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_386093 | [
"Sc",
"La",
"Au"
] | [
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57,
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21,
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] | {
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | La2ScAu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386111 | [
"Fe",
"La",
"Ta"
] | [
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57,
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73,
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] | 16 | 3 | [
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] | {
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"c": 7.182521820068359,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | La2TaFe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_1eAKOZk4uiQuztXlDBYpXY7f_hS9 | [
"Si",
"La",
"Sm"
] | [
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57,
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57,
57,
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57,
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62,
62,
62,
14,
14,
14,
14
] | 16 | 3 | [
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] | {
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"c": 7.716563701629639,
"alpha": 90,
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"gamma": 90
} | 225 | La2SmSi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386139 | [
"Cu",
"Ag",
"La"
] | [
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57,
57,
57,
57,
57,
57,
57,
29,
29,
29,
29,
47,
47,
47,
47
] | 16 | 3 | [
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] | {
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"c": 7.420663833618164,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | La2CuAg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386150 | [
"V",
"Pd",
"La"
] | [
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57,
57,
57,
57,
57,
57,
57,
23,
23,
23,
23,
46,
46,
46,
46
] | 16 | 3 | [
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] | {
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"b": 7.337862014770508,
"c": 7.337862014770508,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | La2VPd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386162 | [
"Ni",
"Nb",
"La"
] | [
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57,
57,
57,
57,
57,
57,
57,
41,
41,
41,
41,
28,
28,
28,
28
] | 16 | 3 | [
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] | {
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"b": 7.2578301429748535,
"c": 7.2578301429748535,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | La2NbNi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_ABeHbXOZazYApbGA3P82fna3zXop | [
"Li",
"La",
"Th"
] | [
3,
3,
3,
3,
57,
57,
57,
57,
57,
57,
57,
57,
90,
90,
90,
90
] | 16 | 3 | [
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] | {
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"b": 8.008153915405273,
"c": 8.008153915405273,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LiLa2Th | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_386189 | [
"Cu",
"La",
"Np"
] | [
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57,
57,
57,
57,
57,
57,
57,
93,
93,
93,
93,
29,
29,
29,
29
] | 16 | 3 | [
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] | {
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"b": 7.3146162033081055,
"c": 7.3146162033081055,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | La2NpCu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_mJ8Ml6RckNZL7LYzKkvBNvc-M7Bh | [
"Cr",
"Sr",
"Pb"
] | [
38,
38,
38,
38,
24,
24,
24,
24,
24,
24,
24,
24,
82,
82,
82,
82
] | 16 | 3 | [
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] | {
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"c": 6.8738226890563965,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SrCr2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386221 | [
"Cr",
"Zn",
"Pb"
] | [
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30,
30,
30,
24,
24,
24,
24,
24,
24,
24,
24,
82,
82,
82,
82
] | 16 | 3 | [
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] | {
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ZnCr2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386234 | [
"Mg",
"V",
"Cr"
] | [
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12,
12,
12,
23,
23,
23,
23,
24,
24,
24,
24,
24,
24,
24,
24
] | 16 | 3 | [
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] | {
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | MgVCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386253 | [
"Cr",
"Ce",
"Pu"
] | [
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58,
58,
58,
94,
94,
94,
94,
24,
24,
24,
24,
24,
24,
24,
24
] | 16 | 3 | [
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] | {
"a": 6.6906561851501465,
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"c": 6.6906561851501465,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CePuCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_J7i5QpksMfB4kDKUc9lkFaJGeJ2c | [
"Cr",
"Cs",
"Ce"
] | [
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55,
55,
55,
58,
58,
58,
58,
24,
24,
24,
24,
24,
24,
24,
24
] | 16 | 3 | [
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] | {
"a": 8.00302505493164,
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CsCeCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386286 | [
"Cr",
"Nb",
"Tl"
] | [
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41,
41,
41,
81,
81,
81,
81,
24,
24,
24,
24,
24,
24,
24,
24
] | 16 | 3 | [
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] | {
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NbTlCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386300 | [
"Mg",
"Cr",
"Te"
] | [
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12,
12,
12,
24,
24,
24,
24,
24,
24,
24,
24,
52,
52,
52,
52
] | 16 | 3 | [
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tar:OQMD_386316 | [
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tar:OQMD_386357 | [
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tar:OQMD_386374 | [
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tar:OQMD_386404 | [
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tar:NOMAD_fvaen2OVIwCcPz23GeOoouplMcor | [
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tar:NOMAD_0vVQiIceoOV-pv5pnCCSQWh_rqA4 | [
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tar:NOMAD_Rzgb-DV0gqltuOqCytITxSzTpQ9x | [
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tar:OQMD_386465 | [
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tar:OQMD_386480 | [
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tar:OQMD_386494 | [
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tar:OQMD_386508 | [
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tar:NOMAD_uxAodsYpCa-93wvs0klAywqFJyrp | [
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} | 225 | SrCr2Pt | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386534 | [
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tar:NOMAD_zlEYxWKsWm1phge5J0gLGVMhSzq4 | [
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tar:OQMD_386560 | [
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} | 225 | NpTiCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386572 | [
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} | 225 | PmCr2Ag | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386593 | [
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39,
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24,
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tar:NOMAD_FW0YSBAV6IN3uHFyWV0uEHLbnwD1 | [
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} | 225 | EuThCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386629 | [
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24,
24,
24,
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} | 225 | HfCr2Co | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386646 | [
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24,
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tar:NOMAD_V6zMuSN_iJTesAu1qDT2auaso8Fh | [
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24,
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24,
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74,
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} | 225 | LuCr2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386677 | [
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20,
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20,
20,
24,
24,
24,
24,
24,
24,
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24
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} | 225 | RbCaCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386692 | [
"Cr",
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24,
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24,
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83,
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} | 225 | Cr2BiPd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_MKYlu7ZDbcNPJxzVz0Q0_YXDCGW- | [
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62,
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24,
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24,
24,
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24,
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} | 225 | LaSmCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386723 | [
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24,
24,
24,
24,
24,
24,
24,
24,
33,
33,
33,
33
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} | 225 | LiCr2As | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_386737 | [
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24,
24,
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24,
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26,
26,
26,
80,
80,
80,
80
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} | 225 | Cr2FeHg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_axhqzTt90pQZJCrjtvIfNIy0MqSJ | [
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19,
81,
81,
81,
81,
24,
24,
24,
24,
24,
24,
24,
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} | 225 | KTlCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386770 | [
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tar:OQMD_386787 | [
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tar:OQMD_386805 | [
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tar:NOMAD_ZSmuvuJQhzxuc9kzFMM0dwmjm_oZ | [
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tar:NOMAD_lJMTW6GrHVpg2uVN_OCdVjndn18e | [
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tar:NOMAD_jn3EdmHiZwlxm9qwmPqXFU_ufLzA | [
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} | 225 | NdVCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386859 | [
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} | 225 | Cr2GeAu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386875 | [
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} | 225 | LiCr2Fe | general_inorganic | true | 4 | null | null | null | null | [
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] | external_cif_tar |
tar:OQMD_386888 | [
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} | 225 | HoErCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386917 | [
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} | 225 | Cr2BRh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386932 | [
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} | 225 | TlCr2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386948 | [
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} | 225 | VCr2Cu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_luqoAuDTfuJVwXfNvoKDnN3tunnJ | [
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} | 225 | TmCr2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_vpM-e6P0HsK0c2MvCWdP8NUqj0DH | [
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24,
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} | 225 | LuVCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_386992 | [
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} | 225 | HfCr2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387007 | [
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} | 225 | UCr2In | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387017 | [
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"alpha": 90,
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} | 225 | DyHfCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387036 | [
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"Ni",
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} | 225 | Cr2NiOs | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Sg1S276fmhlan_y8xjDynD5YYnUm | [
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"alpha": 90,
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} | 225 | HfCr2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387065 | [
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} | 225 | HoCr2Ag | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387079 | [
"Cr",
"Ir",
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24,
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} | 225 | Cr2IrAu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387091 | [
"Si",
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] | [
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24,
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14,
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} | 225 | Cr2SiGe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_D_XEmrN4xW5BFYu8eTOFIKbLcxf7 | [
"Cr",
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24,
24,
24,
24,
24,
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"alpha": 90,
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} | 225 | PmCr2Re | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387120 | [
"B",
"Cr",
"Ce"
] | [
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24,
24,
24,
24,
24,
24,
24,
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"alpha": 90,
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} | 225 | CeCr2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_G4PxlF4BTzsMjxYL7-0OtBGJ3LXN | [
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] | [
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24,
24,
24,
24,
24,
24,
24,
24,
42,
42,
42,
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] | {
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"alpha": 90,
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} | 225 | LiCr2Mo | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_387146 | [
"Cr",
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24,
24,
24,
24,
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24,
24,
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33,
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"alpha": 90,
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} | 225 | PuCr2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387171 | [
"Cr",
"Zr",
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] | [
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40,
40,
40,
24,
24,
24,
24,
24,
24,
24,
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"alpha": 90,
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} | 225 | HfZrCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387186 | [
"Sc",
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63,
21,
21,
21,
21,
24,
24,
24,
24,
24,
24,
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} | 225 | EuScCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_49nIDmxYae4CpJeUxD05SNfhRTq5 | [
"Cr",
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24,
24,
24,
24,
24,
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48,
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tar:NOMAD_cPrZQwp8lV8TW_HY8X0Hw6gBiMN2 | [
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tar:NOMAD_AB6UFWQ8FUIaafLVZ8KoJOOrOzy3 | [
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tar:OQMD_387274 | [
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tar:NOMAD_7MDqB9JhUTRCL3EHrt0hU7oExytt | [
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tar:OQMD_387306 | [
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tar:NOMAD_Fdu55qZZ9IgWVAIDKehK1xcooWUe | [
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} | 225 | KCr2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387334 | [
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} | 225 | Cr2CoSn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387347 | [
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} | 225 | TbCr2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387363 | [
"Ti",
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24,
24,
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24,
24,
24,
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} | 225 | TiCr2Sn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387375 | [
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24,
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24,
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} | 225 | NdCr2Ga | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387394 | [
"K",
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90,
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24,
24,
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} | 225 | KThCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387409 | [
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24,
24,
24,
24,
24,
24,
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46,
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} | 225 | ErCr2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_0GM3vpKQZKKpX7769tlimG6Vx31c | [
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24,
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24,
24,
24,
24,
24,
51,
51,
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} | 225 | PrCr2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387443 | [
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24,
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24,
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24,
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46,
46,
46,
46
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[
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0,
0
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[
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]
] | {
"a": 6.598790168762207,
"b": 6.598790168762207,
"c": 6.598790168762207,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SmCr2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387462 | [
"Be",
"Cr",
"Cu"
] | [
4,
4,
4,
4,
24,
24,
24,
24,
24,
24,
24,
24,
29,
29,
29,
29
] | 16 | 3 | [
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] | {
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"c": 5.57466983795166,
"alpha": 90,
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"gamma": 90
} | 225 | BeCr2Cu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387478 | [
"Si",
"Cr",
"Ac"
] | [
89,
89,
89,
89,
24,
24,
24,
24,
24,
24,
24,
24,
14,
14,
14,
14
] | 16 | 3 | [
[
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[
0,
0,
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[
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0.5
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[
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] | {
"a": 6.632242202758789,
"b": 6.632242202758789,
"c": 6.632242202758789,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | AcCr2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_rXAQDn0KeE7_DPgUccotaSWv3BQE | [
"Cr",
"Dy",
"Tl"
] | [
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66,
66,
66,
81,
81,
81,
81,
24,
24,
24,
24,
24,
24,
24,
24
] | 16 | 3 | [
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0
],
[
0,
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0.5,
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[
0.25,
0.25,
0.25
],
[
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] | {
"a": 6.691561222076416,
"b": 6.691561222076416,
"c": 6.691561222076416,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | DyTlCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_6x__4Kr1rEqtruK6meRxREAgd3U7 | [
"Cr",
"Sm",
"Au"
] | [
62,
62,
62,
62,
24,
24,
24,
24,
24,
24,
24,
24,
79,
79,
79,
79
] | 16 | 3 | [
[
0,
0,
0
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[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
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] | {
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"c": 6.602937698364258,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SmCr2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387521 | [
"Cr",
"Sm",
"Bi"
] | [
62,
62,
62,
62,
24,
24,
24,
24,
24,
24,
24,
24,
83,
83,
83,
83
] | 16 | 3 | [
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] | {
"a": 6.765932083129883,
"b": 6.765932083129883,
"c": 6.765932083129883,
"alpha": 90,
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} | 225 | SmCr2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_WoEndAlVH7Y1DXPZn72FtoJYdjaJ | [
"Cr",
"Cu",
"Gd"
] | [
64,
64,
64,
64,
24,
24,
24,
24,
24,
24,
24,
24,
29,
29,
29,
29
] | 16 | 3 | [
[
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0,
0
],
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[
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0,
0.5
],
[
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]
] | {
"a": 6.55234956741333,
"b": 6.55234956741333,
"c": 6.55234956741333,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | GdCr2Cu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_oDjcvU95gc69Hk5bJE_sLQyJ-xBi | [
"Cr",
"Pm",
"Ir"
] | [
61,
61,
61,
61,
24,
24,
24,
24,
24,
24,
24,
24,
77,
77,
77,
77
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
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[
0.5,
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,
0.5,
0
],
[
0.5,
0,
0
],
[
0.5,
0.5,
0.5
]
] | {
"a": 6.305897235870361,
"b": 6.305897235870361,
"c": 6.305897235870361,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PmCr2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_51PxoYJvZHhX7MAOcy2nqbGdb6dj | [
"Cr",
"Nd",
"Sm"
] | [
60,
60,
60,
60,
62,
62,
62,
62,
24,
24,
24,
24,
24,
24,
24,
24
] | 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,
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],
[
0.5,
0,
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],
[
0.5,
0.5,
0
],
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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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],
[
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0.75,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.75,
0.25,
0.25
]
] | {
"a": 7.21265983581543,
"b": 7.21265983581543,
"c": 7.21265983581543,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdSmCr2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Lnbn_RxuMouGRhZKlPkMB-aiqtoB | [
"Si",
"Cr",
"Pd"
] | [
24,
24,
24,
24,
24,
24,
24,
24,
14,
14,
14,
14,
46,
46,
46,
46
] | 16 | 3 | [
[
0.75,
0.75,
0.25
],
[
0.25,
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],
[
0.75,
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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,
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],
[
0.5,
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[
0.5,
0,
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[
0,
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[
0,
0.5,
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],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
]
] | {
"a": 5.933146953582764,
"b": 5.933146953582764,
"c": 5.933146953582764,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Cr2SiPd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387590 | [
"B",
"Cr",
"Cu"
] | [
24,
24,
24,
24,
24,
24,
24,
24,
29,
29,
29,
29,
5,
5,
5,
5
] | 16 | 3 | [
[
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],
[
0.25,
0.25,
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],
[
0.25,
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[
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[
0,
0.5,
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[
0.5,
0,
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[
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] | {
"a": 5.47175407409668,
"b": 5.47175407409668,
"c": 5.47175407409668,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Cr2CuB | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387606 | [
"Cr",
"Zr",
"Te"
] | [
40,
40,
40,
40,
24,
24,
24,
24,
24,
24,
24,
24,
52,
52,
52,
52
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
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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,
0.25,
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],
[
0.75,
0.75,
0.75
],
[
0,
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[
0,
0.5,
0
],
[
0.5,
0,
0
],
[
0.5,
0.5,
0.5
]
] | {
"a": 6.339498043060303,
"b": 6.339498043060303,
"c": 6.339498043060303,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ZrCr2Te | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_387620 | [
"Cr",
"Ge",
"Cd"
] | [
24,
24,
24,
24,
24,
24,
24,
24,
48,
48,
48,
48,
32,
32,
32,
32
] | 16 | 3 | [
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.25,
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0.75
],
[
0.25,
0.75,
0.75
],
[
0.75,
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],
[
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,
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[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
]
] | {
"a": 6.27849006652832,
"b": 6.27849006652832,
"c": 6.27849006652832,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Cr2CdGe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
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