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"energy_uncorrected": -41.49427512,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.3201836,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:31.747000Z",
"spacegroup": 166
},
{
"id": "mp-1184415",
"created_at": "2022-09-04T14:45:19.282315Z",
"structure_string": "Gd2 Ag1 Ru1\n1.0\n0.000000 3.542101 3.542101\n3.542101 0.000000 3.542101\n3.542101 3.542101 0.000000\nGd Ag Ru\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Gd\n0.750000 0.750000 0.750000 Gd\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Gd",
"Ag",
"Ru"
],
"chemical_system": "Ag-Gd-Ru",
"density": 9.779163200076946,
"density_atomic": 0.045003591504194425,
"volume": 88.88179512577773,
"volume_molar": 13.381467031222885,
"formula_full": "Gd2 Ag1 Ru1",
"formula_reduced": "Gd2AgRu",
"formula_anonymous": "ABC2",
"energy": -41.49277597,
"energy_per_atom": -10.3731939925,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -41.49277597,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 14.1455583,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:03.992000Z",
"spacegroup": 225
}
]
}