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{
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{
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"id": "mp-861735",
"created_at": "2022-09-04T14:40:00.775526Z",
"structure_string": "Ac1 Mg1 Tl2\n1.0\n0.000000 3.930004 3.930004\n3.930004 0.000000 3.930004\n3.930004 3.930004 0.000000\nAc Mg Tl\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ac\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Tl\n0.750000 0.750000 0.750000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Mg",
"Tl"
],
"chemical_system": "Ac-Mg-Tl",
"density": 9.028823679711246,
"density_atomic": 0.03294966613635998,
"volume": 121.39728467797727,
"volume_molar": 18.27678840531426,
"formula_full": "Ac1 Mg1 Tl2",
"formula_reduced": "AcMgTl2",
"formula_anonymous": "ABC2",
"energy": -11.46481933,
"energy_per_atom": -2.8662048325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.46481933,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0205745,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:02.801000Z",
"spacegroup": 225
}
]
}