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"id": "mp-29200",
"created_at": "2022-09-04T14:45:39.833441Z",
"structure_string": "K4 N4 O8\n1.0\n9.726330 0.000000 0.000000\n0.000000 4.561600 0.000000\n0.000000 2.426006 6.850124\nK N O\n4 4 8\ndirect\n0.640275 0.415010 0.290047 K\n0.140275 0.584990 0.209953 K\n0.359725 0.584990 0.709953 K\n0.859725 0.415010 0.790047 K\n0.087836 0.073493 0.688598 N\n0.912164 0.926507 0.311402 N\n0.412164 0.073493 0.188598 N\n0.587836 0.926507 0.811402 N\n0.697404 0.836973 0.909962 O\n0.802596 0.836973 0.409962 O\n0.197404 0.163027 0.590038 O\n0.302596 0.163027 0.090038 O\n0.589393 0.205755 0.694497 O\n0.089393 0.794245 0.805503 O\n0.410607 0.794245 0.305503 O\n0.910607 0.205755 0.194497 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"K",
"N",
"O"
],
"chemical_system": "K-N-O",
"density": 1.8599163304118171,
"density_atomic": 0.05264478412213482,
"volume": 303.9237460425391,
"volume_molar": 11.439197368591648,
"formula_full": "K4 N4 O8",
"formula_reduced": "KNO2",
"formula_anonymous": "ABC2",
"energy": -98.02899579,
"energy_per_atom": -6.126812236875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -92.53299579,
"band_gap": 2.3232,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004888,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:06.359000Z",
"spacegroup": 14
}
]
}