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"updated_at": "2021-11-28T01:35:57.104000Z",
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{
"id": "mp-1215142",
"created_at": "2022-09-04T14:39:06.314981Z",
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{
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O\n0.617464 0.194109 0.199913 O\n0.875000 0.436009 0.313991 O\n0.014318 0.838617 0.335638 O\n0.485682 0.161383 0.835638 O\n0.914362 0.588617 0.264318 O\n0.588617 0.264318 0.914362 O\n0.845519 0.823937 0.176937 O\n0.727342 0.158323 0.082223 O\n0.313991 0.875000 0.436009 O\n0.367464 0.449913 0.055891 O\n0.977342 0.167777 0.908323 O\n0.055891 0.367464 0.449913 O\n0.477342 0.332223 0.091677 O\n0.926063 0.904481 0.573063 O\n0.449913 0.055891 0.367464 O\n0.835638 0.485682 0.161383 O\n0.091677 0.477342 0.332223 O\n0.904481 0.573063 0.926063 O\n0.805891 0.699913 0.882536 O\n0.426063 0.595519 0.426937 O\n0.676937 0.654481 0.176063 O\n0.176063 0.676937 0.654481 O\n0.658323 0.417777 0.272658 O\n0.073063 0.573937 0.095519 O\n0.063991 0.686009 0.375000 O\n0.300087 0.382536 0.694109 O\n0.917777 0.227342 0.341677 O\n0.686009 0.375000 0.063991 O\n0.625000 0.563991 0.813991 O\n0.332223 0.091677 0.477342 O\n0.199913 0.617464 0.194109 O\n0.936009 0.186009 0.125000 O\n0.264318 0.914362 0.588617 O\n0.345519 0.676063 0.823063 O\n0.563991 0.813991 0.625000 O\n0.186009 0.125000 0.936009 O\n0.335638 0.014318 0.838617 O\n0.227342 0.341677 0.917777 O\n",
"nsites": 164,
"nelements": 4,
"elements": [
"Na",
"Nd",
"N",
"O"
],
"chemical_system": "N-Na-Nd-O",
"density": 2.6099105519728614,
"density_atomic": 0.07038875173417201,
"volume": 2329.9177206516933,
"volume_molar": 8.555544190843204,
"formula_full": "Na12 Nd8 N36 O108",
"formula_reduced": "Na3Nd2(NO3)9",
"formula_anonymous": "A2B3C9D27",
"energy": -1124.3823240099998,
"energy_per_atom": -6.8559897805487795,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1050.18632401,
"band_gap": 3.4965,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0460747,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:20.662000Z",
"spacegroup": 213
}
]
}