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"created_at": "2022-09-04T14:42:03.222493Z",
"structure_string": "Nd1 Eu1 Zr1 Ti1 O6\n1.0\n-0.000000 -4.055543 -4.055543\n4.055543 -0.000000 -4.055543\n4.055543 -4.055543 0.000000\nNd Eu Zr Ti O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Nd\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 Zr\n-0.000000 -0.000000 0.000000 Ti\n0.756965 0.243035 0.243035 O\n0.243035 0.756965 0.756965 O\n0.756965 0.243035 0.756965 O\n0.243035 0.756965 0.243035 O\n0.756965 0.756965 0.243035 O\n0.243035 0.243035 0.756965 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Nd",
"Eu",
"Zr",
"Ti",
"O"
],
"chemical_system": "Eu-Nd-O-Ti-Zr",
"density": 6.61312133818165,
"density_atomic": 0.0749588599731376,
"volume": 133.40651129944638,
"volume_molar": 8.033927893457966,
"formula_full": "Nd1 Eu1 Zr1 Ti1 O6",
"formula_reduced": "NdEuZrTiO6",
"formula_anonymous": "ABCDE6",
"energy": -95.8146451,
"energy_per_atom": -9.58146451,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -91.6926451,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.844615,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:36.945000Z",
"spacegroup": 216
}
]
}