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{
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"volume": 570.5265532867529,
"volume_molar": 13.214581581578718,
"formula_full": "Li8 Bi4 S14",
"formula_reduced": "Li4Bi2S7",
"formula_anonymous": "A2B4C7",
"energy": -112.934087,
"energy_per_atom": -4.343618730769231,
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"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -105.892087,
"band_gap": 0.9856000000000004,
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"is_magnetic": false,
"total_magnetization": 0.0001152,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:55.586000Z",
"spacegroup": 14
},
{
"id": "mp-677241",
"created_at": "2022-09-04T14:43:14.986539Z",
"structure_string": "Lu1 Cu1 Se2\n1.0\n2.032522 -3.520431 0.000000\n2.032522 3.520431 0.000000\n0.000000 0.000000 6.375557\nLu Cu Se\n1 1 2\ndirect\n0.000000 0.000000 0.800679 Lu\n0.666667 0.333333 0.178032 Cu\n0.333333 0.666667 0.072230 Se\n0.666667 0.333333 0.568259 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Cu",
"Se"
],
"chemical_system": "Cu-Lu-Se",
"density": 7.215055501265846,
"density_atomic": 0.043841032239849566,
"volume": 91.23872764027158,
"volume_molar": 13.736311515325452,
"formula_full": "Lu1 Cu1 Se2",
"formula_reduced": "LuCuSe2",
"formula_anonymous": "ABC2",
"energy": -21.2857518,
"energy_per_atom": -5.32143795,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
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"energy_uncorrected": -20.3417518,
"band_gap": 1.1077000000000004,
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"total_magnetization": 0.0014579,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:07.147000Z",
"spacegroup": 156
}
]
}