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"density_atomic": 0.06889805367675826,
"volume": 145.1419810335419,
"volume_molar": 8.740654399692396,
"formula_full": "Ba1 Sr1 Gd1 V1 O6",
"formula_reduced": "BaSrGdVO6",
"formula_anonymous": "ABCDE6",
"energy": -87.67199453,
"energy_per_atom": -8.767199453,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -81.84999453,
"band_gap": 1.5448,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.9999998,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:47.901000Z",
"spacegroup": 216
},
{
"id": "mp-1516589",
"created_at": "2022-09-04T14:44:56.640322Z",
"structure_string": "K1 La1 In1 Sb1 O6\n1.0\n0.000000 -4.111320 -4.111320\n4.111320 -0.000000 -4.111320\n4.111320 -4.111320 -0.000000\nK La In Sb O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 La\n-0.000000 0.000000 -0.000000 In\n0.500000 0.500000 0.500000 Sb\n0.741165 0.258835 0.258835 O\n0.258835 0.741165 0.741165 O\n0.741165 0.258835 0.741165 O\n0.258835 0.741165 0.258835 O\n0.741165 0.741165 0.258835 O\n0.258835 0.258835 0.741165 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"La",
"In",
"Sb",
"O"
],
"chemical_system": "In-K-La-O-Sb",
"density": 6.100107681901296,
"density_atomic": 0.0719492318370407,
"volume": 138.98689040418395,
"volume_molar": 8.36998617808689,
"formula_full": "K1 La1 In1 Sb1 O6",
"formula_reduced": "KLaInSbO6",
"formula_anonymous": "ABCDE6",
"energy": -66.27095801,
"energy_per_atom": -6.627095801,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -62.14895801,
"band_gap": 1.1483999999999996,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:40.234000Z",
"spacegroup": 216
}
]
}