5605]
_cell_length_b [12.1... |
agm001760941 | BiGaOP2 | data_[Ga1Bi1P2O1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ga 1.8100 1.3000 0.7600
Bi 2.0200 1.6000 1.0350
P 2.1900 1.0000 0.5500
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.3338]
_cell_length_b [5.333... |
agm002490352 | HSe3Zn | data_[Zn1H1Se3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zn 1.6500 1.3500 0.8800
H 2.2000 0.2500 0.0000
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.9662]
_cell_length_b [4.9662]
_cell_length_c [4.9662]
_cel... |
agm001939313 | CdEr2Gd | data_[Gd3Er6Cd3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Gd 1.2000 1.8000 1.0750
Er 1.2400 1.7500 1.0300
Cd 1.6900 1.5500 1.0900
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.5440]
_cell_length_b [3.5440]
_cell_length_c [32.2747]
_c... |
agm003724117 | DyPm3Ru | data_[Pm12Dy4Ru4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Dy 1.2200 1.7500 1.1310
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [8.7699]
_cell_length_b [9.4439]
_cell_length_c [7.5156]
_c... |
agm004971619 | Cu2O6RhSb | data_[Cu6Sb3Rh3O18]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cu 1.9000 1.3500 0.8200
Sb 2.0500 1.4500 0.8300
Rh 2.2800 1.3500 0.7450
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [5.2323]
_cell_length_b [5.2323... |
agm005437945 | CdLaW4 | data_[La4Cd4W16]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Cd 1.6900 1.5500 1.0900
W 2.3600 1.3500 0.7667
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.8437]
_cell_length_b [7.8437]
_cell_length_c [7.8437]
_ce... |
agm001075324 | AuCu4Hf2 | data_[Hf4Cu8Au2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hf 1.3000 1.5500 0.8500
Cu 1.9000 1.3500 0.8200
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [4.6711]
_cell_length_b [4.6711]
_cell_length_c [13.1059]
... |
agm004583750 | Pr2Rb2S6Sn | data_[Rb4Pr4Sn2S12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Pr 1.1300 1.8500 1.0600
Sn 1.9600 1.4500 0.8300
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1428]
_cell_length_b [12.2... |
oqmd-9031407 | C3Rh2 | data_[Rh16C24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rh 2.2800 1.3500 0.7450
C 2.5500 0.7000 0.3000
]
_symmetry_space_group_name_H-M [I-43d]
_cell_length_a [7.7857]
_cell_length_b [7.7857]
_cell_length_c [7.7857]
_cell_angle_alpha [90.0000]
_cell_... |
agm005927528 | Dy12Er3Zr | data_[Dy12Er3Zr1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Er 1.2400 1.7500 1.0300
Zr 1.3300 1.5500 0.8600
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.9695]
_cell_length_b [4.9695]
_cell_length_c [19.8014]... |
oqmd-3329525 | Au2HgTl | data_[Tl4Hg4Au8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tl 1.6200 1.9000 1.3325
Hg 2.0000 1.5000 1.2450
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.0048]
_cell_length_b [7.0048]
_cell_length_c [7.0048]
_c... |
agm004977622 | La2Nd6TmY | data_[La8Nd24Y4Tm4]
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
Y 1.2200 1.8000 1.0400
Tm 1.2500 1.7500 1.0950
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.2009]
_cell_length_b [15.3... |
agm001132509 | MgTb2Te | data_[Tb2Mg1Te1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Tb 1.1000 1.7500 0.9815
Mg 1.3100 1.5000 0.8600
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.9334]
_cell_length_b [3.9334]
_cell_length_c [6.9562]
_... |
agm001280894 | ErTl3 | data_[Er2Tl6]
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
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [4.6376]
_cell_length_b [4.6376]
_cell_length_c [10.1415]
_cell_angle_alpha [90.0000]
_cel... |
agm002856633 | BiIMo2 | data_[Bi4Mo8I4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Bi 2.0200 1.6000 1.0350
Mo 2.1600 1.4500 0.7750
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [6.4003]
_cell_length_b [6.4003]
_cell_length_c [11.7091]
_ce... |
agm001223154 | LaSc2Sn | data_[La1Sc2Sn1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Sc 1.3600 1.6000 0.8850
Sn 1.9600 1.4500 0.8300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.7616]
_cell_length_b [4.7616]
_cell_length_c [4.5904]
_... |
agm005632173 | LaScTl | data_[La2Sc2Tl2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Sc 1.3600 1.6000 0.8850
Tl 1.6200 1.9000 1.3325
]
_symmetry_space_group_name_H-M [P4/nmm]
_cell_length_a [4.7295]
_cell_length_b [4.7295]
_cell_length_c [8.0328]
_... |
agm005470124 | Cl2Re | data_[Re2Cl4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Re 1.9000 1.3500 0.7125
Cl 3.1600 1.0000 0.7800
]
_symmetry_space_group_name_H-M [Pnnm]
_cell_length_a [5.8659]
_cell_length_b [5.9327]
_cell_length_c [3.1242]
_cell_angle_alpha [90.0000]
_cell_a... |
agm001171703 | CaDyGd4 | data_[Ca4Gd16Dy4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Gd 1.2000 1.8000 1.0750
Dy 1.2200 1.7500 1.1310
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [9.4352]
_cell_length_b [9.4352]
_cell_length_c [9.4352]
_... |
agm001762975 | OOsP2Ta | data_[Ta1P2Os1O1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ta 1.5000 1.4500 0.8200
P 2.1900 1.0000 0.5500
Os 2.2000 1.3000 0.6730
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.8012]
_cell_length_b [4.801... |
agm004480137 | BBaBr6Rb2 | data_[Rb8Ba4B4Br24]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Ba 0.8900 2.1500 1.4900
B 2.0400 0.8500 0.4100
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [11.2874]
_cell_length_b [11... |
oqmd-2571776 | CrMoPbY | data_[Y4Cr4Mo4Pb4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Cr 1.6600 1.4000 0.9400
Mo 2.1600 1.4500 0.7750
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.9094]
_cell_length_b [6.90... |
agm003339750 | Bi4Ca3Zn2 | data_[Ca6Zn4Bi8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Zn 1.6500 1.3500 0.8800
Bi 2.0200 1.6000 1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.8153]
_cell_length_b [4.4501]
_cell_length_c [9.8631]
_c... |
oqmd-4105495 | Ag2In2Pr | data_[Pr2In4Ag4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pr 1.1300 1.8500 1.0600
In 1.7800 1.5500 0.9400
Ag 1.9300 1.6000 1.0867
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [4.4381]
_cell_length_b [4.4381]
_cell_length_c [12.3241]
... |
oqmd-2195709 | CrFe2Sb | data_[Cr4Fe8Sb4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cr 1.6600 1.4000 0.9400
Fe 1.8300 1.4000 0.8525
Sb 2.0500 1.4500 0.8300
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.0179]
_cell_length_b [6.0179]
_cell_length_c [6.0179]
_c... |
agm003727688 | ErGaTb3 | data_[Tb12Er4Ga4]
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
Ga 1.8100 1.3000 0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.8210]
_cell_length_b [8.9199]
_cell_length_c [7.6920]
_... |
oqmd-3046914 | SiTcTi | data_[Ti4Si4Tc4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ti 1.5400 1.4000 0.8517
Si 1.9000 1.1000 0.5400
Tc 1.9000 1.3500 0.7417
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [5.8027]
_cell_length_b [5.8027]
_cell_length_c [5.8027]
_c... |
agm001849466 | HgPdPu | data_[Pu2Hg2Pd2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pu 1.2800 1.7500 0.9675
Hg 2.0000 1.5000 1.2450
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [3.4558]
_cell_length_b [3.4558]
_cell_length_c [11.0551]
_c... |
agm003815917 | As2LaTc | data_[La1Tc1As2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Tc 1.9000 1.3500 0.7417
As 2.1800 1.1500 0.6600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.0601]
_cell_length_b [4.2614]
_cell_length_c [5.2002]
_ce... |
agm001248560 | AlIr2Pd | data_[Al1Ir2Pd1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Al 1.6100 1.2500 0.6750
Ir 2.2000 1.3500 0.7650
Pd 2.2000 1.4000 0.8462
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.9096]
_cell_length_b [3.9096]
_cell_length_c [3.7886]
_... |
agm001919621 | LiMnPrSm | data_[Li4Pr4Sm4Mn4]
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
Sm 1.1700 1.8500 1.2290
Mn 1.5500 1.4000 0.6483
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.3578]
_cell_length_b [7.... |
oqmd-2966979 | BeBiInOs | data_[Be4In4Bi4Os4]
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
Bi 2.0200 1.6000 1.0350
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.6690]
_cell_length_b [6.... |
agm001248963 | Hg2NbZr | data_[Zr1Nb1Hg2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zr 1.3300 1.5500 0.8600
Nb 1.6000 1.4500 0.8200
Hg 2.0000 1.5000 1.2450
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.3668]
_cell_length_b [4.3668]
_cell_length_c [4.2727]
_... |
agm004831084 | ErPr2S4Th | data_[Pr2Er1Th1S4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pr 1.1300 1.8500 1.0600
Er 1.2400 1.7500 1.0300
Th 1.3000 1.8000 1.0800
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.9921]
_cell_length_b [3.997... |
agm003523138 | As2Br8Rb | data_[Rb1As2Br8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
As 2.1800 1.1500 0.6600
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [8.0042]
_cell_length_b [8.0042]
_cell_length_c [10.6039]
_... |
agm005024292 | HoNd3PrY | data_[Pr4Nd12Y4Ho4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pr 1.1300 1.8500 1.0600
Nd 1.1400 1.8500 1.2765
Y 1.2200 1.8000 1.0400
Ho 1.2300 1.7500 1.0410
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [20.7586]
_cell_length_b [5.8... |
agm004068928 | BeReTe2 | data_[Be2Re2Te4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Be 1.5700 1.0500 0.5900
Re 1.9000 1.3500 0.7125
Te 2.1000 1.4000 1.2933
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [6.1324]
_cell_length_b [7.2232]
_cell_length_c [3.3542]
_ce... |
agm003978437 | Ca2KSc | data_[K2Ca4Sc2]
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
Sc 1.3600 1.6000 0.8850
]
_symmetry_space_group_name_H-M [Cmm2]
_cell_length_a [4.1168]
_cell_length_b [5.9733]
_cell_length_c [12.9111]
_cel... |
agm003490153 | Au6Hf2Zn | data_[Hf4Zn2Au12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hf 1.3000 1.5500 0.8500
Zn 1.6500 1.3500 0.8800
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [7.4965]
_cell_length_b [13.9947]
_cell_length_c [3.2870]
_... |
agm005010924 | HgHo2OY | data_[Y1Ho2Hg1O1]
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
Hg 2.0000 1.5000 1.2450
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.7367]
_cell_length_b [4.736... |
agm003503119 | CaGa6Li2 | data_[Li4Ca2Ga12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Ca 1.0000 1.8000 1.1400
Ga 1.8100 1.3000 0.7600
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.6811]
_cell_length_b [7.4401]
_cell_length_c [12.5904]
_... |
agm001242370 | CeSi2Sn | data_[Ce1Si2Sn1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ce 1.1200 1.8500 1.0800
Si 1.9000 1.1000 0.5400
Sn 1.9600 1.4500 0.8300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.4758]
_cell_length_b [4.4758]
_cell_length_c [4.1316]
_... |
agm004509873 | Ac2AgGe4Mg3 | data_[Ac2Mg3Ag1Ge4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ac 1.1000 1.9500 1.2600
Mg 1.3100 1.5000 0.8600
Ag 1.9300 1.6000 1.0867
Ge 2.0100 1.2500 0.7700
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.6280]
_cell_length_b [4.... |
mp-2712669 | CaNa2O24P4S2Sn3 | data_[Na6Ca3Sn9P12S6O72]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Ca 1.0000 1.8000 1.1400
Sn 1.9600 1.4500 0.8300
P 2.1900 1.0000 0.5500
S 2.5800 1.0000 0.8800
O 3.4400 0.6000 1.2600
]
_symmetry_space_group... |
agm002136537 | AsU | data_[U4As4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
U 1.3800 1.7500 0.9913
As 2.1800 1.1500 0.6600
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [3.9983]
_cell_length_b [3.9983]
_cell_length_c [14.1986]
_cell_angle_alpha [90.0000]
_cel... |
agm002585523 | HfMo3S | data_[Hf1Mo3S1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hf 1.3000 1.5500 0.8500
Mo 2.1600 1.4500 0.7750
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.8197]
_cell_length_b [4.8197]
_cell_length_c [4.8197]
_cel... |
agm002844784 | AgLiOs2 | data_[Li4Ag4Os8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Ag 1.9300 1.6000 1.0867
Os 2.2000 1.3000 0.6730
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [3.6328]
_cell_length_b [3.6328]
_cell_length_c [19.5941]
_... |
agm005484741 | AlRe4Ru | data_[Al4Re16Ru4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Al 1.6100 1.2500 0.6750
Re 1.9000 1.3500 0.7125
Ru 2.2000 1.3000 0.6610
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.2649]
_cell_length_b [7.2649]
_cell_length_c [7.2649]
_... |
agm003740707 | Hg4LiTb | data_[Li1Tb1Hg4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
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 [4.6889]
_cell_length_b [4.6889]
_cell_length_c [7.1236]
_... |
oqmd-5925415 | GdK3P2 | data_[K12Gd4P8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Gd 1.2000 1.8000 1.0750
P 2.1900 1.0000 0.5500
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [7.8312]
_cell_length_b [15.0472]
_cell_length_c [7.1951]
_cell... |
agm002427182 | BrSb3Y | data_[Y1Sb3Br1]
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
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [5.7827]
_cell_length_b [5.7827]
_cell_length_c [5.7827]
_cel... |
agm002840356 | BaI2Tl | data_[Ba4Tl4I8]
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
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [I-42d]
_cell_length_a [6.1962]
_cell_length_b [6.1962]
_cell_length_c [21.5445]
_ce... |
agm004972900 | NaO6PtSe2 | data_[Na3Pt3Se6O18]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Pt 2.2800 1.3500 0.8050
Se 2.5500 1.1500 1.0133
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [5.2656]
_cell_length_b [5.265... |
agm2000142801 | Br6NdU | data_[Nd1U1Br6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nd 1.1400 1.8500 1.2765
U 1.3800 1.7500 0.9913
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [P312]
_cell_length_a [7.5734]
_cell_length_b [7.5734]
_cell_length_c [18.3384]
_cel... |
agm001038228 | CNiTc | data_[Tc6Ni6C6]
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
C 2.5500 0.7000 0.3000
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [2.9320]
_cell_length_b [2.9320]
_cell_length_c [25.7539]
_cel... |
agm005193730 | AgHoLaY | data_[La1Y1Ho1Ag1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Y 1.2200 1.8000 1.0400
Ho 1.2300 1.7500 1.0410
Ag 1.9300 1.6000 1.0867
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.6521]
_cell_length_b [3.652... |
agm005150989 | O5Pb2RhV | data_[V4Rh4Pb8O20]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
V 1.6300 1.3500 0.7775
Rh 2.2800 1.3500 0.7450
Pb 2.3300 1.8000 1.1225
O 3.4400 0.6000 1.2600
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.2806]
_cell_length_b [15.4... |
agm001977344 | Gd2SmTm | data_[Sm3Gd6Tm3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Sm 1.1700 1.8500 1.2290
Gd 1.2000 1.8000 1.0750
Tm 1.2500 1.7500 1.0950
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.5692]
_cell_length_b [3.5692]
_cell_length_c [34.9344]
_c... |
agm004030155 | AgMgW2 | data_[Mg2Ag2W4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mg 1.3100 1.5000 0.8600
Ag 1.9300 1.6000 1.0867
W 2.3600 1.3500 0.7667
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.3506]
_cell_length_b [2.6995]
_cell_length_c [5.4037]
_cell_a... |
agm003981191 | Be2KSc | data_[K4Sc4Be8]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Sc 1.3600 1.6000 0.8850
Be 1.5700 1.0500 0.5900
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.5964]
_cell_length_b [6.5964]
_cell_length_c [6.5964]
_cel... |
agm001723217 | IMnN2Rb | data_[Rb1Mn1I1N2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Mn 1.5500 1.4000 0.6483
I 2.6600 1.4000 1.2733
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.1153]
_cell_length_b [4.115... |
agm003955965 | KMgRe2 | data_[K2Mg2Re4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
K 0.8200 2.2000 1.5200
Mg 1.3100 1.5000 0.8600
Re 1.9000 1.3500 0.7125
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.8228]
_cell_length_b [3.8228]
_cell_length_c [10.2249]
_c... |
agm001982057 | LiPm2Zr | data_[Li3Pm6Zr3]
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
Zr 1.3300 1.5500 0.8600
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [3.4310]
_cell_length_b [3.4310]
_cell_length_c [33.4612]
_c... |
agm001253667 | In12Sn5Tl3 | data_[Tl24In96Sn40]
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
Sn 1.9600 1.4500 0.8300
]
_symmetry_space_group_name_H-M [Ia-3d]
_cell_length_a [17.5006]
_cell_length_b [17.5006]
_cell_length_c [17.50... |
agm004243311 | BaLaPb2 | data_[Ba4La4Pb8]
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
Pb 2.3300 1.8000 1.1225
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [8.2371]
_cell_length_b [8.2371]
_cell_length_c [8.2371]
_c... |
agm003336775 | La4Pm3Y2 | data_[La4Pm3Y2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
La 1.1000 1.9500 1.1720
Pm 1.1300 1.8500 1.1100
Y 1.2200 1.8000 1.0400
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [3.6583]
_cell_length_b [3.6583]
_cell_length_c [27.4730]
_cel... |
agm001732747 | AlN2SeTl | data_[Al1Tl1Se1N2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Al 1.6100 1.2500 0.6750
Tl 1.6200 1.9000 1.3325
Se 2.5500 1.1500 1.0133
N 3.0400 0.6500 0.6300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.8493]
_cell_length_b [3.8... |
agm1000016159 | CaSe | data_[Ca3Se3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ca 1.0000 1.8000 1.1400
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [17.6341]
_cell_length_b [4.4832]
_cell_length_c [17.6341]
_cell_angle_alpha [90.0000]
_cell_a... |
agm003945616 | CaMoSe2 | data_[Ca3Mo3Se6]
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
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.0174]
_cell_length_b [4.0174]
_cell_length_c [18.5469]
_c... |
agm003625268 | HSZr2 | data_[Zr4H2S2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Zr 1.3300 1.5500 0.8600
H 2.2000 0.2500 0.0000
S 2.5800 1.0000 0.8800
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [3.6092]
_cell_length_b [9.3206]
_cell_length_c [3.6763]
_cell... |
mp-1110569 | F6InNa3 | data_[Na12In4F24]
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
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [8.5695]
_cell_length_b [8.5695]
_cell_length_c [8.5695]
_c... |
agm006025088 | HfSc6Zr8 | data_[Hf1Zr8Sc6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hf 1.3000 1.5500 0.8500
Zr 1.3300 1.5500 0.8600
Sc 1.3600 1.6000 0.8850
]
_symmetry_space_group_name_H-M [P-3]
_cell_length_a [8.5202]
_cell_length_b [8.5202]
_cell_length_c [5.6863]
_cel... |
agm001384150 | IrPmPrTl | data_[Pm4Pr4Tl4Ir4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Pr 1.1300 1.8500 1.0600
Tl 1.6200 1.9000 1.3325
Ir 2.2000 1.3500 0.7650
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [7.4454]
_cell_length_b [7.... |
agm006050811 | HoTb4Y6 | data_[Tb16Y24Ho4]
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
Ho 1.2300 1.7500 1.0410
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [5.7102]
_cell_length_b [9.6638]
_cell_length_c [25.7306]
_c... |
agm003742408 | RhTe4Ti | data_[Ti1Te4Rh1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ti 1.5400 1.4000 0.8517
Te 2.1000 1.4000 1.2933
Rh 2.2800 1.3500 0.7450
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.1984]
_cell_length_b [3.7792]
_cell_length_c [7.2354]
_ce... |
agm004927754 | CrF6Rb2Tl | data_[Rb4Tl2Cr2F12]
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
Cr 1.6600 1.4000 0.9400
F 3.9800 0.5000 0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.4609]
_cell_length_b [6.... |
oqmd-2843089 | NaOsPt | data_[Na4Os4Pt4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Na 0.9300 1.8000 1.1600
Os 2.2000 1.3000 0.6730
Pt 2.2800 1.3500 0.8050
]
_symmetry_space_group_name_H-M [F-43m]
_cell_length_a [6.0667]
_cell_length_b [6.0667]
_cell_length_c [6.0667]
_c... |
agm004004842 | CdRuW2 | data_[Cd2Ru2W4]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Cd 1.6900 1.5500 1.0900
Ru 2.2000 1.3000 0.6610
W 2.3600 1.3500 0.7667
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.5064]
_cell_length_b [2.8689]
_cell_length_c [4.9700]
_cell_a... |
agm002554119 | Br3HfNi | data_[Hf1Ni1Br3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Hf 1.3000 1.5500 0.8500
Ni 1.9100 1.3500 0.7400
Br 2.9600 1.1500 0.8825
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.8460]
_cell_length_b [4.8460]
_cell_length_c [4.8460]
_c... |
agm002911001 | Au2BCo2 | data_[Co4B2Au4]
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
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.6701]
_cell_length_b [3.6701]
_cell_length_c [12.1812]
_c... |
agm001615524 | CLiNiY2 | data_[Li1Y2Ni1C1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Li 0.9800 1.4500 0.9000
Y 1.2200 1.8000 1.0400
Ni 1.9100 1.3500 0.7400
C 2.5500 0.7000 0.3000
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.0159]
_cell_length_b [5.015... |
agm006127206 | As6Dy5Pm | data_[Pm2Dy10As12]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Pm 1.1300 1.8500 1.1100
Dy 1.2200 1.7500 1.1310
As 2.1800 1.1500 0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1701]
_cell_length_b [12.4173]
_cell_length_c [7.1690]
... |
agm002531492 | Au3MoPd | data_[Mo1Pd1Au3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Mo 2.1600 1.4500 0.7750
Pd 2.2000 1.4000 0.8462
Au 2.5400 1.3500 1.0700
]
_symmetry_space_group_name_H-M [Pm-3m]
_cell_length_a [4.9889]
_cell_length_b [4.9889]
_cell_length_c [4.9889]
_c... |
agm003691602 | AuIn12Li6 | data_[Li18In36Au3]
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 [R-3]
_cell_length_a [10.6094]
_cell_length_b [10.6094]
_cell_length_c [13.0511]... |
agm005778885 | Cu3NbZn2 | data_[Nb1Zn2Cu3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Nb 1.6000 1.4500 0.8200
Zn 1.6500 1.3500 0.8800
Cu 1.9000 1.3500 0.8200
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [2.8516]
_cell_length_b [2.8516]
_cell_length_c [10.1558]
... |
agm004270546 | SbYZr2 | data_[Y2Zr4Sb2]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Y 1.2200 1.8000 1.0400
Zr 1.3300 1.5500 0.8600
Sb 2.0500 1.4500 0.8300
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [4.6349]
_cell_length_b [3.8472]
_cell_length_c [11.4303]
_cel... |
agm004113178 | Ba2BeFe | data_[Ba6Be3Fe3]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Ba 0.8900 2.1500 1.4900
Be 1.5700 1.0500 0.5900
Fe 1.8300 1.4000 0.8525
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.3786]
_cell_length_b [4.3786]
_cell_length_c [25.8192]
_c... |
agm001799515 | ILiRbTe2 | data_[Rb1Li1Te2I1]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Rb 0.8200 2.3500 1.6600
Li 0.9800 1.4500 0.9000
Te 2.1000 1.4000 1.2933
I 2.6600 1.4000 1.2733
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.1066]
_cell_length_b [5.1... |
agm003615691 | DySe2Y | data_[Dy3Y3Se6]
loop_
_atom_type_symbol
_atom_type_electronegativity
_atom_type_radius
_atom_type_ionic_radius
[
Dy 1.2200 1.7500 1.1310
Y 1.2200 1.8000 1.0400
Se 2.5500 1.1500 1.0133
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.0939]
_cell_length_b [4.0939]
_cell_length_c [19.8830]
_cel... |
agm005656278 | Ho2NdSb3 | data_[Nd2Ho4Sb6]
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
Sb 2.0500 1.4500 0.8300
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.4220]
_cell_length_b [6.2570]
_cell_length_c [13.2581]
_c... |
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