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_XljYExFRtOwfxQfi1Fr9-AU6W48f | [
"Al",
"Sb",
"Pa"
] | [
91,
91,
91,
91,
13,
13,
13,
13,
13,
13,
13,
13,
51,
51,
51,
51
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.75,
0.75
],
... | {
"a": 7.132465839385986,
"b": 7.132465839385986,
"c": 7.132465839385986,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PaAl2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511068 | [
"Al",
"Rb",
"Hf"
] | [
37,
37,
37,
37,
72,
72,
72,
72,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0,
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": 7.337913990020752,
"b": 7.337913990020752,
"c": 7.337913990020752,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbHfAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511085 | [
"Al",
"Ca",
"Pr"
] | [
20,
20,
20,
20,
59,
59,
59,
59,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
0
],
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 7.457761764526367,
"b": 7.457761764526367,
"c": 7.457761764526367,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CaPrAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_gMkMrcR7p--qC4KEsebAjBgz4pir | [
"Al",
"Ga",
"Tm"
] | [
69,
69,
69,
69,
13,
13,
13,
13,
13,
13,
13,
13,
31,
31,
31,
31
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
... | {
"a": 6.851865768432617,
"b": 6.851865768432617,
"c": 6.851865768432617,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TmAl2Ga | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511117 | [
"Al",
"Ac",
"Np"
] | [
89,
89,
89,
89,
93,
93,
93,
93,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
0
],
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 7.5291619300842285,
"b": 7.5291619300842285,
"c": 7.5291619300842285,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | AcNpAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511129 | [
"Al",
"Mn",
"Yb"
] | [
70,
70,
70,
70,
25,
25,
25,
25,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0,
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": 6.617958068847656,
"b": 6.617958068847656,
"c": 6.617958068847656,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YbMnAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_k5r26ovMUmt0_fQEfeihXP-PvFhl | [
"Al",
"Ti",
"Tc"
] | [
22,
22,
22,
22,
13,
13,
13,
13,
13,
13,
13,
13,
43,
43,
43,
43
] | 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": 6.21340274810791,
"b": 6.21340274810791,
"c": 6.21340274810791,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TiAl2Tc | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511164 | [
"Be",
"Al",
"Cu"
] | [
4,
4,
4,
4,
13,
13,
13,
13,
13,
13,
13,
13,
29,
29,
29,
29
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
0
],
[
0.75,
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": 5.901423931121826,
"b": 5.901423931121826,
"c": 5.901423931121826,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BeAl2Cu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511180 | [
"Al",
"Si",
"Ac"
] | [
89,
89,
89,
89,
13,
13,
13,
13,
13,
13,
13,
13,
14,
14,
14,
14
] | 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": 7.218530178070068,
"b": 7.218530178070068,
"c": 7.218530178070068,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | AcAl2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_ynXU2hIXyT9okATGkNnnb4fptSFF | [
"Al",
"Ce",
"Ta"
] | [
58,
58,
58,
58,
73,
73,
73,
73,
13,
13,
13,
13,
13,
13,
13,
13
] | 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": 6.984391212463379,
"b": 6.984391212463379,
"c": 6.984391212463379,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CeTaAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_4Ybzyvzn_BfoQuwgn1DTzty7X3lR | [
"Al",
"Ba",
"Re"
] | [
56,
56,
56,
56,
13,
13,
13,
13,
13,
13,
13,
13,
75,
75,
75,
75
] | 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": 6.985559463500977,
"b": 6.985559463500977,
"c": 6.985559463500977,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BaAl2Re | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_uZguEjKMLLFCj_MHuG3eWe1jt-78 | [
"Al",
"Rb",
"Nb"
] | [
37,
37,
37,
37,
41,
41,
41,
41,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0,
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": 7.223679542541504,
"b": 7.223679542541504,
"c": 7.223679542541504,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbNbAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511241 | [
"Li",
"Al",
"Ag"
] | [
3,
3,
3,
3,
13,
13,
13,
13,
13,
13,
13,
13,
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": 6.316279888153076,
"b": 6.316279888153076,
"c": 6.316279888153076,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LiAl2Ag | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_511255 | [
"Al",
"Sc",
"In"
] | [
21,
21,
21,
21,
13,
13,
13,
13,
13,
13,
13,
13,
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": 6.835214138031006,
"b": 6.835214138031006,
"c": 6.835214138031006,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ScAl2In | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511269 | [
"Al",
"Ca",
"In"
] | [
20,
20,
20,
20,
13,
13,
13,
13,
13,
13,
13,
13,
49,
49,
49,
49
] | 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": 7.153227806091309,
"b": 7.153227806091309,
"c": 7.153227806091309,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CaAl2In | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Mp8ak3vcwOm5TFUwF64T1gz8-TWK | [
"Al",
"Tb",
"Re"
] | [
65,
65,
65,
65,
13,
13,
13,
13,
13,
13,
13,
13,
75,
75,
75,
75
] | 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": 6.573813438415527,
"b": 6.573813438415527,
"c": 6.573813438415527,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TbAl2Re | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511302 | [
"Al",
"As",
"Ta"
] | [
73,
73,
73,
73,
13,
13,
13,
13,
13,
13,
13,
13,
33,
33,
33,
33
] | 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": 6.557569980621338,
"b": 6.557569980621338,
"c": 6.557569980621338,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TaAl2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511319 | [
"Al",
"Ru",
"Pu"
] | [
94,
94,
94,
94,
13,
13,
13,
13,
13,
13,
13,
13,
44,
44,
44,
44
] | 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": 6.560567855834961,
"b": 6.560567855834961,
"c": 6.560567855834961,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PuAl2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_CsyzkFyE-amrxojqse2-CN47EVXO | [
"Al",
"W",
"Pa"
] | [
91,
91,
91,
91,
13,
13,
13,
13,
13,
13,
13,
13,
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
],
... | {
"a": 6.677159309387207,
"b": 6.677159309387207,
"c": 6.677159309387207,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PaAl2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511342 | [
"Al",
"K",
"Ta"
] | [
19,
19,
19,
19,
73,
73,
73,
73,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
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[
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"c": 6.9501118659973145,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | KTaAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511356 | [
"Mg",
"Al",
"Cu"
] | [
12,
12,
12,
12,
13,
13,
13,
13,
13,
13,
13,
13,
29,
29,
29,
29
] | 16 | 3 | [
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0,
0,
0
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[
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"c": 6.350515842437744,
"alpha": 90,
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"gamma": 90
} | 225 | MgAl2Cu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511373 | [
"Li",
"Al",
"Zn"
] | [
3,
3,
3,
3,
13,
13,
13,
13,
13,
13,
13,
13,
30,
30,
30,
30
] | 16 | 3 | [
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0
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"c": 6.273141860961914,
"alpha": 90,
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"gamma": 90
} | 225 | LiAl2Zn | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:NOMAD_skgI8RR9K2c-BoH1aW1Q9FlpkQt3 | [
"Al",
"Fe",
"Ac"
] | [
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89,
89,
89,
13,
13,
13,
13,
13,
13,
13,
13,
26,
26,
26,
26
] | 16 | 3 | [
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0
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"alpha": 90,
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"gamma": 90
} | 225 | AcAl2Fe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_1502728 | [
"Al",
"V",
"Pt"
] | [
13,
13,
13,
13,
13,
13,
13,
13,
23,
23,
23,
23,
78,
78,
78,
78
] | 16 | 3 | [
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | Al2VPt | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511417 | [
"Na",
"Al",
"As"
] | [
11,
11,
11,
11,
13,
13,
13,
13,
13,
13,
13,
13,
33,
33,
33,
33
] | 16 | 3 | [
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0,
0,
0
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"alpha": 90,
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} | 225 | NaAl2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511434 | [
"Al",
"Sr",
"Hf"
] | [
38,
38,
38,
38,
72,
72,
72,
72,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | SrHfAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_5wSop5mNje16zyJ9OY0oTbf7LEU4 | [
"Al",
"K",
"Hg"
] | [
19,
19,
19,
19,
13,
13,
13,
13,
13,
13,
13,
13,
80,
80,
80,
80
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | KAl2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511468 | [
"Al",
"Si",
"Ca"
] | [
20,
20,
20,
20,
13,
13,
13,
13,
13,
13,
13,
13,
14,
14,
14,
14
] | 16 | 3 | [
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0
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[
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"c": 6.853477954864502,
"alpha": 90,
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} | 225 | CaAl2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Cg-mXF2nwoTfUXr0dyE64Q-zcgI4 | [
"Al",
"Tc",
"Ru"
] | [
13,
13,
13,
13,
13,
13,
13,
13,
43,
43,
43,
43,
44,
44,
44,
44
] | 16 | 3 | [
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[
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... | {
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"c": 6.059706211090088,
"alpha": 90,
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"gamma": 90
} | 225 | Al2TcRu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_cmWxoQzu-NXv0EsG-h90aVF0UBHN | [
"Al",
"Cs",
"Hg"
] | [
55,
55,
55,
55,
13,
13,
13,
13,
13,
13,
13,
13,
80,
80,
80,
80
] | 16 | 3 | [
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | CsAl2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511514 | [
"Li",
"Al",
"Tm"
] | [
3,
3,
3,
3,
69,
69,
69,
69,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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[
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... | {
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"c": 6.778602123260498,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LiTmAl2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_511535 | [
"Al",
"La",
"Pu"
] | [
57,
57,
57,
57,
94,
94,
94,
94,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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[
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"alpha": 90,
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} | 225 | LaPuAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_n8klHAzQ5i-84FEw-9zcZUr44SJN | [
"Al",
"Nb",
"Os"
] | [
41,
41,
41,
41,
13,
13,
13,
13,
13,
13,
13,
13,
76,
76,
76,
76
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | NbAl2Os | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511560 | [
"Al",
"Rb",
"Nd"
] | [
37,
37,
37,
37,
60,
60,
60,
60,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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[
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... | {
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"c": 7.859405994415283,
"alpha": 90,
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} | 225 | RbNdAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_XkrmfmBJHq-Q-A2bE0iL5Tenpn2a | [
"Al",
"Si",
"Y"
] | [
39,
39,
39,
39,
13,
13,
13,
13,
13,
13,
13,
13,
14,
14,
14,
14
] | 16 | 3 | [
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"alpha": 90,
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"gamma": 90
} | 225 | YAl2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511592 | [
"Al",
"K",
"Rb"
] | [
19,
19,
19,
19,
37,
37,
37,
37,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | KRbAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_B5WtzHKr2usub796DPEGndxN5M_A | [
"Al",
"Ti",
"U"
] | [
92,
92,
92,
92,
22,
22,
22,
22,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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[
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | UTiAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511620 | [
"Al",
"Pm",
"Pu"
] | [
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61,
61,
61,
94,
94,
94,
94,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | PmPuAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511631 | [
"Al",
"Fe",
"In"
] | [
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13,
13,
13,
13,
13,
13,
13,
49,
49,
49,
49,
26,
26,
26,
26
] | 16 | 3 | [
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[
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[
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... | {
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"alpha": 90,
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"gamma": 90
} | 225 | Al2InFe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511665 | [
"Al",
"K",
"Dy"
] | [
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19,
19,
19,
66,
66,
66,
66,
13,
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tar:OQMD_511680 | [
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tar:NOMAD_LMQjwMOnkdISxF6Fh11DRFrhSZzM | [
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tar:OQMD_511715 | [
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28,
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tar:NOMAD_FXnX1bVS6jR-LESDS76nQ2S4Jy3P | [
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13,
13,
13,
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} | 225 | CeAl2Ge | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_dEbCX9-sQpza5oKQQC-fM09nB2jP | [
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13,
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13,
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} | 225 | TmAl2Tc | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_mO9Bu-cg04vWMAN83Eca5SOvMXEw | [
"Al",
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13,
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13,
45,
45,
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} | 225 | Al2RhW | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_VTkbxtlXQtpy3Q-XL8CXGIKDtQPG | [
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59,
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} | 225 | LaPrAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_oTJDxJ0_ljXh9NW8na6klnvjSfG6 | [
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} | 225 | SmNbAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511819 | [
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22,
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22,
13,
13,
13,
13,
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} | 225 | TiAl2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_zlACYnVNQDnxCaVZ3qIDHYrnFDjQ | [
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13,
13,
13,
13,
13,
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} | 225 | YbAl2Cd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511855 | [
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] | [
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40,
13,
13,
13,
13,
13,
13,
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} | 225 | ZrAl2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_bb2fNRBGNDjUGA7dVPw3UoPOHtIG | [
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61,
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59,
59,
59,
13,
13,
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13,
13,
13,
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} | 225 | PmPrAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_6sL1jhlOd9_omDiDboEvdsY2fNaW | [
"Al",
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37,
13,
13,
13,
13,
13,
13,
13,
13,
52,
52,
52,
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} | 225 | RbAl2Te | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511897 | [
"Al",
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] | [
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13,
13,
13,
13,
13,
13,
13,
47,
47,
47,
47,
52,
52,
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} | 225 | Al2AgTe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511907 | [
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] | [
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92,
13,
13,
13,
13,
13,
13,
13,
13,
78,
78,
78,
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] | 16 | 3 | [
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} | 225 | UAl2Pt | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511926 | [
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] | [
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11,
11,
11,
13,
13,
13,
13,
13,
13,
13,
13,
80,
80,
80,
80
] | 16 | 3 | [
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} | 225 | NaAl2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_1mLOJSZdLQCI6jlDYpn5EHR-X-SO | [
"Al",
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] | [
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59,
59,
59,
13,
13,
13,
13,
13,
13,
13,
13,
52,
52,
52,
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} | 225 | PrAl2Te | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511951 | [
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] | [
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41,
41,
41,
13,
13,
13,
13,
13,
13,
13,
13,
79,
79,
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] | 16 | 3 | [
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} | 225 | NbAl2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_A6zBKIbgFW1rEJNxIRqb9RaVYZRk | [
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] | [
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91,
13,
13,
13,
13,
13,
13,
13,
13,
50,
50,
50,
50
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"gamma": 90
} | 225 | PaAl2Sn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511980 | [
"Al",
"Pa",
"Np"
] | [
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93,
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93,
91,
91,
91,
91,
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13,
13,
13,
13,
13,
13,
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} | 225 | NpPaAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_511993 | [
"Al",
"Ge",
"Pd"
] | [
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13,
13,
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13,
13,
13,
13,
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32,
32,
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46,
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} | 225 | Al2GePd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_A54ExdjRl4jX0btN9C77D856yUPF | [
"Al",
"Pb",
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] | [
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90,
90,
90,
13,
13,
13,
13,
13,
13,
13,
13,
82,
82,
82,
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"alpha": 90,
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} | 225 | ThAl2Pb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_XKzXOHcyJagovnloAPHlb6aeUGIr | [
"Al",
"As",
"Tm"
] | [
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69,
69,
69,
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13,
13,
13,
13,
13,
13,
13,
33,
33,
33,
33
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"alpha": 90,
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} | 225 | TmAl2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512038 | [
"Al",
"Ho",
"Ac"
] | [
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89,
89,
89,
67,
67,
67,
67,
13,
13,
13,
13,
13,
13,
13,
13
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"alpha": 90,
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} | 225 | AcHoAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512053 | [
"Al",
"Ru",
"Dy"
] | [
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66,
66,
66,
13,
13,
13,
13,
13,
13,
13,
13,
44,
44,
44,
44
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | DyAl2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512070 | [
"Al",
"Rh",
"Tl"
] | [
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13,
13,
13,
13,
13,
13,
13,
81,
81,
81,
81,
45,
45,
45,
45
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | Al2TlRh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512081 | [
"Al",
"Pm",
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] | [
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61,
61,
61,
13,
13,
13,
13,
13,
13,
13,
13,
83,
83,
83,
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] | 16 | 3 | [
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"alpha": 90,
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} | 225 | PmAl2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_knJGMvN3gm26jO8o9FzashtZhg0c | [
"Al",
"Hf",
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] | [
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72,
72,
72,
13,
13,
13,
13,
13,
13,
13,
13,
74,
74,
74,
74
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | HfAl2W | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512115 | [
"Al",
"Ir",
"Bi"
] | [
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13,
13,
13,
13,
13,
13,
13,
83,
83,
83,
83,
77,
77,
77,
77
] | 16 | 3 | [
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... | {
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"alpha": 90,
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} | 225 | Al2BiIr | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512128 | [
"Al",
"Y",
"Tc"
] | [
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39,
39,
39,
13,
13,
13,
13,
13,
13,
13,
13,
43,
43,
43,
43
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | YAl2Tc | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512141 | [
"Al",
"Ho",
"Pu"
] | [
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67,
67,
67,
94,
94,
94,
94,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | HoPuAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512156 | [
"B",
"Al",
"Cs"
] | [
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55,
55,
55,
13,
13,
13,
13,
13,
13,
13,
13,
5,
5,
5,
5
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | CsAl2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512175 | [
"Al",
"Pd",
"Te"
] | [
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13,
13,
13,
13,
13,
13,
13,
52,
52,
52,
52,
46,
46,
46,
46
] | 16 | 3 | [
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[
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... | {
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"alpha": 90,
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} | 225 | Al2TePd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512185 | [
"Al",
"Ge",
"Ag"
] | [
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13,
13,
13,
13,
13,
13,
13,
47,
47,
47,
47,
32,
32,
32,
32
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | Al2AgGe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_pFLzIeysP1fx2m2n7Jz5Y9FVxe6D | [
"Al",
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] | [
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64,
64,
64,
91,
91,
91,
91,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | GdPaAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512217 | [
"Al",
"Ba",
"Ho"
] | [
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56,
56,
56,
67,
67,
67,
67,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | BaHoAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512228 | [
"Al",
"Hg",
"Pu"
] | [
94,
94,
94,
94,
13,
13,
13,
13,
13,
13,
13,
13,
80,
80,
80,
80
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | PuAl2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_OR06gPEfKFzi4FPTeqHGu5zNvcjD | [
"Al",
"Sc",
"Tb"
] | [
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65,
65,
65,
21,
21,
21,
21,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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"alpha": 90,
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} | 225 | TbScAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_tWVaDVqSBh3-UaNsHwoUY73hztCn | [
"Al",
"Hf",
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] | [
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72,
72,
72,
92,
92,
92,
92,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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"c": 6.890251636505127,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | HfUAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_Qhbikwlok60HRTsgMHWRRoUj3YdT | [
"Al",
"Zn",
"Rb"
] | [
37,
37,
37,
37,
13,
13,
13,
13,
13,
13,
13,
13,
30,
30,
30,
30
] | 16 | 3 | [
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0,
0.5,
0
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[
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"c": 7.244659900665283,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbAl2Zn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_6D1UbeFcgjFohffRaJm6uvFDETLS | [
"Al",
"Fe",
"Cu"
] | [
13,
13,
13,
13,
13,
13,
13,
13,
26,
26,
26,
26,
29,
29,
29,
29
] | 16 | 3 | [
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[
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[
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... | {
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"c": 5.839568138122559,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Al2FeCu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512328 | [
"Na",
"Al",
"Sn"
] | [
11,
11,
11,
11,
13,
13,
13,
13,
13,
13,
13,
13,
50,
50,
50,
50
] | 16 | 3 | [
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0,
0.5,
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[
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... | {
"a": 7.081476211547852,
"b": 7.081476211547852,
"c": 7.081476211547852,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NaAl2Sn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_JEa1DqXPYX9NuHUYSA5oXCfXr6xm | [
"Al",
"K",
"Co"
] | [
19,
19,
19,
19,
13,
13,
13,
13,
13,
13,
13,
13,
27,
27,
27,
27
] | 16 | 3 | [
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... | {
"a": 6.625002861022949,
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"c": 6.625002861022949,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | KAl2Co | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512357 | [
"Al",
"Cu",
"Pt"
] | [
13,
13,
13,
13,
13,
13,
13,
13,
29,
29,
29,
29,
78,
78,
78,
78
] | 16 | 3 | [
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[
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[
0.75,
0.25,
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[
0,
... | {
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"c": 6.062471866607666,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Al2CuPt | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512370 | [
"Al",
"Sc",
"Sm"
] | [
62,
62,
62,
62,
21,
21,
21,
21,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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0,
0,
0
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[
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[
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[
0.25,
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[
0.25,
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... | {
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"b": 7.0528059005737305,
"c": 7.0528059005737305,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SmScAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512385 | [
"Al",
"Rb",
"Au"
] | [
37,
37,
37,
37,
13,
13,
13,
13,
13,
13,
13,
13,
79,
79,
79,
79
] | 16 | 3 | [
[
0,
0,
0
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[
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0.25
],
[
0.75,
0.75,
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... | {
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"b": 7.114952087402344,
"c": 7.114952087402344,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbAl2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_NG30hgzFFL2Mh3dag1XR4qxJdWsm | [
"Al",
"Lu",
"Ta"
] | [
71,
71,
71,
71,
73,
73,
73,
73,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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0,
0.5,
0
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[
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... | {
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"c": 6.709585189819336,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LuTaAl2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512417 | [
"Li",
"Al",
"Zr"
] | [
3,
3,
3,
3,
40,
40,
40,
40,
13,
13,
13,
13,
13,
13,
13,
13
] | 16 | 3 | [
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0,
0.5,
0
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[
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[
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0.75,
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[
0.25,
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... | {
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"b": 6.562009811401367,
"c": 6.562009811401367,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LiZrAl2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_512440 | [
"Na",
"Nb",
"Hg"
] | [
11,
11,
11,
11,
41,
41,
41,
41,
80,
80,
80,
80,
80,
80,
80,
80
] | 16 | 3 | [
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0,
0.5,
0
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[
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... | {
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"c": 6.939166069030762,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NaNbHg2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512459 | [
"Ti",
"Ce",
"Hg"
] | [
58,
58,
58,
58,
22,
22,
22,
22,
80,
80,
80,
80,
80,
80,
80,
80
] | 16 | 3 | [
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0.5,
0
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[
0.5,
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0.75,
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[
0.25,
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... | {
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"b": 7.23330020904541,
"c": 7.23330020904541,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CeTiHg2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512475 | [
"Ge",
"Ta",
"Hg"
] | [
73,
73,
73,
73,
80,
80,
80,
80,
80,
80,
80,
80,
32,
32,
32,
32
] | 16 | 3 | [
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0,
0,
0
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[
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[
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... | {
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"c": 6.951298236846924,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TaHg2Ge | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512487 | [
"Ge",
"Nd",
"Hg"
] | [
60,
60,
60,
60,
80,
80,
80,
80,
80,
80,
80,
80,
32,
32,
32,
32
] | 16 | 3 | [
[
0,
0,
0
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[
0,
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[
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[
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[
0.25,
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[
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... | {
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"b": 7.338833808898926,
"c": 7.338833808898926,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdHg2Ge | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512503 | [
"Tm",
"Ta",
"Hg"
] | [
69,
69,
69,
69,
73,
73,
73,
73,
80,
80,
80,
80,
80,
80,
80,
80
] | 16 | 3 | [
[
0,
0,
0
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[
0.5,
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[
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[
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[
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[
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[
0.25,
0.75,
0.75
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[
0.25,
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... | {
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"c": 6.966506004333496,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TmTaHg2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512528 | [
"Nb",
"Hg",
"Tl"
] | [
41,
41,
41,
41,
81,
81,
81,
81,
80,
80,
80,
80,
80,
80,
80,
80
] | 16 | 3 | [
[
0,
0.5,
0
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[
0.5,
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[
0.75,
0.75,
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[
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... | {
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"c": 7.0235819816589355,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NbTlHg2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512545 | [
"Tc",
"Yb",
"Hg"
] | [
70,
70,
70,
70,
43,
43,
43,
43,
80,
80,
80,
80,
80,
80,
80,
80
] | 16 | 3 | [
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0,
0,
0
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[
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[
0.5,
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[
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[
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[
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[
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0.5
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[
0.25,
0.75,
0.75
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[
0.25,
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... | {
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"b": 6.8619160652160645,
"c": 6.8619160652160645,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YbTcHg2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512560 | [
"Mg",
"Ta",
"Hg"
] | [
12,
12,
12,
12,
73,
73,
73,
73,
80,
80,
80,
80,
80,
80,
80,
80
] | 16 | 3 | [
[
0,
0.5,
0
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[
0,
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[
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[
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[
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[
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],
[
0.75,
0.75,
0.25
],
[
0.25,
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... | {
"a": 6.778182029724121,
"b": 6.778182029724121,
"c": 6.778182029724121,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | MgTaHg2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_VSC60byANxao-lLFCmo7zs_XZEIY | [
"Sn",
"Cs",
"Hg"
] | [
55,
55,
55,
55,
50,
50,
50,
50,
80,
80,
80,
80,
80,
80,
80,
80
] | 16 | 3 | [
[
0,
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0
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[
0,
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[
0.5,
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0.5
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[
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[
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[
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[
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[
0.75,
0.75,
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[
0.25,
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... | {
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"b": 8.098931312561035,
"c": 8.098931312561035,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CsSnHg2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512596 | [
"Nd",
"Tm",
"Hg"
] | [
60,
60,
60,
60,
69,
69,
69,
69,
80,
80,
80,
80,
80,
80,
80,
80
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
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[
0.5,
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[
0.5,
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[
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[
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[
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[
0.5,
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0
],
[
0.75,
0.75,
0.25
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[
0.25,
0.75,
... | {
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"c": 7.414939880371094,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdTmHg2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512609 | [
"Ni",
"Rb",
"Hg"
] | [
37,
37,
37,
37,
28,
28,
28,
28,
80,
80,
80,
80,
80,
80,
80,
80
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
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0.5
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[
0.5,
0,
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],
[
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0
],
[
0,
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],
[
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0
],
[
0.5,
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[
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[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
... | {
"a": 7.604385852813721,
"b": 7.604385852813721,
"c": 7.604385852813721,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbNiHg2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_512637 | [
"Tc",
"Pd",
"Hg"
] | [
43,
43,
43,
43,
80,
80,
80,
80,
80,
80,
80,
80,
46,
46,
46,
46
] | 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": 6.577447891235352,
"b": 6.577447891235352,
"c": 6.577447891235352,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TcHg2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
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