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"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -140.96041829,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.904904,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:51.651000Z",
"spacegroup": 194
},
{
"id": "mp-2347",
"created_at": "2022-09-04T14:48:29.661659Z",
"structure_string": "Ni2 As2\n1.0\n1.759517 -3.047573 0.000000\n1.759517 3.047573 0.000000\n0.000000 0.000000 5.684002\nNi As\n2 2\ndirect\n0.666667 0.333333 0.750000 Ni\n0.333333 0.666667 0.250000 Ni\n0.000000 0.000000 0.500000 As\n0.000000 0.000000 0.000000 As\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ni",
"As"
],
"chemical_system": "As-Ni",
"density": 7.2795160329015065,
"density_atomic": 0.06561878566023159,
"volume": 60.9581533665017,
"volume_molar": 9.177464501068528,
"formula_full": "Ni2 As2",
"formula_reduced": "NiAs",
"formula_anonymous": "AB",
"energy": -20.66946509,
"energy_per_atom": -5.1673662725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.66946509,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0315251,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:43.143000Z",
"spacegroup": 194
}
]
}