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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:47.118000Z",
"spacegroup": 216
},
{
"id": "mp-1522415",
"created_at": "2022-09-04T14:41:19.865216Z",
"structure_string": "K1 Ce1 Mg1 W1 O6\n1.0\n0.000000 -3.991802 -3.991802\n3.991802 -0.000000 -3.991802\n3.991802 -3.991802 0.000000\nK Ce Mg W O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 Ce\n0.000000 -0.000000 -0.000000 Mg\n0.500000 0.500000 0.500000 W\n0.743022 0.256978 0.256978 O\n0.256978 0.743022 0.743022 O\n0.743022 0.256978 0.743022 O\n0.256978 0.743022 0.256978 O\n0.743022 0.743022 0.256978 O\n0.256978 0.256978 0.743022 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"Ce",
"Mg",
"W",
"O"
],
"chemical_system": "Ce-K-Mg-O-W",
"density": 6.309267949518559,
"density_atomic": 0.07860732726993329,
"volume": 127.21460387096667,
"volume_molar": 7.661042512386022,
"formula_full": "K1 Ce1 Mg1 W1 O6",
"formula_reduced": "KCeMgWO6",
"formula_anonymous": "ABCDE6",
"energy": -78.78026295000001,
"energy_per_atom": -7.878026295000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -70.22026295,
"band_gap": 0.1377000000000006,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.9999994,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:09.845000Z",
"spacegroup": 216
}
]
}