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"updated_at": "2021-11-28T01:34:44.297000Z",
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},
{
"id": "mp-1223566",
"created_at": "2022-09-04T14:40:02.528039Z",
"structure_string": "La9 Ni6 O19\n1.0\n2.757926 8.302418 0.000000\n-2.757926 8.302418 0.000000\n0.000000 2.666155 10.016408\nLa Ni O\n9 6 19\ndirect\n0.155235 0.155235 0.004602 La\n0.844765 0.844765 0.995398 La\n0.500000 0.500000 0.000000 La\n0.233018 0.233018 0.643945 La\n0.891644 0.891644 0.636727 La\n0.555094 0.555094 0.650452 La\n0.766982 0.766982 0.356055 La\n0.444906 0.444906 0.349548 La\n0.108356 0.108356 0.363273 La\n0.301098 0.301098 0.174816 Ni\n0.967600 0.967600 0.196829 Ni\n0.640982 0.640982 0.167521 Ni\n0.698902 0.698902 0.825184 Ni\n0.359018 0.359018 0.832479 Ni\n0.032400 0.032400 0.803171 Ni\n0.242824 0.242824 0.420989 O\n0.940205 0.940205 0.405643 O\n0.608356 0.608356 0.424769 O\n0.757176 0.757176 0.579011 O\n0.391644 0.391644 0.575231 O\n0.059795 0.059795 0.594357 O\n0.141600 0.622673 0.188419 O\n0.798026 0.312736 0.185857 O\n0.472708 0.975433 0.157657 O\n0.975433 0.472708 0.157657 O\n0.622673 0.141600 0.188419 O\n0.312736 0.798026 0.185857 O\n0.858400 0.377327 0.811581 O\n0.527292 0.024567 0.842343 O\n0.201974 0.687264 0.814143 O\n0.024567 0.527292 0.842343 O\n0.687264 0.201974 0.814143 O\n0.377327 0.858400 0.811581 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 34,
"nelements": 3,
"elements": [
"La",
"Ni",
"O"
],
"chemical_system": "La-Ni-O",
"density": 6.900979479115921,
"density_atomic": 0.0741224406352178,
"volume": 458.70049216708566,
"volume_molar": 8.124585089739607,
"formula_full": "La9 Ni6 O19",
"formula_reduced": "La9Ni6O19",
"formula_anonymous": "A6B9C19",
"energy": -267.54127635,
"energy_per_atom": -7.868861069117647,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -239.24227635,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 10.0789856,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:46.356000Z",
"spacegroup": 12
}
]
}