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{
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{
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"energy_uncorrected": -33.69096407,
"band_gap": 4.358900000000001,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0011875,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:00.707000Z",
"spacegroup": 123
},
{
"id": "mp-1096758",
"created_at": "2022-09-04T14:46:01.420090Z",
"structure_string": "Cu1 Sn1 Pd2\n1.0\n-4.895524 5.468321 7.732045\n4.895524 -5.468321 7.732045\n4.895524 5.468321 -7.732045\nCu Sn Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Sn\n0.000000 0.252062 0.252062 Pd\n0.000000 0.747938 0.747938 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cu",
"Sn",
"Pd"
],
"chemical_system": "Cu-Pd-Sn",
"density": 0.7923994794413558,
"density_atomic": 0.004831171365942102,
"volume": 827.9565548426744,
"volume_molar": 124.65177291068112,
"formula_full": "Cu1 Sn1 Pd2",
"formula_reduced": "CuSnPd2",
"formula_anonymous": "ABC2",
"energy": -11.89992552,
"energy_per_atom": -2.97498138,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.89992552,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0014347,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:17.711000Z",
"spacegroup": 71
}
]
}