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"id": "mp-1523336",
"created_at": "2022-09-04T14:44:04.913392Z",
"structure_string": "Ba1 Eu1 Gd1 Sb1 O6\n1.0\n-0.000000 -4.250088 -4.250088\n4.250088 -0.000000 -4.250088\n4.250088 -4.250088 0.000000\nBa Eu Gd Sb O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Eu\n0.000000 0.000000 0.000000 Gd\n0.500000 0.500000 0.500000 Sb\n0.735487 0.264513 0.264513 O\n0.264513 0.735487 0.735487 O\n0.735487 0.264513 0.735487 O\n0.264513 0.735487 0.264513 O\n0.735487 0.735487 0.264513 O\n0.264513 0.264513 0.735487 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Eu",
"Gd",
"Sb",
"O"
],
"chemical_system": "Ba-Eu-Gd-O-Sb",
"density": 7.184356708566877,
"density_atomic": 0.06512927400286612,
"volume": 153.54078719747332,
"volume_molar": 9.246442329043902,
"formula_full": "Ba1 Eu1 Gd1 Sb1 O6",
"formula_reduced": "BaEuGdSbO6",
"formula_anonymous": "ABCDE6",
"energy": -90.08345781,
"energy_per_atom": -9.008345781,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -85.96145781000001,
"band_gap": 0.6533999999999995,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:21.846000Z",
"spacegroup": 216
}
]
}