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_1sCaDJo2nvHVvcc5PWtVz1mBOEw8 | [
"Be",
"Y",
"Hf"
] | [
39,
39,
39,
39,
72,
72,
72,
72,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.508118152618408,
"b": 6.508118152618408,
"c": 6.508118152618408,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YHfBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_F0yVXl9V8dk-2SUVkORW32JoGc_1 | [
"Be",
"K",
"Fe"
] | [
19,
19,
19,
19,
4,
4,
4,
4,
4,
4,
4,
4,
26,
26,
26,
26
] | 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": 6.261327266693115,
"b": 6.261327266693115,
"c": 6.261327266693115,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | KBe2Fe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_499897 | [
"Be",
"Ti",
"Tl"
] | [
22,
22,
22,
22,
4,
4,
4,
4,
4,
4,
4,
4,
81,
81,
81,
81
] | 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": 6.082047939300537,
"b": 6.082047939300537,
"c": 6.082047939300537,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TiBe2Tl | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_499912 | [
"Be",
"Rh",
"Dy"
] | [
66,
66,
66,
66,
4,
4,
4,
4,
4,
4,
4,
4,
45,
45,
45,
45
] | 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": 6.126649856567383,
"b": 6.126649856567383,
"c": 6.126649856567383,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | DyBe2Rh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_499929 | [
"Be",
"Fe",
"Pd"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
26,
26,
26,
26,
46,
46,
46,
46
] | 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": 5.426653861999512,
"b": 5.426653861999512,
"c": 5.426653861999512,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2FePd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_499943 | [
"Be",
"Pr",
"Yb"
] | [
70,
70,
70,
70,
59,
59,
59,
59,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 7.034947872161865,
"b": 7.034947872161865,
"c": 7.034947872161865,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YbPrBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_499959 | [
"Be",
"Cs",
"Sm"
] | [
55,
55,
55,
55,
62,
62,
62,
62,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 7.540939807891846,
"b": 7.540939807891846,
"c": 7.540939807891846,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CsSmBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_499975 | [
"Be",
"Nb",
"Sn"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
41,
41,
41,
41,
50,
50,
50,
50
] | 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": 6.126294136047363,
"b": 6.126294136047363,
"c": 6.126294136047363,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2NbSn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_499994 | [
"Be",
"Pm",
"Pa"
] | [
61,
61,
61,
61,
91,
91,
91,
91,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.815857887268066,
"b": 6.815857887268066,
"c": 6.815857887268066,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PmPaBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500005 | [
"Be",
"Pr",
"Au"
] | [
59,
59,
59,
59,
4,
4,
4,
4,
4,
4,
4,
4,
79,
79,
79,
79
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
... | {
"a": 6.44775390625,
"b": 6.44775390625,
"c": 6.44775390625,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PrBe2Au | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500018 | [
"Be",
"Sn",
"Pr"
] | [
59,
59,
59,
59,
4,
4,
4,
4,
4,
4,
4,
4,
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": 6.657365798950195,
"b": 6.657365798950195,
"c": 6.657365798950195,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PrBe2Sn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500036 | [
"Be",
"Pd",
"Ba"
] | [
56,
56,
56,
56,
4,
4,
4,
4,
4,
4,
4,
4,
46,
46,
46,
46
] | 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": 6.7549920082092285,
"b": 6.7549920082092285,
"c": 6.7549920082092285,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BaBe2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500069 | [
"Be",
"Ba",
"Ta"
] | [
56,
56,
56,
56,
73,
73,
73,
73,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.756529808044434,
"b": 6.756529808044434,
"c": 6.756529808044434,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BaTaBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500085 | [
"Be",
"Nb",
"Tm"
] | [
69,
69,
69,
69,
4,
4,
4,
4,
4,
4,
4,
4,
41,
41,
41,
41
] | 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": 6.3029022216796875,
"b": 6.3029022216796875,
"c": 6.3029022216796875,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TmBe2Nb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500100 | [
"Be",
"Ba",
"Bi"
] | [
56,
56,
56,
56,
4,
4,
4,
4,
4,
4,
4,
4,
83,
83,
83,
83
] | 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": 7.235775947570801,
"b": 7.235775947570801,
"c": 7.235775947570801,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BaBe2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500115 | [
"Be",
"Lu",
"Hg"
] | [
71,
71,
71,
71,
4,
4,
4,
4,
4,
4,
4,
4,
80,
80,
80,
80
] | 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": 6.303974151611328,
"b": 6.303974151611328,
"c": 6.303974151611328,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LuBe2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500127 | [
"Be",
"Lu",
"Tl"
] | [
71,
71,
71,
71,
4,
4,
4,
4,
4,
4,
4,
4,
81,
81,
81,
81
] | 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": 6.430047988891602,
"b": 6.430047988891602,
"c": 6.430047988891602,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LuBe2Tl | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500145 | [
"Be",
"Sc",
"Zn"
] | [
21,
21,
21,
21,
4,
4,
4,
4,
4,
4,
4,
4,
30,
30,
30,
30
] | 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": 5.890202045440674,
"b": 5.890202045440674,
"c": 5.890202045440674,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ScBe2Zn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500164 | [
"Be",
"Pd",
"Np"
] | [
93,
93,
93,
93,
4,
4,
4,
4,
4,
4,
4,
4,
46,
46,
46,
46
] | 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": 6.0917558670043945,
"b": 6.0917558670043945,
"c": 6.0917558670043945,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NpBe2Pd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500180 | [
"Be",
"Ga",
"Ru"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
31,
31,
31,
31,
44,
44,
44,
44
] | 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
],
[
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0.25,
0.25
],
[
0,
... | {
"a": 5.608724117279053,
"b": 5.608724117279053,
"c": 5.608724117279053,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2GaRu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500195 | [
"Be",
"Ru",
"Tm"
] | [
69,
69,
69,
69,
4,
4,
4,
4,
4,
4,
4,
4,
44,
44,
44,
44
] | 16 | 3 | [
[
0,
0,
0
],
[
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0.5,
0.5
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[
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[
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[
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[
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[
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0.25
],
[
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],
[
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... | {
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"b": 6.057894229888916,
"c": 6.057894229888916,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TmBe2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500209 | [
"Be",
"Ca",
"Th"
] | [
20,
20,
20,
20,
90,
90,
90,
90,
4,
4,
4,
4,
4,
4,
4,
4
] | 16 | 3 | [
[
0,
0.5,
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
],
[
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[
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[
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],
[
0.75,
0.75,
0.25
],
[
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... | {
"a": 6.999733924865723,
"b": 6.999733924865723,
"c": 6.999733924865723,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CaThBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500225 | [
"Be",
"Ge",
"Pr"
] | [
59,
59,
59,
59,
4,
4,
4,
4,
4,
4,
4,
4,
32,
32,
32,
32
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
0.5,
0,
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[
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[
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[
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],
[
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0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
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0.75,
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],
... | {
"a": 6.42588996887207,
"b": 6.42588996887207,
"c": 6.42588996887207,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PrBe2Ge | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_fpSOfaXmvOyfQWOcmxEUz2wyIRB_ | [
"Be",
"K",
"Bi"
] | [
19,
19,
19,
19,
4,
4,
4,
4,
4,
4,
4,
4,
83,
83,
83,
83
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
0.5,
0,
0.5
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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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0.25,
0.25
],
[
0.25,
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],
[
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],
... | {
"a": 7.064476490020752,
"b": 7.064476490020752,
"c": 7.064476490020752,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | KBe2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500254 | [
"Be",
"Re",
"Th"
] | [
90,
90,
90,
90,
4,
4,
4,
4,
4,
4,
4,
4,
75,
75,
75,
75
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
0.5,
0,
0.5
],
[
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0
],
[
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[
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[
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],
[
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0.25
],
[
0.75,
0.75,
0.25
],
... | {
"a": 6.360132217407227,
"b": 6.360132217407227,
"c": 6.360132217407227,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ThBe2Re | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500268 | [
"Be",
"Zn",
"Nd"
] | [
60,
60,
60,
60,
4,
4,
4,
4,
4,
4,
4,
4,
30,
30,
30,
30
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
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[
0.5,
0.5,
0.5
],
[
0.5,
0,
0
],
[
0.75,
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[
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[
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0.25,
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],
[
0.25,
0.25,
0.75
],
[
0.25,
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],
... | {
"a": 6.348199844360352,
"b": 6.348199844360352,
"c": 6.348199844360352,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdBe2Zn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500281 | [
"Be",
"Fe",
"Co"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
26,
26,
26,
26,
27,
27,
27,
27
] | 16 | 3 | [
[
0.25,
0.75,
0.75
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[
0.25,
0.25,
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[
0.25,
0.25,
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[
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[
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[
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],
[
0.75,
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[
0.75,
0.75,
0.75
],
[
0,
... | {
"a": 5.185108184814453,
"b": 5.185108184814453,
"c": 5.185108184814453,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2FeCo | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500298 | [
"Li",
"Be",
"Cd"
] | [
3,
3,
3,
3,
4,
4,
4,
4,
4,
4,
4,
4,
48,
48,
48,
48
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
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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,
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],
... | {
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"b": 5.783574104309082,
"c": 5.783574104309082,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LiBe2Cd | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_500313 | [
"Be",
"V",
"Nd"
] | [
60,
60,
60,
60,
4,
4,
4,
4,
4,
4,
4,
4,
23,
23,
23,
23
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
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[
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0.5
],
[
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0,
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[
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[
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[
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],
[
0.25,
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0.75
],
[
0.25,
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],
... | {
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"b": 6.3613362312316895,
"c": 6.3613362312316895,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdBe2V | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500327 | [
"Be",
"Te",
"Os"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
52,
52,
52,
52,
76,
76,
76,
76
] | 16 | 3 | [
[
0.25,
0.75,
0.75
],
[
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[
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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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[
0.75,
0.75,
0.75
],
[
0,
... | {
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"b": 6.035459995269775,
"c": 6.035459995269775,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2TeOs | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500340 | [
"Be",
"B",
"Pr"
] | [
59,
59,
59,
59,
4,
4,
4,
4,
4,
4,
4,
4,
5,
5,
5,
5
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
0.5,
0,
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],
[
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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": 6.005238056182861,
"c": 6.005238056182861,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PrBe2B | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500375 | [
"Be",
"V",
"Cd"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
23,
23,
23,
23,
48,
48,
48,
48
] | 16 | 3 | [
[
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0.75,
0.75
],
[
0.25,
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[
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[
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],
[
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],
[
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],
[
0.75,
0.75,
0.75
],
[
0,
... | {
"a": 5.833456039428711,
"b": 5.833456039428711,
"c": 5.833456039428711,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2VCd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500389 | [
"Li",
"Be",
"Ga"
] | [
3,
3,
3,
3,
4,
4,
4,
4,
4,
4,
4,
4,
31,
31,
31,
31
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
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,
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],
... | {
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"b": 5.592964172363281,
"c": 5.592964172363281,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LiBe2Ga | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_500404 | [
"Be",
"Si",
"Hf"
] | [
72,
72,
72,
72,
4,
4,
4,
4,
4,
4,
4,
4,
14,
14,
14,
14
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
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],
[
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[
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[
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],
[
0.25,
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],
[
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],
... | {
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"b": 5.881584167480469,
"c": 5.881584167480469,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | HfBe2Si | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500421 | [
"Be",
"K",
"Pr"
] | [
19,
19,
19,
19,
59,
59,
59,
59,
4,
4,
4,
4,
4,
4,
4,
4
] | 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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],
[
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],
[
0.75,
0.75,
0.25
],
[
0.25,
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... | {
"a": 7.28874397277832,
"b": 7.28874397277832,
"c": 7.28874397277832,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | KPrBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500434 | [
"Be",
"Bi",
"Pa"
] | [
91,
91,
91,
91,
4,
4,
4,
4,
4,
4,
4,
4,
83,
83,
83,
83
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
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],
[
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],
[
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],
[
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],
[
0.25,
0.75,
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],
[
0.75,
0.75,
0.25
],
... | {
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"b": 6.669506072998047,
"c": 6.669506072998047,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PaBe2Bi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500449 | [
"Be",
"Al",
"Cu"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
13,
13,
13,
13,
29,
29,
29,
29
] | 16 | 3 | [
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
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],
[
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0.25,
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],
[
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],
[
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[
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],
[
0.25,
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],
[
0.75,
0.25,
0.25
],
[
0,
... | {
"a": 5.523838043212891,
"b": 5.523838043212891,
"c": 5.523838043212891,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2AlCu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500469 | [
"Be",
"Te",
"Yb"
] | [
70,
70,
70,
70,
4,
4,
4,
4,
4,
4,
4,
4,
52,
52,
52,
52
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
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0
],
[
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[
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[
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],
[
0.25,
0.75,
0.25
],
[
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],
... | {
"a": 6.715402126312256,
"b": 6.715402126312256,
"c": 6.715402126312256,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YbBe2Te | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500486 | [
"Be",
"Al",
"Lu"
] | [
71,
71,
71,
71,
4,
4,
4,
4,
4,
4,
4,
4,
13,
13,
13,
13
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
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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": 6.1276397705078125,
"c": 6.1276397705078125,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LuBe2Al | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500498 | [
"Be",
"Ni",
"Ta"
] | [
73,
73,
73,
73,
4,
4,
4,
4,
4,
4,
4,
4,
28,
28,
28,
28
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
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0
],
[
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],
[
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],
[
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],
[
0.25,
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0.25
],
[
0.75,
0.75,
0.25
],
... | {
"a": 5.606637954711914,
"b": 5.606637954711914,
"c": 5.606637954711914,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TaBe2Ni | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500515 | [
"Be",
"Ca",
"La"
] | [
20,
20,
20,
20,
57,
57,
57,
57,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 7.1255998611450195,
"b": 7.1255998611450195,
"c": 7.1255998611450195,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CaLaBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500527 | [
"Be",
"Lu",
"Ir"
] | [
71,
71,
71,
71,
4,
4,
4,
4,
4,
4,
4,
4,
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": 6.000648021697998,
"b": 6.000648021697998,
"c": 6.000648021697998,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LuBe2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500542 | [
"Be",
"Na",
"Ta"
] | [
11,
11,
11,
11,
73,
73,
73,
73,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.087421894073486,
"b": 6.087421894073486,
"c": 6.087421894073486,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NaTaBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_-05un87X92HoJnBcDXqw5z69jOXc | [
"Be",
"Mg",
"Mn"
] | [
12,
12,
12,
12,
25,
25,
25,
25,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 5.631551742553711,
"b": 5.631551742553711,
"c": 5.631551742553711,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | MgMnBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500569 | [
"Be",
"Zn",
"Re"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
30,
30,
30,
30,
75,
75,
75,
75
] | 16 | 3 | [
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
[
0.75,
0.25,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.75,
0.75,
0.75
],
[
0,
... | {
"a": 5.615717887878418,
"b": 5.615717887878418,
"c": 5.615717887878418,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2ZnRe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500584 | [
"Be",
"Ti",
"Cu"
] | [
22,
22,
22,
22,
4,
4,
4,
4,
4,
4,
4,
4,
29,
29,
29,
29
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
0.5,
0.5,
0
],
[
0.25,
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": 5.578728199005127,
"b": 5.578728199005127,
"c": 5.578728199005127,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TiBe2Cu | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500598 | [
"Be",
"Ta",
"Th"
] | [
90,
90,
90,
90,
73,
73,
73,
73,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.528145790100098,
"b": 6.528145790100098,
"c": 6.528145790100098,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ThTaBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500612 | [
"Li",
"Be",
"Gd"
] | [
3,
3,
3,
3,
64,
64,
64,
64,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.3744378089904785,
"b": 6.3744378089904785,
"c": 6.3744378089904785,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LiGdBe2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_500625 | [
"Be",
"Ti",
"Zn"
] | [
22,
22,
22,
22,
4,
4,
4,
4,
4,
4,
4,
4,
30,
30,
30,
30
] | 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": 5.683824062347412,
"b": 5.683824062347412,
"c": 5.683824062347412,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TiBe2Zn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500638 | [
"Be",
"Fe",
"Ba"
] | [
56,
56,
56,
56,
4,
4,
4,
4,
4,
4,
4,
4,
26,
26,
26,
26
] | 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": 6.694744110107422,
"b": 6.694744110107422,
"c": 6.694744110107422,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BaBe2Fe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500652 | [
"Be",
"Tb",
"Os"
] | [
65,
65,
65,
65,
4,
4,
4,
4,
4,
4,
4,
4,
76,
76,
76,
76
] | 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": 6.12736177444458,
"b": 6.12736177444458,
"c": 6.12736177444458,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TbBe2Os | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500665 | [
"Be",
"Cd",
"U"
] | [
92,
92,
92,
92,
4,
4,
4,
4,
4,
4,
4,
4,
48,
48,
48,
48
] | 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": 6.346595764160156,
"b": 6.346595764160156,
"c": 6.346595764160156,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | UBe2Cd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500679 | [
"Be",
"Sc",
"Dy"
] | [
66,
66,
66,
66,
21,
21,
21,
21,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.57815408706665,
"b": 6.57815408706665,
"c": 6.57815408706665,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | DyScBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500689 | [
"Be",
"Nb",
"Lu"
] | [
71,
71,
71,
71,
4,
4,
4,
4,
4,
4,
4,
4,
41,
41,
41,
41
] | 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": 6.274466037750244,
"b": 6.274466037750244,
"c": 6.274466037750244,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LuBe2Nb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_jZVevZw9WaVBleKHKzx3TzY0Wmsu | [
"Be",
"Ca",
"V"
] | [
20,
20,
20,
20,
4,
4,
4,
4,
4,
4,
4,
4,
23,
23,
23,
23
] | 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": 6.250946521759033,
"b": 6.250946521759033,
"c": 6.250946521759033,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CaBe2V | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500715 | [
"Be",
"Ti",
"Ta"
] | [
73,
73,
73,
73,
22,
22,
22,
22,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 5.916079998016357,
"b": 5.916079998016357,
"c": 5.916079998016357,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TaTiBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500730 | [
"Be",
"Yb",
"Pa"
] | [
70,
70,
70,
70,
91,
91,
91,
91,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.730134010314941,
"b": 6.730134010314941,
"c": 6.730134010314941,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YbPaBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500748 | [
"Be",
"K",
"U"
] | [
19,
19,
19,
19,
92,
92,
92,
92,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 7.007053852081299,
"b": 7.007053852081299,
"c": 7.007053852081299,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | KUBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500762 | [
"Be",
"Ru",
"Er"
] | [
68,
68,
68,
68,
4,
4,
4,
4,
4,
4,
4,
4,
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": 6.076879978179932,
"b": 6.076879978179932,
"c": 6.076879978179932,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ErBe2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500779 | [
"Be",
"Sm",
"Ho"
] | [
62,
62,
62,
62,
67,
67,
67,
67,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.867839813232422,
"b": 6.867839813232422,
"c": 6.867839813232422,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SmHoBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500792 | [
"Be",
"Ho",
"Tl"
] | [
67,
67,
67,
67,
4,
4,
4,
4,
4,
4,
4,
4,
81,
81,
81,
81
] | 16 | 3 | [
[
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0.5,
0
],
[
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0,
0.5
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[
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0.5,
0.5
],
[
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0,
0
],
[
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[
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],
[
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],
[
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],
[
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],
... | {
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"b": 6.48399019241333,
"c": 6.48399019241333,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | HoBe2Tl | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500808 | [
"Be",
"Ag",
"Ba"
] | [
56,
56,
56,
56,
4,
4,
4,
4,
4,
4,
4,
4,
47,
47,
47,
47
] | 16 | 3 | [
[
0,
0,
0
],
[
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[
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[
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],
[
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[
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[
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0.25
],
[
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],
[
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],
... | {
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"c": 6.905529975891113,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | BaBe2Ag | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500822 | [
"Be",
"Sb",
"Pa"
] | [
91,
91,
91,
91,
4,
4,
4,
4,
4,
4,
4,
4,
51,
51,
51,
51
] | 16 | 3 | [
[
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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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[
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],
[
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],
[
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0.75,
0.75
],
... | {
"a": 6.485507965087891,
"b": 6.485507965087891,
"c": 6.485507965087891,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PaBe2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500837 | [
"Be",
"Rb",
"Hf"
] | [
37,
37,
37,
37,
72,
72,
72,
72,
4,
4,
4,
4,
4,
4,
4,
4
] | 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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[
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[
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[
0.5,
0.5,
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],
[
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0.75,
0.75
],
[
0.25,
0.25,
... | {
"a": 6.921525955200195,
"b": 6.921525955200195,
"c": 6.921525955200195,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbHfBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500861 | [
"Be",
"Sc",
"Y"
] | [
39,
39,
39,
39,
21,
21,
21,
21,
4,
4,
4,
4,
4,
4,
4,
4
] | 16 | 3 | [
[
0,
0,
0
],
[
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0.5,
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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[
0.5,
0.5,
0.5
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
... | {
"a": 6.593698024749756,
"b": 6.593698024749756,
"c": 6.593698024749756,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YScBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500878 | [
"Be",
"Zn",
"Pm"
] | [
61,
61,
61,
61,
4,
4,
4,
4,
4,
4,
4,
4,
30,
30,
30,
30
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
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[
0.5,
0.5,
0.5
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[
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[
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[
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],
[
0.25,
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0.75
],
[
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0.75,
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],
... | {
"a": 6.310205936431885,
"b": 6.310205936431885,
"c": 6.310205936431885,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PmBe2Zn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500891 | [
"Be",
"As",
"Ce"
] | [
58,
58,
58,
58,
4,
4,
4,
4,
4,
4,
4,
4,
33,
33,
33,
33
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
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[
0.5,
0,
0.5
],
[
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0.5,
0
],
[
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[
0.25,
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[
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0.25,
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[
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0.25
],
[
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],
... | {
"a": 6.592889785766602,
"b": 6.592889785766602,
"c": 6.592889785766602,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CeBe2As | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500908 | [
"Be",
"Mn",
"Sb"
] | [
25,
25,
25,
25,
4,
4,
4,
4,
4,
4,
4,
4,
51,
51,
51,
51
] | 16 | 3 | [
[
0,
0.5,
0
],
[
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0,
0.5
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[
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0.5
],
[
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0,
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],
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[
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[
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],
[
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0.75
],
[
0.25,
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],
... | {
"a": 6.000368118286133,
"b": 6.000368118286133,
"c": 6.000368118286133,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | MnBe2Sb | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500922 | [
"Be",
"Ni",
"In"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
49,
49,
49,
49,
28,
28,
28,
28
] | 16 | 3 | [
[
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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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],
[
0.25,
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[
0.75,
0.25,
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],
[
0,
... | {
"a": 5.729281902313232,
"b": 5.729281902313232,
"c": 5.729281902313232,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2InNi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500940 | [
"Be",
"In",
"Gd"
] | [
64,
64,
64,
64,
4,
4,
4,
4,
4,
4,
4,
4,
49,
49,
49,
49
] | 16 | 3 | [
[
0,
0.5,
0
],
[
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0,
0.5
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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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[
0.25,
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],
[
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],
... | {
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"b": 6.4714460372924805,
"c": 6.4714460372924805,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | GdBe2In | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500956 | [
"Be",
"Ho",
"Lu"
] | [
67,
67,
67,
67,
71,
71,
71,
71,
4,
4,
4,
4,
4,
4,
4,
4
] | 16 | 3 | [
[
0,
0.5,
0
],
[
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0.5
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[
0.5,
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0.5
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[
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[
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0
],
[
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[
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],
[
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],
[
0.75,
0.75,
0.25
],
[
0.25,
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... | {
"a": 6.723598003387451,
"b": 6.723598003387451,
"c": 6.723598003387451,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | HoLuBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_500991 | [
"Be",
"Ru",
"Ta"
] | [
73,
73,
73,
73,
4,
4,
4,
4,
4,
4,
4,
4,
44,
44,
44,
44
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
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[
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0,
0.5
],
[
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0
],
[
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[
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[
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],
[
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0.25
],
[
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],
... | {
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"b": 5.757818222045898,
"c": 5.757818222045898,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TaBe2Ru | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501001 | [
"Be",
"As",
"Tl"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
81,
81,
81,
81,
33,
33,
33,
33
] | 16 | 3 | [
[
0.25,
0.75,
0.75
],
[
0.25,
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],
[
0.25,
0.25,
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],
[
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[
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],
[
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[
0.75,
0.75,
0.75
],
[
0,
... | {
"a": 6.427969932556152,
"b": 6.427969932556152,
"c": 6.427969932556152,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2TlAs | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501016 | [
"Be",
"Tl",
"Bi"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
81,
81,
81,
81,
83,
83,
83,
83
] | 16 | 3 | [
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
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],
[
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[
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[
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[
0.75,
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],
[
0,
... | {
"a": 6.78577995300293,
"b": 6.78577995300293,
"c": 6.78577995300293,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2TlBi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501029 | [
"Be",
"Nd",
"Sm"
] | [
60,
60,
60,
60,
62,
62,
62,
62,
4,
4,
4,
4,
4,
4,
4,
4
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
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],
[
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0
],
[
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[
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],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
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... | {
"a": 7.007445812225342,
"b": 7.007445812225342,
"c": 7.007445812225342,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdSmBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501044 | [
"Be",
"V",
"Zr"
] | [
40,
40,
40,
40,
4,
4,
4,
4,
4,
4,
4,
4,
23,
23,
23,
23
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
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],
[
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[
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[
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[
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],
[
0.25,
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0.25
],
[
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],
... | {
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"b": 5.9868597984313965,
"c": 5.9868597984313965,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ZrBe2V | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501057 | [
"Be",
"Nd",
"Hf"
] | [
60,
60,
60,
60,
72,
72,
72,
72,
4,
4,
4,
4,
4,
4,
4,
4
] | 16 | 3 | [
[
0,
0,
0
],
[
0,
0.5,
0.5
],
[
0.5,
0,
0.5
],
[
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],
[
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],
[
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[
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],
[
0.5,
0.5,
0.5
],
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
... | {
"a": 6.636606216430664,
"b": 6.636606216430664,
"c": 6.636606216430664,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NdHfBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501074 | [
"Be",
"Ti",
"Tb"
] | [
65,
65,
65,
65,
22,
22,
22,
22,
4,
4,
4,
4,
4,
4,
4,
4
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
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],
[
0,
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0
],
[
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],
[
0.5,
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],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 6.373730182647705,
"b": 6.373730182647705,
"c": 6.373730182647705,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | TbTiBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501090 | [
"Be",
"Rb",
"Tb"
] | [
37,
37,
37,
37,
65,
65,
65,
65,
4,
4,
4,
4,
4,
4,
4,
4
] | 16 | 3 | [
[
0,
0.5,
0
],
[
0,
0,
0.5
],
[
0.5,
0.5,
0.5
],
[
0.5,
0,
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],
[
0,
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0
],
[
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],
[
0.5,
0,
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],
[
0.5,
0.5,
0
],
[
0.75,
0.75,
0.25
],
[
0.25,
0.75,
... | {
"a": 7.309741973876953,
"b": 7.309741973876953,
"c": 7.309741973876953,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | RbTbBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501107 | [
"Be",
"Ni",
"Hg"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
28,
28,
28,
28,
80,
80,
80,
80
] | 16 | 3 | [
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
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],
[
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],
[
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],
[
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],
[
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],
[
0.75,
0.75,
0.75
],
[
0,
... | {
"a": 5.708682060241699,
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"c": 5.708682060241699,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2NiHg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501122 | [
"Be",
"Si",
"Tl"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
81,
81,
81,
81,
14,
14,
14,
14
] | 16 | 3 | [
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
[
0.75,
0.25,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.75,
0.75,
0.75
],
[
0,
... | {
"a": 6.269162178039551,
"b": 6.269162178039551,
"c": 6.269162178039551,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2TlSi | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501136 | [
"Be",
"Al",
"Cd"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
13,
13,
13,
13,
48,
48,
48,
48
] | 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": 6.014547824859619,
"b": 6.014547824859619,
"c": 6.014547824859619,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2AlCd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501153 | [
"Be",
"B",
"W"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
5,
5,
5,
5,
74,
74,
74,
74
] | 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": 5.372647762298584,
"b": 5.372647762298584,
"c": 5.372647762298584,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2BW | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501168 | [
"Be",
"Rh",
"La"
] | [
57,
57,
57,
57,
4,
4,
4,
4,
4,
4,
4,
4,
45,
45,
45,
45
] | 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": 6.3796000480651855,
"b": 6.3796000480651855,
"c": 6.3796000480651855,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LaBe2Rh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501187 | [
"Be",
"Sc",
"Ce"
] | [
58,
58,
58,
58,
21,
21,
21,
21,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.776572227478027,
"b": 6.776572227478027,
"c": 6.776572227478027,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CeScBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501197 | [
"Li",
"Be",
"Hf"
] | [
3,
3,
3,
3,
72,
72,
72,
72,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 5.933105945587158,
"b": 5.933105945587158,
"c": 5.933105945587158,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | LiHfBe2 | general_inorganic | true | 4 | null | null | null | null | [
"li"
] | external_cif_tar |
tar:OQMD_501211 | [
"Be",
"Zr",
"Ce"
] | [
58,
58,
58,
58,
40,
40,
40,
40,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.756311893463135,
"b": 6.756311893463135,
"c": 6.756311893463135,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CeZrBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501225 | [
"Be",
"Pm",
"Gd"
] | [
61,
61,
61,
61,
64,
64,
64,
64,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.937717914581299,
"b": 6.937717914581299,
"c": 6.937717914581299,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | PmGdBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501240 | [
"Be",
"Er",
"Ir"
] | [
68,
68,
68,
68,
4,
4,
4,
4,
4,
4,
4,
4,
77,
77,
77,
77
] | 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": 6.056000232696533,
"b": 6.056000232696533,
"c": 6.056000232696533,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ErBe2Ir | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501255 | [
"Be",
"Cs",
"Lu"
] | [
55,
55,
55,
55,
71,
71,
71,
71,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 7.400544166564941,
"b": 7.400544166564941,
"c": 7.400544166564941,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CsLuBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:NOMAD_9WbYhCN8yRYVNz6wPYmeH5p4xOyB | [
"Be",
"Fe",
"Ge"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
26,
26,
26,
26,
32,
32,
32,
32
] | 16 | 3 | [
[
0.25,
0.75,
0.75
],
[
0.25,
0.25,
0.75
],
[
0.25,
0.25,
0.25
],
[
0.25,
0.75,
0.25
],
[
0.75,
0.75,
0.25
],
[
0.75,
0.25,
0.25
],
[
0.75,
0.25,
0.75
],
[
0.75,
0.75,
0.75
],
[
0,
... | {
"a": 5.4565229415893555,
"b": 5.4565229415893555,
"c": 5.4565229415893555,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2FeGe | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501284 | [
"Be",
"Gd",
"Er"
] | [
64,
64,
64,
64,
68,
68,
68,
68,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.812233924865723,
"b": 6.812233924865723,
"c": 6.812233924865723,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | GdErBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501299 | [
"Be",
"Ce",
"U"
] | [
58,
58,
58,
58,
92,
92,
92,
92,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.886685848236084,
"b": 6.886685848236084,
"c": 6.886685848236084,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | CeUBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501316 | [
"Be",
"Ti",
"Sr"
] | [
38,
38,
38,
38,
22,
22,
22,
22,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.666563987731934,
"b": 6.666563987731934,
"c": 6.666563987731934,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | SrTiBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501333 | [
"Be",
"Zr",
"Hg"
] | [
40,
40,
40,
40,
4,
4,
4,
4,
4,
4,
4,
4,
80,
80,
80,
80
] | 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": 6.188610076904297,
"b": 6.188610076904297,
"c": 6.188610076904297,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ZrBe2Hg | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501349 | [
"Be",
"V",
"Zn"
] | [
4,
4,
4,
4,
4,
4,
4,
4,
23,
23,
23,
23,
30,
30,
30,
30
] | 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": 5.56823205947876,
"b": 5.56823205947876,
"c": 5.56823205947876,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | Be2VZn | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501363 | [
"Be",
"Na",
"Tl"
] | [
11,
11,
11,
11,
4,
4,
4,
4,
4,
4,
4,
4,
81,
81,
81,
81
] | 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": 6.310619831085205,
"b": 6.310619831085205,
"c": 6.310619831085205,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | NaBe2Tl | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501378 | [
"Be",
"Sc",
"Cd"
] | [
21,
21,
21,
21,
4,
4,
4,
4,
4,
4,
4,
4,
48,
48,
48,
48
] | 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": 6.1115641593933105,
"b": 6.1115641593933105,
"c": 6.1115641593933105,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | ScBe2Cd | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501389 | [
"Be",
"Y",
"U"
] | [
39,
39,
39,
39,
92,
92,
92,
92,
4,
4,
4,
4,
4,
4,
4,
4
] | 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": 6.698363780975342,
"b": 6.698363780975342,
"c": 6.698363780975342,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | YUBe2 | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
tar:OQMD_501401 | [
"Be",
"Rh",
"Ac"
] | [
89,
89,
89,
89,
4,
4,
4,
4,
4,
4,
4,
4,
45,
45,
45,
45
] | 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": 6.579775810241699,
"b": 6.579775810241699,
"c": 6.579775810241699,
"alpha": 90,
"beta": 90,
"gamma": 90
} | 225 | AcBe2Rh | general_inorganic | false | null | null | null | null | null | null | external_cif_tar |
Subsets and Splits
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