mp_id
stringlengths
4
38
elements
listlengths
1
10
atomic_numbers
listlengths
1
200
num_atoms
int32
1
200
num_elements
int32
1
10
fractional_coords
listlengths
1
200
lattice
dict
spacegroup_number
int32
0
230
reduced_formula
stringlengths
1
24
tier
stringclasses
3 values
is_li_containing
bool
2 classes
num_li_atoms
int32
0
104
band_gap
float32
0
17.9
energy_above_hull
float32
0
9.71
formation_energy_per_atom
float32
-5.15
8.99
is_metal
bool
2 classes
source_tags
listlengths
1
5
source
stringclasses
4 values
tar:OQMD_362796
[ "Sc", "Co", "W" ]
[ 21, 21, 21, 21, 21, 21, 21, 21, 27, 27, 27, 27, 74, 74, 74, 74 ]
16
3
[ [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ] ]
{ "a": 6.486100196838379, "b": 6.486100196838379, "c": 6.486100196838379, "alpha": 90, "beta": 90, "gamma": 90 }
225
Sc2CoW
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362812
[ "Sc", "Y", "Ba" ]
[ 56, 56, 56, 56, 39, 39, 39, 39, 21, 21, 21, 21, 21, 21, 21, 21 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.8902058601379395, "b": 7.8902058601379395, "c": 7.8902058601379395, "alpha": 90, "beta": 90, "gamma": 90 }
225
BaYSc2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362822
[ "Sc", "Rb", "Th" ]
[ 37, 37, 37, 37, 90, 90, 90, 90, 21, 21, 21, 21, 21, 21, 21, 21 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 8.009245872497559, "b": 8.009245872497559, "c": 8.009245872497559, "alpha": 90, "beta": 90, "gamma": 90 }
225
RbThSc2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362837
[ "Sc", "Eu", "Pu" ]
[ 63, 63, 63, 63, 94, 94, 94, 94, 21, 21, 21, 21, 21, 21, 21, 21 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.648776054382324, "b": 7.648776054382324, "c": 7.648776054382324, "alpha": 90, "beta": 90, "gamma": 90 }
225
EuPuSc2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362850
[ "Sc", "Pr", "Hg" ]
[ 59, 59, 59, 59, 21, 21, 21, 21, 21, 21, 21, 21, 80, 80, 80, 80 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 7.236998081207275, "b": 7.236998081207275, "c": 7.236998081207275, "alpha": 90, "beta": 90, "gamma": 90 }
225
PrSc2Hg
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362864
[ "Sc", "V", "Yb" ]
[ 70, 70, 70, 70, 21, 21, 21, 21, 21, 21, 21, 21, 23, 23, 23, 23 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 7.080875873565674, "b": 7.080875873565674, "c": 7.080875873565674, "alpha": 90, "beta": 90, "gamma": 90 }
225
YbSc2V
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362879
[ "Sc", "Ta", "Os" ]
[ 21, 21, 21, 21, 21, 21, 21, 21, 73, 73, 73, 73, 76, 76, 76, 76 ]
16
3
[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 6.601675987243652, "b": 6.601675987243652, "c": 6.601675987243652, "alpha": 90, "beta": 90, "gamma": 90 }
225
Sc2TaOs
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362891
[ "Sc", "V", "Ir" ]
[ 21, 21, 21, 21, 21, 21, 21, 21, 23, 23, 23, 23, 77, 77, 77, 77 ]
16
3
[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 6.495396137237549, "b": 6.495396137237549, "c": 6.495396137237549, "alpha": 90, "beta": 90, "gamma": 90 }
225
Sc2VIr
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362906
[ "K", "Sc", "Os" ]
[ 19, 19, 19, 19, 21, 21, 21, 21, 21, 21, 21, 21, 76, 76, 76, 76 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ] ]
{ "a": 6.938218116760254, "b": 6.938218116760254, "c": 6.938218116760254, "alpha": 90, "beta": 90, "gamma": 90 }
225
KSc2Os
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362923
[ "Sc", "Ni", "Sr" ]
[ 38, 38, 38, 38, 21, 21, 21, 21, 21, 21, 21, 21, 28, 28, 28, 28 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 7.055853843688965, "b": 7.055853843688965, "c": 7.055853843688965, "alpha": 90, "beta": 90, "gamma": 90 }
225
SrSc2Ni
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362937
[ "Sc", "Ga", "Gd" ]
[ 64, 64, 64, 64, 21, 21, 21, 21, 21, 21, 21, 21, 31, 31, 31, 31 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 7.154451847076416, "b": 7.154451847076416, "c": 7.154451847076416, "alpha": 90, "beta": 90, "gamma": 90 }
225
GdSc2Ga
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362951
[ "Sc", "Ce", "Os" ]
[ 58, 58, 58, 58, 21, 21, 21, 21, 21, 21, 21, 21, 76, 76, 76, 76 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ] ]
{ "a": 6.931119918823242, "b": 6.931119918823242, "c": 6.931119918823242, "alpha": 90, "beta": 90, "gamma": 90 }
225
CeSc2Os
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362965
[ "Sc", "Sb", "La" ]
[ 57, 57, 57, 57, 21, 21, 21, 21, 21, 21, 21, 21, 51, 51, 51, 51 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ] ]
{ "a": 7.223092079162598, "b": 7.223092079162598, "c": 7.223092079162598, "alpha": 90, "beta": 90, "gamma": 90 }
225
LaSc2Sb
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_362983
[ "Sc", "W", "Au" ]
[ 21, 21, 21, 21, 21, 21, 21, 21, 74, 74, 74, 74, 79, 79, 79, 79 ]
16
3
[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 6.6199421882629395, "b": 6.6199421882629395, "c": 6.6199421882629395, "alpha": 90, "beta": 90, "gamma": 90 }
225
Sc2WAu
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363003
[ "Be", "Sc", "Ta" ]
[ 21, 21, 21, 21, 21, 21, 21, 21, 73, 73, 73, 73, 4, 4, 4, 4 ]
16
3
[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 6.671497821807861, "b": 6.671497821807861, "c": 6.671497821807861, "alpha": 90, "beta": 90, "gamma": 90 }
225
Sc2TaBe
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363019
[ "Sc", "Ag", "Sm" ]
[ 62, 62, 62, 62, 21, 21, 21, 21, 21, 21, 21, 21, 47, 47, 47, 47 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 7.145532131195068, "b": 7.145532131195068, "c": 7.145532131195068, "alpha": 90, "beta": 90, "gamma": 90 }
225
SmSc2Ag
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363035
[ "Sc", "Mn", "Co" ]
[ 21, 21, 21, 21, 21, 21, 21, 21, 25, 25, 25, 25, 27, 27, 27, 27 ]
16
3
[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 6.3303680419921875, "b": 6.3303680419921875, "c": 6.3303680419921875, "alpha": 90, "beta": 90, "gamma": 90 }
225
Sc2MnCo
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363051
[ "Sc", "Rb", "Pu" ]
[ 37, 37, 37, 37, 94, 94, 94, 94, 21, 21, 21, 21, 21, 21, 21, 21 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 7.933110237121582, "b": 7.933110237121582, "c": 7.933110237121582, "alpha": 90, "beta": 90, "gamma": 90 }
225
RbPuSc2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363068
[ "Li", "Sc", "La" ]
[ 3, 3, 3, 3, 57, 57, 57, 57, 21, 21, 21, 21, 21, 21, 21, 21 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 7.408227920532227, "b": 7.408227920532227, "c": 7.408227920532227, "alpha": 90, "beta": 90, "gamma": 90 }
225
LiLaSc2
general_inorganic
true
4
null
null
null
null
[ "li" ]
external_cif_tar
tar:OQMD_363081
[ "Al", "Sc", "Sm" ]
[ 62, 62, 62, 62, 21, 21, 21, 21, 21, 21, 21, 21, 13, 13, 13, 13 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 7.224646091461182, "b": 7.224646091461182, "c": 7.224646091461182, "alpha": 90, "beta": 90, "gamma": 90 }
225
SmSc2Al
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363093
[ "Be", "Sc", "Hf" ]
[ 72, 72, 72, 72, 21, 21, 21, 21, 21, 21, 21, 21, 4, 4, 4, 4 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 6.816959857940674, "b": 6.816959857940674, "c": 6.816959857940674, "alpha": 90, "beta": 90, "gamma": 90 }
225
HfSc2Be
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363108
[ "Sc", "Yb", "Np" ]
[ 70, 70, 70, 70, 93, 93, 93, 93, 21, 21, 21, 21, 21, 21, 21, 21 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 7.563881874084473, "b": 7.563881874084473, "c": 7.563881874084473, "alpha": 90, "beta": 90, "gamma": 90 }
225
YbNpSc2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363122
[ "Sc", "Ir", "U" ]
[ 21, 21, 21, 21, 21, 21, 21, 21, 92, 92, 92, 92, 77, 77, 77, 77 ]
16
3
[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 6.760451793670654, "b": 6.760451793670654, "c": 6.760451793670654, "alpha": 90, "beta": 90, "gamma": 90 }
225
Sc2UIr
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363137
[ "Sc", "Y", "Pa" ]
[ 39, 39, 39, 39, 21, 21, 21, 21, 21, 21, 21, 21, 91, 91, 91, 91 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 7.507108211517334, "b": 7.507108211517334, "c": 7.507108211517334, "alpha": 90, "beta": 90, "gamma": 90 }
225
YSc2Pa
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363153
[ "Sc", "Lu", "Ta" ]
[ 71, 71, 71, 71, 21, 21, 21, 21, 21, 21, 21, 21, 73, 73, 73, 73 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ] ]
{ "a": 7.051218032836914, "b": 7.051218032836914, "c": 7.051218032836914, "alpha": 90, "beta": 90, "gamma": 90 }
225
LuSc2Ta
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363172
[ "Sc", "Fe", "Sr" ]
[ 38, 38, 38, 38, 21, 21, 21, 21, 21, 21, 21, 21, 26, 26, 26, 26 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 7.013455867767334, "b": 7.013455867767334, "c": 7.013455867767334, "alpha": 90, "beta": 90, "gamma": 90 }
225
SrSc2Fe
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363188
[ "Sc", "Nb", "Ac" ]
[ 89, 89, 89, 89, 21, 21, 21, 21, 21, 21, 21, 21, 41, 41, 41, 41 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ] ]
{ "a": 7.302892208099365, "b": 7.302892208099365, "c": 7.302892208099365, "alpha": 90, "beta": 90, "gamma": 90 }
225
AcSc2Nb
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363203
[ "Nd", "Pt", "Tl" ]
[ 60, 60, 60, 60, 81, 81, 81, 81, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.93911600112915, "b": 6.93911600112915, "c": 6.93911600112915, "alpha": 90, "beta": 90, "gamma": 90 }
225
NdTlPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363219
[ "K", "Pd", "Pt" ]
[ 19, 19, 19, 19, 46, 46, 46, 46, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.679605960845947, "b": 6.679605960845947, "c": 6.679605960845947, "alpha": 90, "beta": 90, "gamma": 90 }
225
KPdPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363232
[ "Mg", "Ge", "Pt" ]
[ 12, 12, 12, 12, 32, 32, 32, 32, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.330009937286377, "b": 6.330009937286377, "c": 6.330009937286377, "alpha": 90, "beta": 90, "gamma": 90 }
225
MgGePt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363247
[ "Sb", "Er", "Pt" ]
[ 68, 68, 68, 68, 51, 51, 51, 51, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.785111904144287, "b": 6.785111904144287, "c": 6.785111904144287, "alpha": 90, "beta": 90, "gamma": 90 }
225
ErSbPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363262
[ "Ti", "Ni", "Pt" ]
[ 22, 22, 22, 22, 28, 28, 28, 28, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.130812168121338, "b": 6.130812168121338, "c": 6.130812168121338, "alpha": 90, "beta": 90, "gamma": 90 }
225
TiNiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363272
[ "Ti", "Mn", "Pt" ]
[ 22, 22, 22, 22, 25, 25, 25, 25, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.265972137451172, "b": 6.265972137451172, "c": 6.265972137451172, "alpha": 90, "beta": 90, "gamma": 90 }
225
TiMnPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363289
[ "Be", "Pt", "Tl" ]
[ 4, 4, 4, 4, 81, 81, 81, 81, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.33486795425415, "b": 6.33486795425415, "c": 6.33486795425415, "alpha": 90, "beta": 90, "gamma": 90 }
225
BeTlPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363307
[ "Mg", "Pt", "Pb" ]
[ 12, 12, 12, 12, 78, 78, 78, 78, 78, 78, 78, 78, 82, 82, 82, 82 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ] ]
{ "a": 6.605132102966309, "b": 6.605132102966309, "c": 6.605132102966309, "alpha": 90, "beta": 90, "gamma": 90 }
225
MgPt2Pb
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363316
[ "Co", "Ni", "Pt" ]
[ 27, 27, 27, 27, 28, 28, 28, 28, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 5.9371161460876465, "b": 5.9371161460876465, "c": 5.9371161460876465, "alpha": 90, "beta": 90, "gamma": 90 }
225
CoNiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_nZXHRLBmZ4OM1mWefhvyPQqQzAr8
[ "Ni", "Pt", "Th" ]
[ 90, 90, 90, 90, 28, 28, 28, 28, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.738429546356201, "b": 6.738429546356201, "c": 6.738429546356201, "alpha": 90, "beta": 90, "gamma": 90 }
225
ThNiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_CvfqlJUMgdzSK2SZ1g7Bzn-fSsDd
[ "Yb", "Pt", "Ac" ]
[ 89, 89, 89, 89, 70, 70, 70, 70, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.191097736358643, "b": 7.191097736358643, "c": 7.191097736358643, "alpha": 90, "beta": 90, "gamma": 90 }
225
AcYbPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_ZFpRFk-vXGhOs-UgUknsbD0JsRIN
[ "Na", "Dy", "Pt" ]
[ 11, 11, 11, 11, 66, 66, 66, 66, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.790069580078125, "b": 6.790069580078125, "c": 6.790069580078125, "alpha": 90, "beta": 90, "gamma": 90 }
225
NaDyPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_WcU0LCOO9gmA45K37J6-8MTI7v-X
[ "Dy", "Tm", "Pt" ]
[ 66, 66, 66, 66, 69, 69, 69, 69, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.885705471038818, "b": 6.885705471038818, "c": 6.885705471038818, "alpha": 90, "beta": 90, "gamma": 90 }
225
DyTmPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363403
[ "Dy", "Pt", "Th" ]
[ 66, 66, 66, 66, 90, 90, 90, 90, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.139041900634766, "b": 7.139041900634766, "c": 7.139041900634766, "alpha": 90, "beta": 90, "gamma": 90 }
225
DyThPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363420
[ "Ag", "Pt", "Pa" ]
[ 91, 91, 91, 91, 47, 47, 47, 47, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.78122615814209, "b": 6.78122615814209, "c": 6.78122615814209, "alpha": 90, "beta": 90, "gamma": 90 }
225
PaAgPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363434
[ "Sc", "Pt", "Bi" ]
[ 21, 21, 21, 21, 83, 83, 83, 83, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.7657999992370605, "b": 6.7657999992370605, "c": 6.7657999992370605, "alpha": 90, "beta": 90, "gamma": 90 }
225
ScBiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363447
[ "Al", "Pt", "Hg" ]
[ 13, 13, 13, 13, 80, 80, 80, 80, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.40039587020874, "b": 6.40039587020874, "c": 6.40039587020874, "alpha": 90, "beta": 90, "gamma": 90 }
225
AlHgPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363461
[ "Eu", "Pt", "Ac" ]
[ 89, 89, 89, 89, 63, 63, 63, 63, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.27099609375, "b": 7.27099609375, "c": 7.27099609375, "alpha": 90, "beta": 90, "gamma": 90 }
225
AcEuPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363475
[ "Ni", "Te", "Pt" ]
[ 28, 28, 28, 28, 52, 52, 52, 52, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.409073829650879, "b": 6.409073829650879, "c": 6.409073829650879, "alpha": 90, "beta": 90, "gamma": 90 }
225
NiTePt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_30jkOv364EAcXrqEeb67tZkwprBr
[ "Na", "Sm", "Pt" ]
[ 11, 11, 11, 11, 62, 62, 62, 62, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.893245220184326, "b": 6.893245220184326, "c": 6.893245220184326, "alpha": 90, "beta": 90, "gamma": 90 }
225
NaSmPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363506
[ "In", "Pt", "Ac" ]
[ 89, 89, 89, 89, 49, 49, 49, 49, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.109158039093018, "b": 7.109158039093018, "c": 7.109158039093018, "alpha": 90, "beta": 90, "gamma": 90 }
225
AcInPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_HqhIZ6fQeoqsyrA9TNviqXvOXHzP
[ "In", "Nd", "Pt" ]
[ 60, 60, 60, 60, 49, 49, 49, 49, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.900700092315674, "b": 6.900700092315674, "c": 6.900700092315674, "alpha": 90, "beta": 90, "gamma": 90 }
225
NdInPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363532
[ "Al", "Pt", "Bi" ]
[ 13, 13, 13, 13, 83, 83, 83, 83, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.636940002441406, "b": 6.636940002441406, "c": 6.636940002441406, "alpha": 90, "beta": 90, "gamma": 90 }
225
AlBiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_ENPgJs86Gu2asQfV7XlBjYPiPdQd
[ "Pt", "Au", "Ac" ]
[ 89, 89, 89, 89, 78, 78, 78, 78, 78, 78, 78, 78, 79, 79, 79, 79 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ] ]
{ "a": 6.907851696014404, "b": 6.907851696014404, "c": 6.907851696014404, "alpha": 90, "beta": 90, "gamma": 90 }
225
AcPt2Au
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363557
[ "Ti", "Pt", "Np" ]
[ 93, 93, 93, 93, 22, 22, 22, 22, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.6276021003723145, "b": 6.6276021003723145, "c": 6.6276021003723145, "alpha": 90, "beta": 90, "gamma": 90 }
225
NpTiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_YGpbjHKTLJLnsZddQ5CNi80Kz-wH
[ "Ho", "Pt", "Th" ]
[ 67, 67, 67, 67, 90, 90, 90, 90, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.128843307495117, "b": 7.128843307495117, "c": 7.128843307495117, "alpha": 90, "beta": 90, "gamma": 90 }
225
HoThPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363589
[ "Ba", "Tb", "Pt" ]
[ 56, 56, 56, 56, 65, 65, 65, 65, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.288422107696533, "b": 7.288422107696533, "c": 7.288422107696533, "alpha": 90, "beta": 90, "gamma": 90 }
225
BaTbPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363604
[ "Ba", "Ta", "Pt" ]
[ 56, 56, 56, 56, 73, 73, 73, 73, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.008312225341797, "b": 7.008312225341797, "c": 7.008312225341797, "alpha": 90, "beta": 90, "gamma": 90 }
225
BaTaPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363620
[ "La", "Pt", "Hg" ]
[ 57, 57, 57, 57, 80, 80, 80, 80, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.926405906677246, "b": 6.926405906677246, "c": 6.926405906677246, "alpha": 90, "beta": 90, "gamma": 90 }
225
LaHgPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363639
[ "Rh", "Sb", "Pt" ]
[ 51, 51, 51, 51, 78, 78, 78, 78, 78, 78, 78, 78, 45, 45, 45, 45 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 6.403679847717285, "b": 6.403679847717285, "c": 6.403679847717285, "alpha": 90, "beta": 90, "gamma": 90 }
225
SbPt2Rh
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_1NKeYTUF9QJKnx5mwCTvSOPpSAg5
[ "Na", "Yb", "Pt" ]
[ 11, 11, 11, 11, 70, 70, 70, 70, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.702847957611084, "b": 6.702847957611084, "c": 6.702847957611084, "alpha": 90, "beta": 90, "gamma": 90 }
225
NaYbPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363669
[ "Ca", "Te", "Pt" ]
[ 20, 20, 20, 20, 52, 52, 52, 52, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.838788032531738, "b": 6.838788032531738, "c": 6.838788032531738, "alpha": 90, "beta": 90, "gamma": 90 }
225
CaTePt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363684
[ "Mg", "Ag", "Pt" ]
[ 12, 12, 12, 12, 47, 47, 47, 47, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.359625816345215, "b": 6.359625816345215, "c": 6.359625816345215, "alpha": 90, "beta": 90, "gamma": 90 }
225
MgAgPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_2GMLROF01e4WECScNmUOIYAEDgc1
[ "Ce", "Pr", "Pt" ]
[ 58, 58, 58, 58, 59, 59, 59, 59, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.222517013549805, "b": 7.222517013549805, "c": 7.222517013549805, "alpha": 90, "beta": 90, "gamma": 90 }
225
CePrPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363730
[ "Si", "V", "Pt" ]
[ 23, 23, 23, 23, 14, 14, 14, 14, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.153163909912109, "b": 6.153163909912109, "c": 6.153163909912109, "alpha": 90, "beta": 90, "gamma": 90 }
225
VSiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363746
[ "Ag", "Yb", "Pt" ]
[ 70, 70, 70, 70, 47, 47, 47, 47, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.597166061401367, "b": 6.597166061401367, "c": 6.597166061401367, "alpha": 90, "beta": 90, "gamma": 90 }
225
YbAgPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363763
[ "Li", "Pt", "Au" ]
[ 3, 3, 3, 3, 78, 78, 78, 78, 78, 78, 78, 78, 79, 79, 79, 79 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 6.305376052856445, "b": 6.305376052856445, "c": 6.305376052856445, "alpha": 90, "beta": 90, "gamma": 90 }
225
LiPt2Au
general_inorganic
true
4
null
null
null
null
[ "li" ]
external_cif_tar
tar:OQMD_363777
[ "Mo", "Sm", "Pt" ]
[ 62, 62, 62, 62, 42, 42, 42, 42, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.711123943328857, "b": 6.711123943328857, "c": 6.711123943328857, "alpha": 90, "beta": 90, "gamma": 90 }
225
SmMoPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363790
[ "B", "Pt", "Pu" ]
[ 94, 94, 94, 94, 5, 5, 5, 5, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.473859786987305, "b": 6.473859786987305, "c": 6.473859786987305, "alpha": 90, "beta": 90, "gamma": 90 }
225
PuBPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363802
[ "Te", "Cs", "Pt" ]
[ 55, 55, 55, 55, 52, 52, 52, 52, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.298871994018555, "b": 7.298871994018555, "c": 7.298871994018555, "alpha": 90, "beta": 90, "gamma": 90 }
225
CsTePt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363813
[ "Fe", "Co", "Pt" ]
[ 26, 26, 26, 26, 27, 27, 27, 27, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 5.931064128875732, "b": 5.931064128875732, "c": 5.931064128875732, "alpha": 90, "beta": 90, "gamma": 90 }
225
FeCoPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363826
[ "Mn", "Tc", "Pt" ]
[ 25, 25, 25, 25, 43, 43, 43, 43, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.159485816955566, "b": 6.159485816955566, "c": 6.159485816955566, "alpha": 90, "beta": 90, "gamma": 90 }
225
MnTcPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363840
[ "Mg", "Fe", "Pt" ]
[ 12, 12, 12, 12, 26, 26, 26, 26, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.20348596572876, "b": 6.20348596572876, "c": 6.20348596572876, "alpha": 90, "beta": 90, "gamma": 90 }
225
MgFePt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363867
[ "Pr", "Pt", "Th" ]
[ 59, 59, 59, 59, 90, 90, 90, 90, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.233339786529541, "b": 7.233339786529541, "c": 7.233339786529541, "alpha": 90, "beta": 90, "gamma": 90 }
225
PrThPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363885
[ "V", "Pt", "Pa" ]
[ 91, 91, 91, 91, 23, 23, 23, 23, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.683187961578369, "b": 6.683187961578369, "c": 6.683187961578369, "alpha": 90, "beta": 90, "gamma": 90 }
225
PaVPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363904
[ "Cu", "As", "Pt" ]
[ 29, 29, 29, 29, 33, 33, 33, 33, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.223899841308594, "b": 6.223899841308594, "c": 6.223899841308594, "alpha": 90, "beta": 90, "gamma": 90 }
225
CuAsPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363917
[ "Be", "Ru", "Pt" ]
[ 4, 4, 4, 4, 44, 44, 44, 44, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.083295822143555, "b": 6.083295822143555, "c": 6.083295822143555, "alpha": 90, "beta": 90, "gamma": 90 }
225
BeRuPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_Ci59sMbvnzE0autinz6kUQ9VWl6R
[ "Ni", "Pt", "Pu" ]
[ 94, 94, 94, 94, 28, 28, 28, 28, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.4352192878723145, "b": 6.4352192878723145, "c": 6.4352192878723145, "alpha": 90, "beta": 90, "gamma": 90 }
225
PuNiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363951
[ "V", "Cu", "Pt" ]
[ 23, 23, 23, 23, 29, 29, 29, 29, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.097829818725586, "b": 6.097829818725586, "c": 6.097829818725586, "alpha": 90, "beta": 90, "gamma": 90 }
225
VCuPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363969
[ "Tb", "Pt", "Tl" ]
[ 65, 65, 65, 65, 81, 81, 81, 81, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.822984218597412, "b": 6.822984218597412, "c": 6.822984218597412, "alpha": 90, "beta": 90, "gamma": 90 }
225
TbTlPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_363985
[ "La", "Dy", "Pt" ]
[ 57, 57, 57, 57, 66, 66, 66, 66, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 7.100900173187256, "b": 7.100900173187256, "c": 7.100900173187256, "alpha": 90, "beta": 90, "gamma": 90 }
225
LaDyPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364004
[ "Tc", "Pt", "U" ]
[ 92, 92, 92, 92, 43, 43, 43, 43, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.584799766540527, "b": 6.584799766540527, "c": 6.584799766540527, "alpha": 90, "beta": 90, "gamma": 90 }
225
UTcPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364017
[ "Li", "Ca", "Pt" ]
[ 3, 3, 3, 3, 20, 20, 20, 20, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.542664051055908, "b": 6.542664051055908, "c": 6.542664051055908, "alpha": 90, "beta": 90, "gamma": 90 }
225
LiCaPt2
general_inorganic
true
4
null
null
null
null
[ "li" ]
external_cif_tar
tar:OQMD_364032
[ "Co", "Cs", "Pt" ]
[ 55, 55, 55, 55, 27, 27, 27, 27, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.848926067352295, "b": 6.848926067352295, "c": 6.848926067352295, "alpha": 90, "beta": 90, "gamma": 90 }
225
CsCoPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364048
[ "Na", "Pd", "Pt" ]
[ 11, 11, 11, 11, 46, 46, 46, 46, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.3752121925354, "b": 6.3752121925354, "c": 6.3752121925354, "alpha": 90, "beta": 90, "gamma": 90 }
225
NaPdPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_hq-FmbkW-TM99tWOzqQxwLRZB3j9
[ "Ti", "Pd", "Pt" ]
[ 22, 22, 22, 22, 46, 46, 46, 46, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.261319160461426, "b": 6.261319160461426, "c": 6.261319160461426, "alpha": 90, "beta": 90, "gamma": 90 }
225
TiPdPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364073
[ "K", "Y", "Pt" ]
[ 19, 19, 19, 19, 39, 39, 39, 39, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.097474098205566, "b": 7.097474098205566, "c": 7.097474098205566, "alpha": 90, "beta": 90, "gamma": 90 }
225
KYPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_DXUVm03-iqGKzEmEXI7RX7zqZEJh
[ "Na", "Ta", "Pt" ]
[ 11, 11, 11, 11, 73, 73, 73, 73, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.444358825683594, "b": 6.444358825683594, "c": 6.444358825683594, "alpha": 90, "beta": 90, "gamma": 90 }
225
NaTaPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364099
[ "Zr", "Pt", "Bi" ]
[ 40, 40, 40, 40, 83, 83, 83, 83, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.816711902618408, "b": 6.816711902618408, "c": 6.816711902618408, "alpha": 90, "beta": 90, "gamma": 90 }
225
ZrBiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_Jh6GivnUfWcWmN_JvCgSHuuoQs9L
[ "Li", "Pt", "U" ]
[ 3, 3, 3, 3, 92, 92, 92, 92, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.639505863189697, "b": 6.639505863189697, "c": 6.639505863189697, "alpha": 90, "beta": 90, "gamma": 90 }
225
LiUPt2
general_inorganic
true
4
null
null
null
null
[ "li" ]
external_cif_tar
tar:OQMD_364136
[ "Li", "Mo", "Pt" ]
[ 3, 3, 3, 3, 42, 42, 42, 42, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.21380615234375, "b": 6.21380615234375, "c": 6.21380615234375, "alpha": 90, "beta": 90, "gamma": 90 }
225
LiMoPt2
general_inorganic
true
4
null
null
null
null
[ "li" ]
external_cif_tar
tar:OQMD_364149
[ "Dy", "Pt", "Pu" ]
[ 66, 66, 66, 66, 94, 94, 94, 94, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.911128044128418, "b": 6.911128044128418, "c": 6.911128044128418, "alpha": 90, "beta": 90, "gamma": 90 }
225
DyPuPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_hQxVEQpYl7aUGMIf9hRKhdj1G_QV
[ "Pt", "Bi", "Np" ]
[ 93, 93, 93, 93, 83, 83, 83, 83, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.916419506072998, "b": 6.916419506072998, "c": 6.916419506072998, "alpha": 90, "beta": 90, "gamma": 90 }
225
NpBiPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364179
[ "Zr", "Hf", "Pt" ]
[ 72, 72, 72, 72, 40, 40, 40, 40, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.626138210296631, "b": 6.626138210296631, "c": 6.626138210296631, "alpha": 90, "beta": 90, "gamma": 90 }
225
HfZrPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364199
[ "Pm", "Dy", "Pt" ]
[ 61, 61, 61, 61, 66, 66, 66, 66, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 7.015880107879639, "b": 7.015880107879639, "c": 7.015880107879639, "alpha": 90, "beta": 90, "gamma": 90 }
225
PmDyPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_b-PD1v386ki--BOlHFKzE8XMy4WE
[ "Rb", "Pt", "Pb" ]
[ 37, 37, 37, 37, 78, 78, 78, 78, 78, 78, 78, 78, 82, 82, 82, 82 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]
{ "a": 7.193123817443848, "b": 7.193123817443848, "c": 7.193123817443848, "alpha": 90, "beta": 90, "gamma": 90 }
225
RbPt2Pb
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364225
[ "Pm", "Pt", "Tl" ]
[ 61, 61, 61, 61, 81, 81, 81, 81, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.906266212463379, "b": 6.906266212463379, "c": 6.906266212463379, "alpha": 90, "beta": 90, "gamma": 90 }
225
PmTlPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_MbEl5c4ZbWi92DIaFCraGiSVT6P6
[ "Cd", "Re", "Pt" ]
[ 48, 48, 48, 48, 75, 75, 75, 75, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 6.420588970184326, "b": 6.420588970184326, "c": 6.420588970184326, "alpha": 90, "beta": 90, "gamma": 90 }
225
CdRePt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_UKvUmkEhzOyIBqj5I06QtoihKUAK
[ "Rb", "Ag", "Pt" ]
[ 37, 37, 37, 37, 47, 47, 47, 47, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.927205562591553, "b": 6.927205562591553, "c": 6.927205562591553, "alpha": 90, "beta": 90, "gamma": 90 }
225
RbAgPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_YTEzUAiIISeFVuPHV2m0Vo2--Iag
[ "Ho", "W", "Pt" ]
[ 67, 67, 67, 67, 78, 78, 78, 78, 78, 78, 78, 78, 74, 74, 74, 74 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ] ]
{ "a": 6.597543716430664, "b": 6.597543716430664, "c": 6.597543716430664, "alpha": 90, "beta": 90, "gamma": 90 }
225
HoPt2W
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364275
[ "Cr", "Zn", "Pt" ]
[ 30, 30, 30, 30, 24, 24, 24, 24, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.179862022399902, "b": 6.179862022399902, "c": 6.179862022399902, "alpha": 90, "beta": 90, "gamma": 90 }
225
ZnCrPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:OQMD_364293
[ "Rb", "Sm", "Pt" ]
[ 37, 37, 37, 37, 62, 62, 62, 62, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0.5, 0.5, 0.5 ], [ 0.5, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.75, 0.75 ], [ 0.75, 0.75, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.75, 0.25, 0.25 ] ]
{ "a": 7.2735981941223145, "b": 7.2735981941223145, "c": 7.2735981941223145, "alpha": 90, "beta": 90, "gamma": 90 }
225
RbSmPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar
tar:NOMAD_VzAY-UpiuzQh7p6cDVUJRrVscReZ
[ "Tb", "Ir", "Pt" ]
[ 65, 65, 65, 65, 77, 77, 77, 77, 78, 78, 78, 78, 78, 78, 78, 78 ]
16
3
[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0, 0, 0.5 ], [ 0, 0.5, 0 ], [ 0.5, 0, 0 ], [ 0.5, 0.5, 0.5 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.75, 0.25, 0.75 ], [ 0.75, 0.75, 0.75 ] ]
{ "a": 6.565441608428955, "b": 6.565441608428955, "c": 6.565441608428955, "alpha": 90, "beta": 90, "gamma": 90 }
225
TbIrPt2
general_inorganic
false
null
null
null
null
null
null
external_cif_tar