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"material_id": "mp-27829",
"formation_energy_per_atom": -1.5341487719270832,
"band_gap": 2.696,
"pretty_formula": "Rb2SeCl6",
"e_above_hull": 0,
"elements": "['Cl', 'Rb', 'Se']",
"spacegroup.number": 225
}
} |
[
[
0.6666666666666666,
0.3333333333333333,
0.25
],
[
0.3333333333333333,
0.6666666666666666,
0.75
],
[
0.163812,
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0.25
],
[
0.163812,
0.836188,
0.25
],
[
0.672376,
0.836188,
0.25
],
[
0.327624,
0.163812,
0.75
],
... | [
68,
68,
12,
12,
12,
12,
12,
12
] | [
[
6.63671853,
0,
4.0638180523032133e-16
],
[
-3.318359796664003,
5.747566537790528,
4.0638180523032133e-16
],
[
0,
0,
5.186665
]
] | {
"object": {
"material_id": "mp-1184313",
"formation_energy_per_atom": -0.0459324825,
"band_gap": 0,
"pretty_formula": "ErMg3",
"e_above_hull": 0.009779342499999,
"elements": "['Er', 'Mg']",
"spacegroup.number": 194
}
} |
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