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_529154 | [
"Mn",
"Ni",
"Ir"
] | [
25,
25,
25,
25,
28,
28,
28,
28,
28,
28,
28,
28,
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
],
... | {
"a": 5.702668190002441,
"b": 5.702668190002441,
"c": 5.702668190002441,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | MnNi2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529190 | [
"Ni",
"Nd",
"Hf"
] | [
60,
60,
60,
60,
72,
72,
72,
72,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0,
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": 6.61873197555542,
"b": 6.61873197555542,
"c": 6.61873197555542,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdHfNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_liRmQ4cFD4AJR0jsJY0FDQi4W75v | [
"Ca",
"Ni",
"Pa"
] | [
20,
20,
20,
20,
91,
91,
91,
91,
28,
28,
28,
28,
28,
28,
28,
28
] | 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,
0.5
],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 6.704413414001465,
"b": 6.704413414001465,
"c": 6.704413414001465,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CaPaNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529218 | [
"V",
"Ni",
"Tm"
] | [
69,
69,
69,
69,
23,
23,
23,
23,
28,
28,
28,
28,
28,
28,
28,
28
] | 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": 6.230319976806641,
"b": 6.230319976806641,
"c": 6.230319976806641,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TmVNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_aUGCdNdo4lzXblAn5t_gSBu9wVEg | [
"Ni",
"Ag",
"Dy"
] | [
66,
66,
66,
66,
28,
28,
28,
28,
28,
28,
28,
28,
47,
47,
47,
47
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
... | {
"a": 6.351283073425293,
"b": 6.351283073425293,
"c": 6.351283073425293,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | DyNi2Ag | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_MX76LT5ypNhOsGbK7QHsD3F4FS3e | [
"Cr",
"Ni",
"Sm"
] | [
62,
62,
62,
62,
24,
24,
24,
24,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
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0,
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0.5
],
[
0,
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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": 6.360195159912109,
"b": 6.360195159912109,
"c": 6.360195159912109,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SmCrNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529263 | [
"Ni",
"Cu",
"Au"
] | [
29,
29,
29,
29,
28,
28,
28,
28,
28,
28,
28,
28,
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": 5.8562822341918945,
"b": 5.8562822341918945,
"c": 5.8562822341918945,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CuNi2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529278 | [
"Ni",
"Sn",
"Nd"
] | [
60,
60,
60,
60,
28,
28,
28,
28,
28,
28,
28,
28,
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
],
... | {
"a": 6.611412048339844,
"b": 6.611412048339844,
"c": 6.611412048339844,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdNi2Sn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529295 | [
"Ni",
"Gd",
"Tb"
] | [
65,
65,
65,
65,
64,
64,
64,
64,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0,
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": 6.739346027374268,
"b": 6.739346027374268,
"c": 6.739346027374268,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TbGdNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Cm0sqp4oLNQxPTlYVtD777eRV2V2 | [
"Cr",
"Ni",
"Th"
] | [
90,
90,
90,
90,
24,
24,
24,
24,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0,
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": 6.369265079498291,
"b": 6.369265079498291,
"c": 6.369265079498291,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ThCrNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529325 | [
"Si",
"Ni",
"Mo"
] | [
14,
14,
14,
14,
28,
28,
28,
28,
28,
28,
28,
28,
42,
42,
42,
42
] | 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": 5.8135881423950195,
"b": 5.8135881423950195,
"c": 5.8135881423950195,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SiNi2Mo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529342 | [
"Ni",
"Er",
"Ta"
] | [
68,
68,
68,
68,
73,
73,
73,
73,
28,
28,
28,
28,
28,
28,
28,
28
] | 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": 6.363039970397949,
"b": 6.363039970397949,
"c": 6.363039970397949,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ErTaNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_rw0E95MfazHr2uUpGxMjUa9nkzRk | [
"Ni",
"Pm",
"Gd"
] | [
61,
61,
61,
61,
64,
64,
64,
64,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0,
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": 6.831419467926025,
"b": 6.831419467926025,
"c": 6.831419467926025,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PmGdNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529370 | [
"Si",
"Ca",
"Ni"
] | [
20,
20,
20,
20,
14,
14,
14,
14,
28,
28,
28,
28,
28,
28,
28,
28
] | 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": 6.114739894866943,
"b": 6.114739894866943,
"c": 6.114739894866943,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CaSiNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529382 | [
"Mg",
"Co",
"Ni"
] | [
12,
12,
12,
12,
27,
27,
27,
27,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0,
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": 5.750723838806152,
"b": 5.750723838806152,
"c": 5.750723838806152,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | MgCoNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529396 | [
"Ni",
"Cs",
"Hg"
] | [
55,
55,
55,
55,
28,
28,
28,
28,
28,
28,
28,
28,
80,
80,
80,
80
] | 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
],
... | {
"a": 6.968987941741943,
"b": 6.968987941741943,
"c": 6.968987941741943,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CsNi2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529409 | [
"Ni",
"Os",
"Pt"
] | [
28,
28,
28,
28,
28,
28,
28,
28,
76,
76,
76,
76,
78,
78,
78,
78
] | 16 | 3 | [
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.75,
0.75
],
[
0.75,
0.75,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.75,
0.25,
0.25
],
[
0,
... | {
"a": 5.874986171722412,
"b": 5.874986171722412,
"c": 5.874986171722412,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Ni2OsPt | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529424 | [
"Ni",
"Ta",
"Ir"
] | [
73,
73,
73,
73,
28,
28,
28,
28,
28,
28,
28,
28,
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
],
... | {
"a": 5.963324069976807,
"b": 5.963324069976807,
"c": 5.963324069976807,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TaNi2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529443 | [
"Cr",
"Ni",
"Tc"
] | [
24,
24,
24,
24,
43,
43,
43,
43,
28,
28,
28,
28,
28,
28,
28,
28
] | 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": 5.758294105529785,
"b": 5.758294105529785,
"c": 5.758294105529785,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CrTcNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_1tIoxVzTKwICQf4FGiYfAc0nqOFO | [
"Ni",
"Sr",
"Th"
] | [
38,
38,
38,
38,
90,
90,
90,
90,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
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} | 225 | SrThNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_t0ZNSIl5vjfl8aSYbD9_KShUTsEH | [
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tar:OQMD_529483 | [
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tar:NOMAD_Bmtssr8Hj2f1OVlZDZJ1rqdcgBtj | [
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tar:NOMAD_3NYuvjKWxnVTk_YiET6T2hrP__wD | [
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} | 225 | PmNi2Rh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529531 | [
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26,
28,
28,
28,
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} | 225 | InFeNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_SfdRahDGeTNyR0BEwnFfIA7dGOjL | [
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} | 225 | CsNi2Mo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529574 | [
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} | 225 | CaNi2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529590 | [
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28,
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28,
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80,
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} | 225 | Ni2HgTe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Cz-R5iy6_fnmEcS-u7SHUtnKi8XI | [
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28,
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28,
28,
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} | 225 | RbTlNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_I9K_FbW5qXz91VTHWg7G4y1OO1rE | [
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28,
28,
28,
28,
28,
28,
28,
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} | 225 | CeNi2Ge | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_voxU4qqdl36uHutvO7i-9Lrz4546 | [
"V",
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23,
23,
28,
28,
28,
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28,
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} | 225 | CeVNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_FNwzgDn_cB70SOMw3V3BkMLHblse | [
"K",
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19,
28,
28,
28,
28,
28,
28,
28,
28,
33,
33,
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} | 225 | KNi2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529709 | [
"Ni",
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31,
28,
28,
28,
28,
28,
28,
28,
28,
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} | 225 | GaNi2Te | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529731 | [
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] | [
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14,
14,
14,
14,
28,
28,
28,
28,
28,
28,
28,
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} | 225 | PrSiNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529743 | [
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"Ni",
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93,
93,
93,
93,
28,
28,
28,
28,
28,
28,
28,
28
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} | 225 | MgNpNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529761 | [
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] | [
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28,
28,
28,
28,
28,
28,
28,
76,
76,
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76,
46,
46,
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} | 225 | Ni2OsPd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529775 | [
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91,
4,
4,
4,
4,
28,
28,
28,
28,
28,
28,
28,
28
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} | 225 | PaBeNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529788 | [
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] | [
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4,
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4,
49,
49,
49,
49,
28,
28,
28,
28,
28,
28,
28,
28
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} | 225 | BeInNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_bCHSwFmZV_nZraVruFXd8URoH_O6 | [
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92,
92,
92,
92,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
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} | 225 | TbUNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529820 | [
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] | [
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69,
69,
29,
29,
29,
29,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
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0
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[
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"alpha": 90,
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} | 225 | TmCuNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529838 | [
"Ni",
"Cd",
"Pm"
] | [
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61,
61,
61,
48,
48,
48,
48,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
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[
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"alpha": 90,
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} | 225 | PmCdNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529853 | [
"Ni",
"Ba",
"Er"
] | [
56,
56,
56,
56,
68,
68,
68,
68,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
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[
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[
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[
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"alpha": 90,
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} | 225 | BaErNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_aBpVBjddZnYUvsctxQlriRApao3I | [
"Ni",
"Tb",
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] | [
65,
65,
65,
65,
70,
70,
70,
70,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
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[
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... | {
"a": 6.676961421966553,
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"c": 6.676961421966553,
"alpha": 90,
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} | 225 | TbYbNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_-8Tv_zNbat6DUaggNTm2a9wfgHc3 | [
"Na",
"Ni",
"Pa"
] | [
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11,
11,
11,
91,
91,
91,
91,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
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[
0.75,
0.75,
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[
0.25,
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... | {
"a": 6.501149654388428,
"b": 6.501149654388428,
"c": 6.501149654388428,
"alpha": 90,
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"gamma": 90
} | 225 | NaPaNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_sV2z_4qauHPkQk7FYjl_7mpvFCYD | [
"Ni",
"As",
"Dy"
] | [
66,
66,
66,
66,
28,
28,
28,
28,
28,
28,
28,
28,
33,
33,
33,
33
] | 16 | 3 | [
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0,
0,
0
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0,
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[
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[
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[
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... | {
"a": 6.261009693145752,
"b": 6.261009693145752,
"c": 6.261009693145752,
"alpha": 90,
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} | 225 | DyNi2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529913 | [
"Ni",
"Pr",
"Ho"
] | [
59,
59,
59,
59,
67,
67,
67,
67,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
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0
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[
0.25,
0.75,
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],
[
0.25,
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... | {
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"c": 6.826208114624023,
"alpha": 90,
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"gamma": 90
} | 225 | PrHoNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529929 | [
"Sc",
"Ni",
"Sr"
] | [
38,
38,
38,
38,
21,
21,
21,
21,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
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0,
0,
0
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[
0,
0.5,
0.5
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[
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[
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[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
... | {
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"c": 6.713918209075928,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SrScNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529946 | [
"Ni",
"Sm",
"Ir"
] | [
62,
62,
62,
62,
28,
28,
28,
28,
28,
28,
28,
28,
77,
77,
77,
77
] | 16 | 3 | [
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0,
0,
0
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[
0,
0.5,
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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,
0.75,
0.25
],
... | {
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"b": 6.308884143829346,
"c": 6.308884143829346,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SmNi2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529960 | [
"Ni",
"Zn",
"Ac"
] | [
89,
89,
89,
89,
30,
30,
30,
30,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
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[
0.5,
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0.5
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[
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0,
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[
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[
0.5,
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[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 6.639420032501221,
"b": 6.639420032501221,
"c": 6.639420032501221,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | AcZnNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529975 | [
"Ni",
"Sb",
"Ho"
] | [
67,
67,
67,
67,
28,
28,
28,
28,
28,
28,
28,
28,
51,
51,
51,
51
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
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[
0.5,
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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": 6.420263767242432,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | HoNi2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_529988 | [
"B",
"Ni",
"Au"
] | [
28,
28,
28,
28,
28,
28,
28,
28,
5,
5,
5,
5,
79,
79,
79,
79
] | 16 | 3 | [
[
0.25,
0.75,
0.75
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[
0.25,
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[
0.25,
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[
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[
0.75,
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],
[
0,
... | {
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"c": 5.734695911407471,
"alpha": 90,
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"gamma": 90
} | 225 | Ni2BAu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530001 | [
"Ni",
"Os",
"Pb"
] | [
28,
28,
28,
28,
28,
28,
28,
28,
76,
76,
76,
76,
82,
82,
82,
82
] | 16 | 3 | [
[
0.75,
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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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[
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[
0.75,
0.25,
0.25
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[
0,
... | {
"a": 6.147012233734131,
"b": 6.147012233734131,
"c": 6.147012233734131,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Ni2OsPb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_oU_s_Un-H_fNCAEfmQOiz_9cjl1O | [
"Fe",
"Ni",
"Pu"
] | [
94,
94,
94,
94,
26,
26,
26,
26,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
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],
[
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],
[
0,
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[
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[
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0.5,
0.5
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[
0.25,
0.75,
0.75
],
[
0.25,
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... | {
"a": 5.950509548187256,
"b": 5.950509548187256,
"c": 5.950509548187256,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PuFeNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530034 | [
"V",
"Ni",
"Ir"
] | [
23,
23,
23,
23,
28,
28,
28,
28,
28,
28,
28,
28,
77,
77,
77,
77
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
0.5,
0,
0.5
],
[
0.5,
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0
],
[
0.25,
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[
0.25,
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[
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[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
... | {
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"b": 5.7998199462890625,
"c": 5.7998199462890625,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | VNi2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_8h05S5zBvJtUP1f8qkMKtDGL_e28 | [
"K",
"Ni",
"Os"
] | [
19,
19,
19,
19,
28,
28,
28,
28,
28,
28,
28,
28,
76,
76,
76,
76
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
0.5,
0,
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],
[
0.5,
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],
[
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[
0.25,
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[
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[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
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],
... | {
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"b": 6.313437461853027,
"c": 6.313437461853027,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | KNi2Os | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530064 | [
"Ni",
"Nb",
"Ta"
] | [
73,
73,
73,
73,
41,
41,
41,
41,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
0.5,
0,
0.5
],
[
0.5,
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0
],
[
0,
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0.5
],
[
0,
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0
],
[
0.5,
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],
[
0.5,
0.5,
0.5
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[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
... | {
"a": 6.128109931945801,
"b": 6.128109931945801,
"c": 6.128109931945801,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TaNbNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Fu7dEJ-Ydy_F4IhN2AVjnP8rEJFe | [
"Al",
"Ni",
"Gd"
] | [
64,
64,
64,
64,
13,
13,
13,
13,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0,
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0.5
],
[
0,
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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": 6.304471492767334,
"b": 6.304471492767334,
"c": 6.304471492767334,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | GdAlNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530103 | [
"Ni",
"Lu",
"Pb"
] | [
71,
71,
71,
71,
28,
28,
28,
28,
28,
28,
28,
28,
82,
82,
82,
82
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
0
],
[
0.75,
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0.25
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[
0.25,
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],
[
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0.25,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.75,
0.75
],
... | {
"a": 6.4711480140686035,
"b": 6.4711480140686035,
"c": 6.4711480140686035,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LuNi2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_1JrPWiJSl1tQ1AJHM0Gyehpn6j0n | [
"Ni",
"Ga",
"As"
] | [
31,
31,
31,
31,
28,
28,
28,
28,
28,
28,
28,
28,
33,
33,
33,
33
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
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],
[
0.75,
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0.25
],
[
0.25,
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[
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],
[
0.25,
0.25,
0.75
],
[
0.25,
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0.75
],
... | {
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"beta": 90,
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} | 225 | GaNi2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_PH28momBnTdoXoOe8Mhl2t0NSw-4 | [
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64,
64,
64,
64,
28,
28,
28,
28,
28,
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} | 225 | SrGdNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530150 | [
"Ni",
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67,
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67,
67,
28,
28,
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} | 225 | DyHoNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530164 | [
"Ni",
"Te",
"Hf"
] | [
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72,
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72,
28,
28,
28,
28,
28,
28,
28,
28,
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} | 225 | HfNi2Te | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_4ahUX8ks1EgRgPriT98V360CGadf | [
"Ni",
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28,
28,
28,
28,
28,
28,
28,
28,
42,
42,
42,
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} | 225 | AcNi2Mo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530214 | [
"Mg",
"Ni",
"Hf"
] | [
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72,
72,
72,
12,
12,
12,
12,
28,
28,
28,
28,
28,
28,
28,
28
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} | 225 | HfMgNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_bJ1qycv2z8AJtx32MrAvLzKz10YH | [
"Ni",
"Nb",
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] | [
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60,
60,
60,
41,
41,
41,
41,
28,
28,
28,
28,
28,
28,
28,
28
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"alpha": 90,
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} | 225 | NdNbNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_OYFagqdV6p4RkVIhTxLALgDkYCYa | [
"Ni",
"Ge",
"Zr"
] | [
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40,
40,
40,
28,
28,
28,
28,
28,
28,
28,
28,
32,
32,
32,
32
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"alpha": 90,
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} | 225 | ZrNi2Ge | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_rkd43SjD6nikhtSqZ-MZk1BxP9nY | [
"Ni",
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] | [
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90,
90,
90,
28,
28,
28,
28,
28,
28,
28,
28,
52,
52,
52,
52
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | ThNi2Te | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530285 | [
"Ni",
"W",
"Th"
] | [
90,
90,
90,
90,
28,
28,
28,
28,
28,
28,
28,
28,
74,
74,
74,
74
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | ThNi2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530298 | [
"Ni",
"Cu",
"Re"
] | [
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29,
29,
29,
75,
75,
75,
75,
28,
28,
28,
28,
28,
28,
28,
28
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | CuReNi2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_-tCdbjWTLnDn4YgaV9MTdEBMLxQD | [
"B",
"Ni",
"U"
] | [
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92,
92,
92,
28,
28,
28,
28,
28,
28,
28,
28,
5,
5,
5,
5
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"alpha": 90,
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} | 225 | UNi2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530323 | [
"Si",
"Ni",
"Rh"
] | [
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14,
14,
14,
28,
28,
28,
28,
28,
28,
28,
28,
45,
45,
45,
45
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | SiNi2Rh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530339 | [
"Sr",
"Ta",
"Pb"
] | [
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38,
38,
38,
73,
73,
73,
73,
73,
73,
73,
73,
82,
82,
82,
82
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | SrTa2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530353 | [
"Sc",
"Pr",
"Ta"
] | [
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59,
59,
59,
21,
21,
21,
21,
73,
73,
73,
73,
73,
73,
73,
73
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | PrScTa2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530371 | [
"Mg",
"V",
"Ta"
] | [
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12,
12,
12,
73,
73,
73,
73,
73,
73,
73,
73,
23,
23,
23,
23
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | MgTa2V | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530386 | [
"Si",
"Eu",
"Ta"
] | [
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63,
63,
63,
73,
73,
73,
73,
73,
73,
73,
73,
14,
14,
14,
14
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | EuTa2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_yNvi5ZvIwNIYHMfKqPgKXoqaXlH3 | [
"Rb",
"Zr",
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] | [
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37,
37,
37,
40,
40,
40,
40,
73,
73,
73,
73,
73,
73,
73,
73
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | RbZrTa2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530434 | [
"Ti",
"Te",
"Ta"
] | [
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73,
73,
73,
73,
73,
73,
73,
22,
22,
22,
22,
52,
52,
52,
52
] | 16 | 3 | [
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[
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... | {
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"c": 6.663462162017822,
"alpha": 90,
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"gamma": 90
} | 225 | Ta2TiTe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530454 | [
"Si",
"Ta",
"Bi"
] | [
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73,
73,
73,
73,
73,
73,
73,
14,
14,
14,
14,
83,
83,
83,
83
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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} | 225 | Ta2SiBi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530468 | [
"B",
"Ta",
"Pa"
] | [
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91,
91,
91,
73,
73,
73,
73,
73,
73,
73,
73,
5,
5,
5,
5
] | 16 | 3 | [
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"alpha": 90,
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"gamma": 90
} | 225 | PaTa2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530480 | [
"Si",
"K",
"Ta"
] | [
19,
19,
19,
19,
73,
73,
73,
73,
73,
73,
73,
73,
14,
14,
14,
14
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | KTa2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530496 | [
"As",
"Ta",
"Au"
] | [
73,
73,
73,
73,
73,
73,
73,
73,
33,
33,
33,
33,
79,
79,
79,
79
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | Ta2AsAu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530506 | [
"Na",
"Dy",
"Ta"
] | [
11,
11,
11,
11,
66,
66,
66,
66,
73,
73,
73,
73,
73,
73,
73,
73
] | 16 | 3 | [
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"c": 7.005623817443848,
"alpha": 90,
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"gamma": 90
} | 225 | NaDyTa2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_DcHyYHPLf-q1C-zRVTcItV2I7TN- | [
"Ca",
"Sb",
"Ta"
] | [
20,
20,
20,
20,
73,
73,
73,
73,
73,
73,
73,
73,
51,
51,
51,
51
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | CaTa2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530535 | [
"Ni",
"Ce",
"Ta"
] | [
58,
58,
58,
58,
73,
73,
73,
73,
73,
73,
73,
73,
28,
28,
28,
28
] | 16 | 3 | [
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"alpha": 90,
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"gamma": 90
} | 225 | CeTa2Ni | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_ezvsOOoXQwhwFEhcMnJw85M5EvHR | [
"Li",
"Er",
"Ta"
] | [
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3,
3,
3,
68,
68,
68,
68,
73,
73,
73,
73,
73,
73,
73,
73
] | 16 | 3 | [
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[
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"alpha": 90,
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"gamma": 90
} | 225 | LiErTa2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_530569 | [
"Ti",
"Ta",
"Tl"
] | [
73,
73,
73,
73,
73,
73,
73,
73,
22,
22,
22,
22,
81,
81,
81,
81
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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} | 225 | Ta2TiTl | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530581 | [
"Al",
"Ta",
"Hg"
] | [
73,
73,
73,
73,
73,
73,
73,
73,
13,
13,
13,
13,
80,
80,
80,
80
] | 16 | 3 | [
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[
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... | {
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"c": 6.5936598777771,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Ta2AlHg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530596 | [
"Pd",
"Ta",
"Re"
] | [
73,
73,
73,
73,
73,
73,
73,
73,
75,
75,
75,
75,
46,
46,
46,
46
] | 16 | 3 | [
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[
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[
0,
... | {
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"b": 6.420301914215088,
"c": 6.420301914215088,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Ta2RePd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_YgGx0HAj4j9YOgflnN09KqfkxlGt | [
"Gd",
"Ta",
"Pb"
] | [
64,
64,
64,
64,
73,
73,
73,
73,
73,
73,
73,
73,
82,
82,
82,
82
] | 16 | 3 | [
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... | {
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"c": 6.996293544769287,
"alpha": 90,
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"gamma": 90
} | 225 | GdTa2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530635 | [
"V",
"Rb",
"Ta"
] | [
37,
37,
37,
37,
73,
73,
73,
73,
73,
73,
73,
73,
23,
23,
23,
23
] | 16 | 3 | [
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[
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... | {
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"c": 6.805222034454346,
"alpha": 90,
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"gamma": 90
} | 225 | RbTa2V | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530650 | [
"Cs",
"Ta",
"Pa"
] | [
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55,
55,
55,
91,
91,
91,
91,
73,
73,
73,
73,
73,
73,
73,
73
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CsPaTa2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530664 | [
"Nb",
"Ta",
"U"
] | [
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92,
92,
92,
73,
73,
73,
73,
73,
73,
73,
73,
41,
41,
41,
41
] | 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,
"beta": 90,
"gamma": 90
} | 225 | UTa2Nb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530679 | [
"Rb",
"In",
"Ta"
] | [
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37,
37,
37,
73,
73,
73,
73,
73,
73,
73,
73,
49,
49,
49,
49
] | 16 | 3 | [
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0,
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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 | RbTa2In | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530700 | [
"Ho",
"Ta",
"Au"
] | [
67,
67,
67,
67,
73,
73,
73,
73,
73,
73,
73,
73,
79,
79,
79,
79
] | 16 | 3 | [
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[
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... | {
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"c": 6.735139846801758,
"alpha": 90,
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"gamma": 90
} | 225 | HoTa2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530714 | [
"Li",
"Cs",
"Ta"
] | [
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55,
55,
55,
3,
3,
3,
3,
73,
73,
73,
73,
73,
73,
73,
73
] | 16 | 3 | [
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"alpha": 90,
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"gamma": 90
} | 225 | CsLiTa2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_530731 | [
"Mg",
"Ta",
"Th"
] | [
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90,
90,
90,
12,
12,
12,
12,
73,
73,
73,
73,
73,
73,
73,
73
] | 16 | 3 | [
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[
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... | {
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"c": 6.976317882537842,
"alpha": 90,
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"gamma": 90
} | 225 | ThMgTa2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530747 | [
"V",
"As",
"Ta"
] | [
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73,
73,
73,
73,
73,
73,
73,
23,
23,
23,
23,
33,
33,
33,
33
] | 16 | 3 | [
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[
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... | {
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"c": 6.364952087402344,
"alpha": 90,
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"gamma": 90
} | 225 | Ta2VAs | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_QVksGEO7wxGdd2zKpeivoFAt5mr8 | [
"K",
"Nd",
"Ta"
] | [
19,
19,
19,
19,
60,
60,
60,
60,
73,
73,
73,
73,
73,
73,
73,
73
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | KNdTa2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_IsSv5N8HuvEcwEve57mYcizz4rxp | [
"Er",
"Ta",
"Tl"
] | [
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68,
68,
68,
73,
73,
73,
73,
73,
73,
73,
73,
81,
81,
81,
81
] | 16 | 3 | [
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[
0.25,
0.75,
0.75
],
... | {
"a": 6.922347545623779,
"b": 6.922347545623779,
"c": 6.922347545623779,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ErTa2Tl | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_530795 | [
"Y",
"In",
"Ta"
] | [
39,
39,
39,
39,
73,
73,
73,
73,
73,
73,
73,
73,
49,
49,
49,
49
] | 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": 6.938908100128174,
"b": 6.938908100128174,
"c": 6.938908100128174,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YTa2In | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
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