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"energy": -143.1739765,
"energy_per_atom": -7.158698825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -134.9299765,
"band_gap": 0.0,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 5.9996396,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:14.349000Z",
"spacegroup": 7
},
{
"id": "mp-1522723",
"created_at": "2022-09-04T14:43:01.190940Z",
"structure_string": "Na1 Pr1 Hf1 Ga1 O6\n1.0\n0.000000 -3.996842 -3.996842\n3.996842 0.000000 -3.996842\n3.996842 -3.996842 0.000000\nNa Pr Hf Ga O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.750000 Pr\n0.500000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Ga\n0.755416 0.244584 0.244584 O\n0.244584 0.755416 0.755416 O\n0.755416 0.244584 0.755416 O\n0.244584 0.755416 0.244584 O\n0.755416 0.755416 0.244584 O\n0.244584 0.244584 0.755416 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Na",
"Pr",
"Hf",
"Ga",
"O"
],
"chemical_system": "Ga-Hf-Na-O-Pr",
"density": 6.607287190764443,
"density_atomic": 0.0783103316240913,
"volume": 127.69707128814676,
"volume_molar": 7.690097379369744,
"formula_full": "Na1 Pr1 Hf1 Ga1 O6",
"formula_reduced": "NaPrHfGaO6",
"formula_anonymous": "ABCDE6",
"energy": -77.54267423,
"energy_per_atom": -7.754267423,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -73.42067423,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.9999999,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:03.522000Z",
"spacegroup": 216
}
]
}