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"formation_energy_per_atom": null,
"energy_uncorrected": -69.28627362,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.005922,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:11.007000Z",
"spacegroup": 216
},
{
"id": "mp-1520503",
"created_at": "2022-09-04T14:40:37.744348Z",
"structure_string": "Sr1 Nd1 Dy1 Mn1 O6\n1.0\n-0.000000 -4.064971 -4.064971\n4.064971 0.000000 -4.064971\n4.064971 -4.064971 -0.000000\nSr Nd Dy Mn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Nd\n0.000000 0.000000 -0.000000 Dy\n0.500000 0.500000 0.500000 Mn\n0.733556 0.266444 0.266444 O\n0.266444 0.733556 0.733556 O\n0.733556 0.266444 0.733556 O\n0.266444 0.733556 0.266444 O\n0.733556 0.733556 0.266444 O\n0.266444 0.266444 0.733556 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Nd",
"Dy",
"Mn",
"O"
],
"chemical_system": "Dy-Mn-Nd-O-Sr",
"density": 6.74030289525028,
"density_atomic": 0.0744385062225376,
"volume": 134.33907405536195,
"volume_molar": 8.090088135294536,
"formula_full": "Sr1 Nd1 Dy1 Mn1 O6",
"formula_reduced": "SrNdDyMnO6",
"formula_anonymous": "ABCDE6",
"energy": -80.28082034,
"energy_per_atom": -8.028082034,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -74.49082034,
"band_gap": 2.2836000000000003,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.0000009,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:04.067000Z",
"spacegroup": 216
}
]
}