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{
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{
"id": "mp-2103",
"created_at": "2022-09-04T14:39:58.160086Z",
"structure_string": "Cu1 Au3\n1.0\n4.053286 0.000000 0.000000\n0.000000 4.053286 0.000000\n0.000000 0.000000 4.053286\nCu Au\n1 3\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.000000 Au\n0.500000 0.000000 0.500000 Au\n0.000000 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Au"
],
"chemical_system": "Au-Cu",
"density": 16.319279276261163,
"density_atomic": 0.06006731857887063,
"volume": 66.59195207370296,
"volume_molar": 10.025652721775328,
"formula_full": "Cu1 Au3",
"formula_reduced": "CuAu3",
"formula_anonymous": "AB3",
"energy": -13.99092283,
"energy_per_atom": -3.4977307075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.99092283,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002728,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:06.830000Z",
"spacegroup": 221
}
]
}