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"updated_at": "2021-11-28T01:34:33.754000Z",
"spacegroup": 216
},
{
"id": "mp-1523079",
"created_at": "2022-09-04T14:39:37.322685Z",
"structure_string": "K1 Ba1 Gd1 W1 O6\n1.0\n0.000000 -4.256552 -4.256552\n4.256552 0.000000 -4.256552\n4.256552 -4.256552 0.000000\nK Ba Gd W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 Ba\n0.000000 -0.000000 -0.000000 Gd\n0.500000 0.500000 0.500000 W\n0.730496 0.269504 0.269504 O\n0.269504 0.730496 0.730496 O\n0.730496 0.269504 0.730496 O\n0.269504 0.730496 0.269504 O\n0.730496 0.730496 0.269504 O\n0.269504 0.269504 0.730496 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"Ba",
"Gd",
"W",
"O"
],
"chemical_system": "Ba-Gd-K-O-W",
"density": 6.604928509687536,
"density_atomic": 0.06483300841503271,
"volume": 154.24241824448976,
"volume_molar": 9.288695538311094,
"formula_full": "K1 Ba1 Gd1 W1 O6",
"formula_reduced": "KBaGdWO6",
"formula_anonymous": "ABCDE6",
"energy": -89.15118181,
"energy_per_atom": -8.915118181,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -80.59118181,
"band_gap": 2.8167000000000004,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0000002,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:36.919000Z",
"spacegroup": 216
}
]
}