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_HA6BTpDG-TES73q91fRNeAJA2nCw | [
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"Cu",
"Mo"
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Cu2BMo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404798 | [
"Cu",
"Ho",
"Os"
] | [
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67,
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67,
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29,
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29,
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] | {
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | HoCu2Os | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404819 | [
"Cu",
"Eu",
"Ho"
] | [
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63,
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67,
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29,
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | EuHoCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404834 | [
"Cu",
"Au",
"Tl"
] | [
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81,
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29,
29,
29,
29,
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] | 16 | 3 | [
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] | {
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"alpha": 90,
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"gamma": 90
} | 225 | TlCu2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_NI0z85kAhTast89VzMieZO11Cdd6 | [
"Cu",
"Ag",
"Np"
] | [
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93,
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93,
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29,
29,
29,
29,
29,
29,
29,
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47,
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] | {
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"c": 6.384947776794434,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NpCu2Ag | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404864 | [
"Cu",
"Pd",
"W"
] | [
29,
29,
29,
29,
29,
29,
29,
29,
46,
46,
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74,
74,
74,
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] | 16 | 3 | [
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] | {
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"c": 5.972844123840332,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Cu2PdW | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404875 | [
"V",
"Cu",
"Lu"
] | [
71,
71,
71,
71,
23,
23,
23,
23,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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] | {
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"c": 6.3322038650512695,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LuVCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404893 | [
"Cu",
"Sn",
"W"
] | [
29,
29,
29,
29,
29,
29,
29,
29,
50,
50,
50,
50,
74,
74,
74,
74
] | 16 | 3 | [
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] | {
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"b": 6.230984210968018,
"c": 6.230984210968018,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Cu2SnW | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404910 | [
"Si",
"Cu",
"Cd"
] | [
48,
48,
48,
48,
29,
29,
29,
29,
29,
29,
29,
29,
14,
14,
14,
14
] | 16 | 3 | [
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] | {
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"c": 6.133195877075195,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CdCu2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404927 | [
"Co",
"Cu",
"Cs"
] | [
55,
55,
55,
55,
27,
27,
27,
27,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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] | {
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CsCoCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404944 | [
"Na",
"Cu",
"Pd"
] | [
11,
11,
11,
11,
29,
29,
29,
29,
29,
29,
29,
29,
46,
46,
46,
46
] | 16 | 3 | [
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] | {
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NaCu2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404961 | [
"Ti",
"Cu",
"Gd"
] | [
64,
64,
64,
64,
22,
22,
22,
22,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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] | {
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"b": 6.5375518798828125,
"c": 6.5375518798828125,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | GdTiCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404979 | [
"Ti",
"Cu",
"W"
] | [
22,
22,
22,
22,
29,
29,
29,
29,
29,
29,
29,
29,
74,
74,
74,
74
] | 16 | 3 | [
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] | {
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"b": 6.0465240478515625,
"c": 6.0465240478515625,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TiCu2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_404996 | [
"Ni",
"Cu",
"Pa"
] | [
91,
91,
91,
91,
29,
29,
29,
29,
29,
29,
29,
29,
28,
28,
28,
28
] | 16 | 3 | [
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] | {
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"b": 6.256971836090088,
"c": 6.256971836090088,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PaCu2Ni | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405008 | [
"Cu",
"Zn",
"Re"
] | [
30,
30,
30,
30,
29,
29,
29,
29,
29,
29,
29,
29,
75,
75,
75,
75
] | 16 | 3 | [
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"alpha": 90,
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"gamma": 90
} | 225 | ZnCu2Re | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405028 | [
"Cu",
"Tb",
"Tm"
] | [
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65,
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65,
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69,
69,
69,
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29,
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29,
29,
29,
29,
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"alpha": 90,
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} | 225 | TbTmCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405042 | [
"Cu",
"Zn",
"W"
] | [
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29,
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29,
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29,
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"alpha": 90,
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} | 225 | ZnCu2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405061 | [
"Cu",
"Ga",
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] | [
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29,
29,
29,
29,
29,
29,
29,
29,
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"alpha": 90,
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} | 225 | GaCu2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405077 | [
"Cu",
"Sb",
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] | [
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29,
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29,
29,
29,
29,
29,
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51,
51,
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78,
78,
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"alpha": 90,
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} | 225 | Cu2SbPt | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405087 | [
"Ni",
"Cu",
"Yb"
] | [
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70,
70,
70,
29,
29,
29,
29,
29,
29,
29,
29,
28,
28,
28,
28
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | YbCu2Ni | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405103 | [
"Co",
"Cu",
"Ga"
] | [
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31,
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31,
27,
27,
27,
27,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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] | {
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"alpha": 90,
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} | 225 | GaCoCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405117 | [
"Cu",
"Zn",
"Ru"
] | [
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30,
30,
30,
29,
29,
29,
29,
29,
29,
29,
29,
44,
44,
44,
44
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"alpha": 90,
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"gamma": 90
} | 225 | ZnCu2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405130 | [
"Cu",
"Dy",
"Np"
] | [
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66,
66,
66,
93,
93,
93,
93,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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"alpha": 90,
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"gamma": 90
} | 225 | DyNpCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405145 | [
"Cu",
"Pd",
"Ir"
] | [
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29,
29,
29,
29,
29,
29,
29,
77,
77,
77,
77,
46,
46,
46,
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"alpha": 90,
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"gamma": 90
} | 225 | Cu2IrPd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405163 | [
"Sc",
"Cu",
"Ru"
] | [
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21,
21,
21,
29,
29,
29,
29,
29,
29,
29,
29,
44,
44,
44,
44
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] | {
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"alpha": 90,
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"gamma": 90
} | 225 | ScCu2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405176 | [
"Cu",
"La",
"Os"
] | [
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57,
57,
57,
29,
29,
29,
29,
29,
29,
29,
29,
76,
76,
76,
76
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] | {
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"alpha": 90,
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} | 225 | LaCu2Os | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405194 | [
"Cu",
"Tl",
"Ac"
] | [
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89,
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89,
81,
81,
81,
81,
29,
29,
29,
29,
29,
29,
29,
29
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"alpha": 90,
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} | 225 | AcTlCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405210 | [
"Cr",
"Cu",
"Np"
] | [
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93,
93,
93,
24,
24,
24,
24,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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[
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] | {
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"alpha": 90,
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} | 225 | NpCrCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405223 | [
"Cu",
"Re",
"Au"
] | [
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29,
29,
29,
29,
29,
29,
29,
75,
75,
75,
75,
79,
79,
79,
79
] | 16 | 3 | [
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] | {
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"alpha": 90,
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} | 225 | Cu2ReAu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405239 | [
"Cu",
"Ta",
"Bi"
] | [
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73,
73,
73,
29,
29,
29,
29,
29,
29,
29,
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83,
83,
83,
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"alpha": 90,
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} | 225 | TaCu2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405255 | [
"Cu",
"As",
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] | [
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65,
65,
65,
29,
29,
29,
29,
29,
29,
29,
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33,
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} | 225 | TbCu2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405272 | [
"Cu",
"Tc",
"Pu"
] | [
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94,
94,
94,
29,
29,
29,
29,
29,
29,
29,
29,
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43,
43,
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"alpha": 90,
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} | 225 | PuCu2Tc | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_qAsnRCFxt_f-fXQ_wdsulFLWOzHg | [
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59,
59,
59,
29,
29,
29,
29,
29,
29,
29,
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"alpha": 90,
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} | 225 | NaPrCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405302 | [
"Cu",
"In",
"Hg"
] | [
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49,
49,
49,
29,
29,
29,
29,
29,
29,
29,
29,
80,
80,
80,
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"alpha": 90,
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} | 225 | InCu2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405314 | [
"Na",
"Cu",
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] | [
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11,
11,
11,
29,
29,
29,
29,
29,
29,
29,
29,
51,
51,
51,
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} | 225 | NaCu2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_dwfXR6qu69rFT8R3SrKO1Ck8HroT | [
"Mn",
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59,
59,
59,
25,
25,
25,
25,
29,
29,
29,
29,
29,
29,
29,
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"alpha": 90,
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} | 225 | PrMnCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405342 | [
"Cu",
"Ga",
"Hg"
] | [
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31,
31,
31,
29,
29,
29,
29,
29,
29,
29,
29,
80,
80,
80,
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"alpha": 90,
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} | 225 | GaCu2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405360 | [
"Fe",
"Cu",
"Cs"
] | [
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55,
55,
55,
26,
26,
26,
26,
29,
29,
29,
29,
29,
29,
29,
29
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"alpha": 90,
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} | 225 | CsFeCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405390 | [
"Cu",
"Zn",
"Np"
] | [
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93,
93,
93,
30,
30,
30,
30,
29,
29,
29,
29,
29,
29,
29,
29
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"alpha": 90,
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} | 225 | NpZnCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405403 | [
"Cu",
"Sb",
"Au"
] | [
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29,
29,
29,
29,
29,
29,
29,
51,
51,
51,
51,
79,
79,
79,
79
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"alpha": 90,
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} | 225 | Cu2SbAu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405420 | [
"Cu",
"Mo",
"Cd"
] | [
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48,
48,
48,
29,
29,
29,
29,
29,
29,
29,
29,
42,
42,
42,
42
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"alpha": 90,
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} | 225 | CdCu2Mo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405434 | [
"Cu",
"Ru",
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] | [
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73,
73,
73,
29,
29,
29,
29,
29,
29,
29,
29,
44,
44,
44,
44
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"alpha": 90,
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} | 225 | TaCu2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405449 | [
"Mg",
"Cu",
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] | [
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12,
12,
12,
29,
29,
29,
29,
29,
29,
29,
29,
77,
77,
77,
77
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"alpha": 90,
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} | 225 | MgCu2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_thpNsQGCSP7jvKKSvU_1WSnTkJBf | [
"Ca",
"Cu",
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] | [
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20,
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20,
63,
63,
63,
63,
29,
29,
29,
29,
29,
29,
29,
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] | {
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"c": 7.059059143066406,
"alpha": 90,
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"gamma": 90
} | 225 | CaEuCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405478 | [
"Cu",
"Zr",
"W"
] | [
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40,
40,
40,
29,
29,
29,
29,
29,
29,
29,
29,
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74,
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"alpha": 90,
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} | 225 | ZrCu2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405494 | [
"Cu",
"Pd",
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] | [
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59,
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59,
29,
29,
29,
29,
29,
29,
29,
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46,
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"alpha": 90,
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} | 225 | PrCu2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405505 | [
"Cu",
"Yb",
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] | [
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70,
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70,
29,
29,
29,
29,
29,
29,
29,
29,
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80,
80,
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"alpha": 90,
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} | 225 | YbCu2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405534 | [
"Cu",
"Ru",
"U"
] | [
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92,
92,
92,
29,
29,
29,
29,
29,
29,
29,
29,
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44,
44,
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"alpha": 90,
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} | 225 | UCu2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405547 | [
"Mn",
"Cu",
"Ho"
] | [
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67,
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67,
25,
25,
25,
25,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | HoMnCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405559 | [
"Si",
"Cu",
"U"
] | [
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92,
92,
92,
29,
29,
29,
29,
29,
29,
29,
29,
14,
14,
14,
14
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"alpha": 90,
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} | 225 | UCu2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_-HWuyPk3mYu8eBJK1fVEzpDPPhP1 | [
"Ti",
"Cu",
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] | [
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22,
22,
22,
29,
29,
29,
29,
29,
29,
29,
29,
80,
80,
80,
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"alpha": 90,
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} | 225 | TiCu2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405591 | [
"Cu",
"Ga",
"Sn"
] | [
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31,
31,
31,
29,
29,
29,
29,
29,
29,
29,
29,
50,
50,
50,
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"alpha": 90,
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} | 225 | GaCu2Sn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405624 | [
"Fe",
"Cu",
"Re"
] | [
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26,
26,
26,
29,
29,
29,
29,
29,
29,
29,
29,
75,
75,
75,
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"alpha": 90,
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} | 225 | FeCu2Re | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405638 | [
"Cu",
"Cd",
"Bi"
] | [
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48,
48,
48,
29,
29,
29,
29,
29,
29,
29,
29,
83,
83,
83,
83
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"alpha": 90,
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} | 225 | CdCu2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405656 | [
"Cu",
"Zr",
"La"
] | [
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57,
57,
57,
40,
40,
40,
40,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | LaZrCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_7kXY_3meMc-fDFaiCTVbysGF-hNO | [
"Cu",
"W",
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93,
93,
93,
29,
29,
29,
29,
29,
29,
29,
29,
74,
74,
74,
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"alpha": 90,
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} | 225 | NpCu2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405687 | [
"B",
"Cu",
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] | [
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31,
31,
31,
29,
29,
29,
29,
29,
29,
29,
29,
5,
5,
5,
5
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] | {
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"alpha": 90,
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} | 225 | GaCu2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405701 | [
"Cu",
"Pm",
"Tb"
] | [
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65,
65,
65,
61,
61,
61,
61,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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] | {
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"alpha": 90,
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"gamma": 90
} | 225 | TbPmCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405717 | [
"Al",
"Cu",
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] | [
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94,
94,
94,
13,
13,
13,
13,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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"alpha": 90,
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"gamma": 90
} | 225 | PuAlCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405732 | [
"Mn",
"Cu",
"Ac"
] | [
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25,
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25,
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29,
29,
29,
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29,
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} | 225 | AcMnCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405741 | [
"B",
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72,
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29,
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29,
29,
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} | 225 | HfCu2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405754 | [
"Ti",
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22,
22,
22,
22,
29,
29,
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29,
29,
29,
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"alpha": 90,
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} | 225 | SrTiCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405780 | [
"Na",
"Cu",
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] | [
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11,
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11,
29,
29,
29,
29,
29,
29,
29,
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82,
82,
82,
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"alpha": 90,
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} | 225 | NaCu2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405797 | [
"Si",
"Cu",
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] | [
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30,
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30,
29,
29,
29,
29,
29,
29,
29,
29,
14,
14,
14,
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"alpha": 90,
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} | 225 | ZnCu2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405827 | [
"Mn",
"Cu",
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] | [
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25,
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25,
30,
30,
30,
30,
29,
29,
29,
29,
29,
29,
29,
29
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"alpha": 90,
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} | 225 | MnZnCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405843 | [
"Fe",
"Cu",
"In"
] | [
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49,
49,
49,
26,
26,
26,
26,
29,
29,
29,
29,
29,
29,
29,
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"alpha": 90,
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} | 225 | InFeCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405862 | [
"Cu",
"Hf",
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] | [
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72,
72,
72,
91,
91,
91,
91,
29,
29,
29,
29,
29,
29,
29,
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"alpha": 90,
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} | 225 | HfPaCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_M4xezEnI9fQyJQJz61c7_JtonqQT | [
"K",
"Cu",
"Dy"
] | [
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19,
19,
19,
66,
66,
66,
66,
29,
29,
29,
29,
29,
29,
29,
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"alpha": 90,
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} | 225 | KDyCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405891 | [
"Cu",
"Nb",
"Pm"
] | [
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61,
61,
61,
41,
41,
41,
41,
29,
29,
29,
29,
29,
29,
29,
29
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"alpha": 90,
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} | 225 | PmNbCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_1wtBcsgi7EgOnzmuqQmqXeEQhPEu | [
"Cu",
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56,
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41,
41,
41,
41,
29,
29,
29,
29,
29,
29,
29,
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"alpha": 90,
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} | 225 | BaNbCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405919 | [
"Cu",
"Eu",
"Tb"
] | [
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65,
65,
65,
63,
63,
63,
63,
29,
29,
29,
29,
29,
29,
29,
29
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] | {
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"alpha": 90,
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} | 225 | TbEuCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405936 | [
"Cu",
"Nb",
"In"
] | [
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41,
41,
41,
49,
49,
49,
49,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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] | {
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"alpha": 90,
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} | 225 | NbInCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_KeGL-ydJTOBasTxrHipk02e-bNYt | [
"Cu",
"La",
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57,
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69,
69,
69,
69,
29,
29,
29,
29,
29,
29,
29,
29
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] | {
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"alpha": 90,
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} | 225 | LaTmCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_405994 | [
"Cu",
"As",
"La"
] | [
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57,
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57,
29,
29,
29,
29,
29,
29,
29,
29,
33,
33,
33,
33
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | LaCu2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_8fu2u-XNZNe_pNtlxZrE8J4bp98l | [
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89,
89,
58,
58,
58,
58,
29,
29,
29,
29,
29,
29,
29,
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"alpha": 90,
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} | 225 | AcCeCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406022 | [
"Cu",
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31,
31,
29,
29,
29,
29,
29,
29,
29,
29,
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52,
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"alpha": 90,
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} | 225 | GaCu2Te | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406040 | [
"Fe",
"Cu",
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] | [
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26,
26,
26,
29,
29,
29,
29,
29,
29,
29,
29,
33,
33,
33,
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"alpha": 90,
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} | 225 | FeCu2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406054 | [
"Mg",
"Ca",
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] | [
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20,
20,
20,
12,
12,
12,
12,
29,
29,
29,
29,
29,
29,
29,
29
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"alpha": 90,
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} | 225 | CaMgCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406072 | [
"Cu",
"Mo",
"Pr"
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59,
59,
59,
29,
29,
29,
29,
29,
29,
29,
29,
42,
42,
42,
42
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"alpha": 90,
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} | 225 | PrCu2Mo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406091 | [
"Fe",
"Cu",
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] | [
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92,
92,
92,
26,
26,
26,
26,
29,
29,
29,
29,
29,
29,
29,
29
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | UFeCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406106 | [
"Cu",
"Zn",
"Hg"
] | [
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30,
30,
30,
29,
29,
29,
29,
29,
29,
29,
29,
80,
80,
80,
80
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | ZnCu2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_xG1tw_HJI3sruzNsCOXG96fHMxWc | [
"Cu",
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] | [
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92,
92,
92,
29,
29,
29,
29,
29,
29,
29,
29,
78,
78,
78,
78
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"alpha": 90,
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} | 225 | UCu2Pt | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406136 | [
"Na",
"Cu",
"Hg"
] | [
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11,
11,
11,
29,
29,
29,
29,
29,
29,
29,
29,
80,
80,
80,
80
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | NaCu2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406152 | [
"Cu",
"Pd",
"Hg"
] | [
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29,
29,
29,
29,
29,
29,
29,
80,
80,
80,
80,
46,
46,
46,
46
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | Cu2HgPd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406168 | [
"Sc",
"Cu",
"Ac"
] | [
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89,
89,
89,
21,
21,
21,
21,
29,
29,
29,
29,
29,
29,
29,
29
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"alpha": 90,
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} | 225 | AcScCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406183 | [
"Cu",
"Tm",
"Pu"
] | [
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69,
69,
69,
94,
94,
94,
94,
29,
29,
29,
29,
29,
29,
29,
29
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"alpha": 90,
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} | 225 | TmPuCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_nwZNXAkF5PF4uit1F1n0552bte_Q | [
"Cu",
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38,
38,
38,
29,
29,
29,
29,
29,
29,
29,
29,
32,
32,
32,
32
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"alpha": 90,
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} | 225 | SrCu2Ge | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_7ZJmRGdy73alkatunNh5-oK1KR0g | [
"K",
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"W"
] | [
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19,
19,
19,
29,
29,
29,
29,
29,
29,
29,
29,
74,
74,
74,
74
] | 16 | 3 | [
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | KCu2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_TUyNPotJmzLNbjXL5VRt_0doT72q | [
"Be",
"Cu",
"Eu"
] | [
63,
63,
63,
63,
4,
4,
4,
4,
29,
29,
29,
29,
29,
29,
29,
29
] | 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,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
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[
0.75,
0.25,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.75,
0.75,
0.75
]
] | {
"a": 6.3531880378723145,
"b": 6.3531880378723145,
"c": 6.3531880378723145,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | EuBeCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406264 | [
"Cu",
"Zr",
"Ir"
] | [
40,
40,
40,
40,
29,
29,
29,
29,
29,
29,
29,
29,
77,
77,
77,
77
] | 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": 6.162642002105713,
"b": 6.162642002105713,
"c": 6.162642002105713,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ZrCu2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406279 | [
"Cu",
"Rb",
"Th"
] | [
37,
37,
37,
37,
90,
90,
90,
90,
29,
29,
29,
29,
29,
29,
29,
29
] | 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": 7.317972183227539,
"b": 7.317972183227539,
"c": 7.317972183227539,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbThCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_2_vKI5Gg5s9McPvYFJ9nL57Gt0xj | [
"Cu",
"Eu",
"Pu"
] | [
63,
63,
63,
63,
94,
94,
94,
94,
29,
29,
29,
29,
29,
29,
29,
29
] | 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": 6.907543659210205,
"b": 6.907543659210205,
"c": 6.907543659210205,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | EuPuCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_uw-NdeSnz-x3vSzg1c_RC3_wgbfp | [
"Co",
"Cu",
"Er"
] | [
68,
68,
68,
68,
27,
27,
27,
27,
29,
29,
29,
29,
29,
29,
29,
29
] | 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": 6.170393466949463,
"b": 6.170393466949463,
"c": 6.170393466949463,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ErCoCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_UvAqUUEpOzizoCTbVETgr73Nnsnh | [
"Cu",
"Ho",
"Hf"
] | [
67,
67,
67,
67,
72,
72,
72,
72,
29,
29,
29,
29,
29,
29,
29,
29
] | 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,
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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": 6.619369029998779,
"b": 6.619369029998779,
"c": 6.619369029998779,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | HoHfCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406340 | [
"Mn",
"Cu",
"Tl"
] | [
25,
25,
25,
25,
81,
81,
81,
81,
29,
29,
29,
29,
29,
29,
29,
29
] | 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": 6.189524173736572,
"b": 6.189524173736572,
"c": 6.189524173736572,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | MnTlCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406355 | [
"V",
"Cu",
"Cs"
] | [
55,
55,
55,
55,
23,
23,
23,
23,
29,
29,
29,
29,
29,
29,
29,
29
] | 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": 7.259548187255859,
"b": 7.259548187255859,
"c": 7.259548187255859,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CsVCu2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406370 | [
"Cu",
"Rh",
"Te"
] | [
29,
29,
29,
29,
29,
29,
29,
29,
52,
52,
52,
52,
45,
45,
45,
45
] | 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": 6.267821788787842,
"b": 6.267821788787842,
"c": 6.267821788787842,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Cu2TeRh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_u6fr_GBpfpEfP6vhZNkNyUerWp27 | [
"Cu",
"Sn",
"Pu"
] | [
94,
94,
94,
94,
29,
29,
29,
29,
29,
29,
29,
29,
50,
50,
50,
50
] | 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": 6.579455852508545,
"b": 6.579455852508545,
"c": 6.579455852508545,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PuCu2Sn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_406402 | [
"Li",
"Cr",
"Cu"
] | [
3,
3,
3,
3,
24,
24,
24,
24,
29,
29,
29,
29,
29,
29,
29,
29
] | 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": 5.8161139488220215,
"b": 5.8161139488220215,
"c": 5.8161139488220215,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LiCrCu2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_406421 | [
"Cu",
"W",
"Ac"
] | [
89,
89,
89,
89,
29,
29,
29,
29,
29,
29,
29,
29,
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": 6.750103950500488,
"b": 6.750103950500488,
"c": 6.750103950500488,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | AcCu2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
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