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:NOMAD_jj8yhZbM2ix9u7SKtH6G8qkntiYq | [
"Rh",
"Gd",
"W"
] | [
64,
64,
64,
64,
45,
45,
45,
45,
74,
74,
74,
74,
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,
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,
... | {
"a": 6.516702175140381,
"b": 6.516702175140381,
"c": 6.516702175140381,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | GdRhW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_539975 | [
"Ti",
"Er",
"W"
] | [
68,
68,
68,
68,
22,
22,
22,
22,
74,
74,
74,
74,
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,
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,
... | {
"a": 6.6122918128967285,
"b": 6.6122918128967285,
"c": 6.6122918128967285,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ErTiW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_SUqgFD_X4nwdg9YbVZmffEpYbeex | [
"Ba",
"W",
"Np"
] | [
56,
56,
56,
56,
93,
93,
93,
93,
74,
74,
74,
74,
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,
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,
... | {
"a": 7.0558977127075195,
"b": 7.0558977127075195,
"c": 7.0558977127075195,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BaNpW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540006 | [
"Si",
"Rb",
"W"
] | [
37,
37,
37,
37,
14,
14,
14,
14,
74,
74,
74,
74,
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,
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,
... | {
"a": 6.501086235046387,
"b": 6.501086235046387,
"c": 6.501086235046387,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbSiW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540017 | [
"Sb",
"W",
"Bi"
] | [
83,
83,
83,
83,
51,
51,
51,
51,
74,
74,
74,
74,
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,
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,
... | {
"a": 6.760735988616943,
"b": 6.760735988616943,
"c": 6.760735988616943,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BiSbW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540028 | [
"Zn",
"Sr",
"W"
] | [
38,
38,
38,
38,
30,
30,
30,
30,
74,
74,
74,
74,
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,
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,
... | {
"a": 6.649857997894287,
"b": 6.649857997894287,
"c": 6.649857997894287,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SrZnW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540045 | [
"Cu",
"Tm",
"W"
] | [
69,
69,
69,
69,
29,
29,
29,
29,
74,
74,
74,
74,
74,
74,
74,
74
] | 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,
... | {
"a": 6.444464206695557,
"b": 6.444464206695557,
"c": 6.444464206695557,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TmCuW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_MxpkO8BE7gGrXz5V5xItvrWkV1fj | [
"Zn",
"Er",
"W"
] | [
68,
68,
68,
68,
30,
30,
30,
30,
74,
74,
74,
74,
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,
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,
... | {
"a": 6.539607524871826,
"b": 6.539607524871826,
"c": 6.539607524871826,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ErZnW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540074 | [
"Nb",
"W",
"Au"
] | [
41,
41,
41,
41,
74,
74,
74,
74,
74,
74,
74,
74,
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
],
... | {
"a": 6.45552396774292,
"b": 6.45552396774292,
"c": 6.45552396774292,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NbW2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_LjwNtcEBlqm0Oxb1L6qyo1sW_ZOD | [
"Tb",
"Yb",
"W"
] | [
65,
65,
65,
65,
70,
70,
70,
70,
74,
74,
74,
74,
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,
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,
... | {
"a": 6.947203159332275,
"b": 6.947203159332275,
"c": 6.947203159332275,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TbYbW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540103 | [
"Cu",
"Rb",
"W"
] | [
37,
37,
37,
37,
29,
29,
29,
29,
74,
74,
74,
74,
74,
74,
74,
74
] | 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,
... | {
"a": 6.514820098876953,
"b": 6.514820098876953,
"c": 6.514820098876953,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbCuW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540115 | [
"Ge",
"Pd",
"W"
] | [
32,
32,
32,
32,
46,
46,
46,
46,
74,
74,
74,
74,
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,
0,
0
],
[
0,
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0.5
],
[
0.5,
0,
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],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 6.2749199867248535,
"b": 6.2749199867248535,
"c": 6.2749199867248535,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | GePdW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540128 | [
"As",
"Dy",
"W"
] | [
66,
66,
66,
66,
33,
33,
33,
33,
74,
74,
74,
74,
74,
74,
74,
74
] | 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
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[
0.5,
0.5,
0.5
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
... | {
"a": 6.551527976989746,
"b": 6.551527976989746,
"c": 6.551527976989746,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | DyAsW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_5yAb6Z-mzWQfduVs_bjli3-SH-Io | [
"As",
"Tm",
"W"
] | [
69,
69,
69,
69,
33,
33,
33,
33,
74,
74,
74,
74,
74,
74,
74,
74
] | 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,
... | {
"a": 6.522609233856201,
"b": 6.522609233856201,
"c": 6.522609233856201,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TmAsW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540161 | [
"Ho",
"W",
"Ac"
] | [
89,
89,
89,
89,
67,
67,
67,
67,
74,
74,
74,
74,
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,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
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],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 7.17164421081543,
"b": 7.17164421081543,
"c": 7.17164421081543,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | AcHoW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540178 | [
"Y",
"Ba",
"W"
] | [
56,
56,
56,
56,
39,
39,
39,
39,
74,
74,
74,
74,
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,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
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],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 7.249450206756592,
"b": 7.249450206756592,
"c": 7.249450206756592,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BaYW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_4UR1CJbIzkR-OYBMWL_A_KeY8JNN | [
"Yb",
"W",
"Pb"
] | [
70,
70,
70,
70,
82,
82,
82,
82,
74,
74,
74,
74,
74,
74,
74,
74
] | 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,
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[
0.5,
0.5,
0.5
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
... | {
"a": 6.771735668182373,
"b": 6.771735668182373,
"c": 6.771735668182373,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YbPbW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540214 | [
"Li",
"Ba",
"W"
] | [
56,
56,
56,
56,
3,
3,
3,
3,
74,
74,
74,
74,
74,
74,
74,
74
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
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[
0.5,
0.5,
0.5
],
[
0.5,
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[
0,
0,
0
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[
0,
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0.5
],
[
0.5,
0,
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],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 6.7275238037109375,
"b": 6.7275238037109375,
"c": 6.7275238037109375,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BaLiW2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_540228 | [
"Pd",
"Tb",
"W"
] | [
65,
65,
65,
65,
46,
46,
46,
46,
74,
74,
74,
74,
74,
74,
74,
74
] | 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,
... | {
"a": 6.562448024749756,
"b": 6.562448024749756,
"c": 6.562448024749756,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TbPdW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_m1UO0DXCJWoozBJqs3lF8scI96kj | [
"Fe",
"Nd",
"W"
] | [
60,
60,
60,
60,
26,
26,
26,
26,
74,
74,
74,
74,
74,
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tar:NOMAD_I14sx4ULnmN0sVyk__OyzBcJi928 | [
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} | 225 | CsVW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540279 | [
"Rh",
"Te",
"W"
] | [
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45,
45,
45,
74,
74,
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} | 225 | TeRhW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540295 | [
"Sn",
"W",
"Pu"
] | [
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94,
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50,
50,
50,
74,
74,
74,
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} | 225 | PuSnW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Eea-7hnrFu3QWQChmm9vMOnz6mwF | [
"Be",
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"W"
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74,
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74,
74,
74,
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} | 225 | RbBeW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540321 | [
"Y",
"W",
"Hg"
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39,
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39,
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80,
80,
80,
74,
74,
74,
74,
74,
74,
74,
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} | 225 | YHgW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540337 | [
"Sb",
"W",
"Re"
] | [
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75,
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75,
51,
51,
51,
51,
74,
74,
74,
74,
74,
74,
74,
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} | 225 | ReSbW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540353 | [
"K",
"Cu",
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19,
29,
29,
29,
29,
74,
74,
74,
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74,
74,
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} | 225 | KCuW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_wkWKfY_8eNbEJgV6q5_zntBGhZYW | [
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74,
74,
74,
74,
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} | 225 | TmBeW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540385 | [
"Li",
"Si",
"W"
] | [
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3,
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14,
14,
14,
14,
74,
74,
74,
74,
74,
74,
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74
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} | 225 | LiSiW2 | electrolyte_relevant | true | 4 | null | null | null | null | [
"li",
"electrolyte_candidate"
] | external_cif_tar |
tar:OQMD_540399 | [
"Sm",
"W",
"Hg"
] | [
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62,
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62,
80,
80,
80,
80,
74,
74,
74,
74,
74,
74,
74,
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"alpha": 90,
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} | 225 | SmHgW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540412 | [
"Gd",
"W",
"Np"
] | [
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93,
93,
93,
93,
74,
74,
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74,
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} | 225 | GdNpW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540425 | [
"K",
"La",
"W"
] | [
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19,
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19,
57,
57,
57,
57,
74,
74,
74,
74,
74,
74,
74,
74
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} | 225 | KLaW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540439 | [
"Mg",
"Hf",
"W"
] | [
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72,
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72,
12,
12,
12,
12,
74,
74,
74,
74,
74,
74,
74,
74
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"alpha": 90,
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} | 225 | HfMgW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540453 | [
"Eu",
"Lu",
"W"
] | [
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63,
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63,
71,
71,
71,
71,
74,
74,
74,
74,
74,
74,
74,
74
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | EuLuW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540466 | [
"Cu",
"Pd",
"W"
] | [
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29,
29,
29,
46,
46,
46,
46,
74,
74,
74,
74,
74,
74,
74,
74
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} | 225 | CuPdW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540484 | [
"Sr",
"W",
"Pa"
] | [
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38,
91,
91,
91,
91,
74,
74,
74,
74,
74,
74,
74,
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"alpha": 90,
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} | 225 | SrPaW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_WeoZgCR6nGDBzFFWMb-I-CM_MaUK | [
"Mn",
"Ag",
"W"
] | [
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25,
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25,
47,
47,
47,
47,
74,
74,
74,
74,
74,
74,
74,
74
] | 16 | 3 | [
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} | 225 | MnAgW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540509 | [
"W",
"Pt",
"Bi"
] | [
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83,
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83,
78,
78,
78,
78,
74,
74,
74,
74,
74,
74,
74,
74
] | 16 | 3 | [
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} | 225 | BiPtW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540523 | [
"Ni",
"Nb",
"W"
] | [
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41,
41,
41,
28,
28,
28,
28,
74,
74,
74,
74,
74,
74,
74,
74
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | NbNiW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540537 | [
"Ga",
"W",
"Np"
] | [
93,
93,
93,
93,
31,
31,
31,
31,
74,
74,
74,
74,
74,
74,
74,
74
] | 16 | 3 | [
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0,
0
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[
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"alpha": 90,
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} | 225 | NpGaW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_WL5b-z7AdmIupMRqoMi26de9goxY | [
"Nb",
"W",
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] | [
89,
89,
89,
89,
41,
41,
41,
41,
74,
74,
74,
74,
74,
74,
74,
74
] | 16 | 3 | [
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"alpha": 90,
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"gamma": 90
} | 225 | AcNbW2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540570 | [
"Re",
"Hg",
"Bi"
] | [
75,
75,
75,
75,
75,
75,
75,
75,
80,
80,
80,
80,
83,
83,
83,
83
] | 16 | 3 | [
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[
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[
0.75,
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | Re2HgBi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540602 | [
"Dy",
"Re",
"Os"
] | [
66,
66,
66,
66,
75,
75,
75,
75,
75,
75,
75,
75,
76,
76,
76,
76
] | 16 | 3 | [
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[
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | DyRe2Os | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540613 | [
"Eu",
"Yb",
"Re"
] | [
70,
70,
70,
70,
63,
63,
63,
63,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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0
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[
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[
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[
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... | {
"a": 6.890573978424072,
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"c": 6.890573978424072,
"alpha": 90,
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"gamma": 90
} | 225 | YbEuRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Dw5QrVJfuaWy9mv8a2qlSB5ay7kG | [
"K",
"Ga",
"Re"
] | [
19,
19,
19,
19,
31,
31,
31,
31,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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[
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[
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... | {
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"c": 6.484546184539795,
"alpha": 90,
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"gamma": 90
} | 225 | KGaRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540638 | [
"B",
"Co",
"Re"
] | [
27,
27,
27,
27,
75,
75,
75,
75,
75,
75,
75,
75,
5,
5,
5,
5
] | 16 | 3 | [
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0
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[
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[
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... | {
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"c": 5.70962381362915,
"alpha": 90,
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"gamma": 90
} | 225 | CoRe2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540653 | [
"Be",
"Re",
"Au"
] | [
4,
4,
4,
4,
75,
75,
75,
75,
75,
75,
75,
75,
79,
79,
79,
79
] | 16 | 3 | [
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[
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[
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... | {
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"c": 6.1007399559021,
"alpha": 90,
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"gamma": 90
} | 225 | BeRe2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540668 | [
"Ga",
"Ho",
"Re"
] | [
67,
67,
67,
67,
31,
31,
31,
31,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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0
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[
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[
0.25,
0.75,
0.75
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[
0.25,
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... | {
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"c": 6.467644214630127,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | HoGaRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540680 | [
"Mg",
"Ta",
"Re"
] | [
12,
12,
12,
12,
73,
73,
73,
73,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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[
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[
0.25,
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... | {
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"c": 6.342775821685791,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | MgTaRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540690 | [
"Ni",
"Re",
"Th"
] | [
90,
90,
90,
90,
75,
75,
75,
75,
75,
75,
75,
75,
28,
28,
28,
28
] | 16 | 3 | [
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0,
0
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[
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0.25
],
[
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... | {
"a": 6.470046043395996,
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"c": 6.470046043395996,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ThRe2Ni | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540701 | [
"La",
"Re",
"Th"
] | [
57,
57,
57,
57,
90,
90,
90,
90,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
[
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0
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[
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[
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[
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[
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[
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[
0.25,
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... | {
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"c": 7.145967960357666,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LaThRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540716 | [
"Nd",
"Tm",
"Re"
] | [
60,
60,
60,
60,
69,
69,
69,
69,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
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[
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[
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[
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[
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[
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[
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[
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[
0.25,
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... | {
"a": 6.91581392288208,
"b": 6.91581392288208,
"c": 6.91581392288208,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdTmRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540731 | [
"Sb",
"Tm",
"Re"
] | [
69,
69,
69,
69,
75,
75,
75,
75,
75,
75,
75,
75,
51,
51,
51,
51
] | 16 | 3 | [
[
0,
0,
0
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[
0,
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[
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[
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[
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[
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[
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[
0.25,
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[
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... | {
"a": 6.610891819000244,
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"c": 6.610891819000244,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TmRe2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540746 | [
"Be",
"B",
"Re"
] | [
4,
4,
4,
4,
75,
75,
75,
75,
75,
75,
75,
75,
5,
5,
5,
5
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
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0.5
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[
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[
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[
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[
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[
0.25,
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0.25
],
[
0.75,
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],
... | {
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"c": 5.566164016723633,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BeRe2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540761 | [
"In",
"Tm",
"Re"
] | [
69,
69,
69,
69,
49,
49,
49,
49,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
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[
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[
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[
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[
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[
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[
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],
[
0.25,
0.75,
0.75
],
[
0.25,
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... | {
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"c": 6.642347812652588,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TmInRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540776 | [
"Mn",
"Lu",
"Re"
] | [
71,
71,
71,
71,
25,
25,
25,
25,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
[
0,
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0
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[
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[
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[
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[
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[
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[
0.75,
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0.25
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[
0.25,
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... | {
"a": 6.311409950256348,
"b": 6.311409950256348,
"c": 6.311409950256348,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LuMnRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540795 | [
"Sr",
"Re",
"Ac"
] | [
38,
38,
38,
38,
89,
89,
89,
89,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
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[
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[
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[
0,
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[
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[
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[
0.5,
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0.5
],
[
0.25,
0.75,
0.75
],
[
0.25,
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... | {
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"b": 7.340089797973633,
"c": 7.340089797973633,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SrAcRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540806 | [
"B",
"Sn",
"Re"
] | [
75,
75,
75,
75,
75,
75,
75,
75,
50,
50,
50,
50,
5,
5,
5,
5
] | 16 | 3 | [
[
0.25,
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[
0.25,
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[
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[
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[
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[
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],
[
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],
[
0.75,
0.75,
0.75
],
[
0,
... | {
"a": 6.124730110168457,
"b": 6.124730110168457,
"c": 6.124730110168457,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Re2SnB | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540819 | [
"Eu",
"Er",
"Re"
] | [
63,
63,
63,
63,
68,
68,
68,
68,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
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0,
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],
[
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[
0,
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[
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[
0.5,
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[
0.5,
0.5,
0.5
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
... | {
"a": 6.860752105712891,
"b": 6.860752105712891,
"c": 6.860752105712891,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | EuErRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540833 | [
"Ca",
"Ni",
"Re"
] | [
20,
20,
20,
20,
75,
75,
75,
75,
75,
75,
75,
75,
28,
28,
28,
28
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} | 225 | CaRe2Ni | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540848 | [
"Gd",
"Re",
"Pb"
] | [
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64,
64,
64,
75,
75,
75,
75,
75,
75,
75,
75,
82,
82,
82,
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"alpha": 90,
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} | 225 | GdRe2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540861 | [
"Rh",
"Eu",
"Re"
] | [
63,
63,
63,
63,
75,
75,
75,
75,
75,
75,
75,
75,
45,
45,
45,
45
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | EuRe2Rh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540872 | [
"Si",
"Ga",
"Re"
] | [
31,
31,
31,
31,
75,
75,
75,
75,
75,
75,
75,
75,
14,
14,
14,
14
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | GaRe2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540885 | [
"Yb",
"Re",
"Bi"
] | [
70,
70,
70,
70,
75,
75,
75,
75,
75,
75,
75,
75,
83,
83,
83,
83
] | 16 | 3 | [
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... | {
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"c": 6.73827600479126,
"alpha": 90,
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} | 225 | YbRe2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540900 | [
"Mo",
"La",
"Re"
] | [
57,
57,
57,
57,
75,
75,
75,
75,
75,
75,
75,
75,
42,
42,
42,
42
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | LaRe2Mo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540912 | [
"Nb",
"Ag",
"Re"
] | [
41,
41,
41,
41,
75,
75,
75,
75,
75,
75,
75,
75,
47,
47,
47,
47
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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} | 225 | NbRe2Ag | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540926 | [
"Ho",
"Re",
"Au"
] | [
67,
67,
67,
67,
75,
75,
75,
75,
75,
75,
75,
75,
79,
79,
79,
79
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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} | 225 | HoRe2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_FZUnLXDXBXiXgbNmkKmlJEaGvBwg | [
"Na",
"Fe",
"Re"
] | [
11,
11,
11,
11,
26,
26,
26,
26,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | NaFeRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540956 | [
"Mg",
"Re",
"Th"
] | [
90,
90,
90,
90,
12,
12,
12,
12,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | ThMgRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540972 | [
"Eu",
"Re",
"Th"
] | [
63,
63,
63,
63,
90,
90,
90,
90,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | EuThRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_540989 | [
"Ga",
"Zr",
"Re"
] | [
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40,
40,
40,
31,
31,
31,
31,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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[
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... | {
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"c": 6.384059906005859,
"alpha": 90,
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"gamma": 90
} | 225 | ZrGaRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541007 | [
"Ti",
"Ga",
"Re"
] | [
22,
22,
22,
22,
31,
31,
31,
31,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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[
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... | {
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"c": 6.179535865783691,
"alpha": 90,
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"gamma": 90
} | 225 | TiGaRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541021 | [
"Ba",
"Re",
"Ac"
] | [
56,
56,
56,
56,
89,
89,
89,
89,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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[
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[
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... | {
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"c": 7.503645896911621,
"alpha": 90,
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"gamma": 90
} | 225 | BaAcRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_6YoDK4vSAkxZRHir4_7GtVCUrNhy | [
"Al",
"As",
"Re"
] | [
13,
13,
13,
13,
75,
75,
75,
75,
75,
75,
75,
75,
33,
33,
33,
33
] | 16 | 3 | [
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[
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[
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... | {
"a": 6.142633438110352,
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"alpha": 90,
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"gamma": 90
} | 225 | AlRe2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_pfNqllITVYlUJXSQi2egy8AY5qXV | [
"Ni",
"Ge",
"Re"
] | [
75,
75,
75,
75,
75,
75,
75,
75,
28,
28,
28,
28,
32,
32,
32,
32
] | 16 | 3 | [
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[
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[
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[
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... | {
"a": 5.947583198547363,
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"c": 5.947583198547363,
"alpha": 90,
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"gamma": 90
} | 225 | Re2NiGe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541077 | [
"Ga",
"Ru",
"Re"
] | [
31,
31,
31,
31,
75,
75,
75,
75,
75,
75,
75,
75,
44,
44,
44,
44
] | 16 | 3 | [
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[
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | GaRe2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541090 | [
"Cd",
"Re",
"Th"
] | [
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90,
90,
90,
48,
48,
48,
48,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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[
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[
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... | {
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"c": 6.763967990875244,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ThCdRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541105 | [
"Ca",
"Re",
"Th"
] | [
20,
20,
20,
20,
90,
90,
90,
90,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | CaThRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541121 | [
"Ge",
"Pr",
"Re"
] | [
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59,
59,
59,
75,
75,
75,
75,
75,
75,
75,
75,
32,
32,
32,
32
] | 16 | 3 | [
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0
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[
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | PrRe2Ge | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541135 | [
"Fe",
"Cd",
"Re"
] | [
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48,
48,
48,
26,
26,
26,
26,
75,
75,
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75,
75,
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} | 225 | CdFeRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541147 | [
"Li",
"B",
"Re"
] | [
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75,
75,
75,
75,
75,
75,
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"alpha": 90,
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} | 225 | LiRe2B | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_541163 | [
"Zn",
"Nd",
"Re"
] | [
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30,
30,
30,
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75,
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} | 225 | NdZnRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_By1rzBbbbsrYELfquTV_eaIsQvmP | [
"Al",
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75,
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75,
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} | 225 | AlRe2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541193 | [
"Fe",
"Te",
"Re"
] | [
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26,
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75,
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75,
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75,
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} | 225 | FeRe2Te | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541207 | [
"Be",
"Co",
"Re"
] | [
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4,
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4,
27,
27,
27,
27,
75,
75,
75,
75,
75,
75,
75,
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] | 16 | 3 | [
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"alpha": 90,
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} | 225 | BeCoRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541221 | [
"Ge",
"Re",
"Au"
] | [
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75,
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75,
75,
75,
75,
75,
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32,
32,
32,
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79,
79,
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] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | Re2GeAu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541236 | [
"Li",
"Fe",
"Re"
] | [
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3,
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3,
26,
26,
26,
26,
75,
75,
75,
75,
75,
75,
75,
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"alpha": 90,
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} | 225 | LiFeRe2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_541257 | [
"Ge",
"Re",
"Ir"
] | [
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75,
75,
75,
75,
75,
75,
75,
32,
32,
32,
32,
77,
77,
77,
77
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[
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... | {
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"alpha": 90,
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} | 225 | Re2GeIr | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541274 | [
"Mo",
"Tb",
"Re"
] | [
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65,
65,
65,
75,
75,
75,
75,
75,
75,
75,
75,
42,
42,
42,
42
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"alpha": 90,
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} | 225 | TbRe2Mo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541289 | [
"K",
"Eu",
"Re"
] | [
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19,
19,
19,
63,
63,
63,
63,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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} | 225 | KEuRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541305 | [
"Na",
"Er",
"Re"
] | [
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11,
11,
11,
68,
68,
68,
68,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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[
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"alpha": 90,
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} | 225 | NaErRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541321 | [
"In",
"Cs",
"Re"
] | [
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55,
55,
55,
49,
49,
49,
49,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | CsInRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541336 | [
"Y",
"Re",
"Au"
] | [
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39,
39,
39,
75,
75,
75,
75,
75,
75,
75,
75,
79,
79,
79,
79
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | YRe2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541350 | [
"Re",
"Os",
"Bi"
] | [
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75,
75,
75,
75,
75,
75,
75,
83,
83,
83,
83,
76,
76,
76,
76
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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} | 225 | Re2BiOs | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541363 | [
"Nd",
"Re",
"Ac"
] | [
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89,
89,
89,
60,
60,
60,
60,
75,
75,
75,
75,
75,
75,
75,
75
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | AcNdRe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541377 | [
"Cr",
"Sb",
"Re"
] | [
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24,
24,
24,
75,
75,
75,
75,
75,
75,
75,
75,
51,
51,
51,
51
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | CrRe2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541391 | [
"Cr",
"Ag",
"Re"
] | [
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24,
24,
24,
75,
75,
75,
75,
75,
75,
75,
75,
47,
47,
47,
47
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | CrRe2Ag | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541410 | [
"Na",
"Pd",
"Re"
] | [
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11,
11,
11,
75,
75,
75,
75,
75,
75,
75,
75,
46,
46,
46,
46
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | NaRe2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541423 | [
"Sb",
"Dy",
"Re"
] | [
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66,
66,
66,
75,
75,
75,
75,
75,
75,
75,
75,
51,
51,
51,
51
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | DyRe2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_541442 | [
"Eu",
"Re",
"Bi"
] | [
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63,
63,
63,
75,
75,
75,
75,
75,
75,
75,
75,
83,
83,
83,
83
] | 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
],
... | {
"a": 6.801214218139648,
"b": 6.801214218139648,
"c": 6.801214218139648,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | EuRe2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
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