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{
"id": "mp-754844",
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{
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{
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{
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{
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{
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},
{
"id": "mp-1215758",
"created_at": "2022-09-04T14:39:28.402779Z",
"structure_string": "Zn1 Cr4 Ni1 O8\n1.0\n0.000000 4.232917 4.232917\n4.232917 0.000000 4.232917\n4.232917 4.232917 0.000000\nZn Cr Ni O\n1 4 1 8\ndirect\n0.000000 0.000000 0.000000 Zn\n0.625030 0.625030 0.124909 Cr\n0.625030 0.124909 0.625030 Cr\n0.124909 0.625030 0.625030 Cr\n0.625030 0.625030 0.625030 Cr\n0.250000 0.250000 0.250000 Ni\n0.863531 0.863531 0.409407 O\n0.863531 0.409407 0.863531 O\n0.409407 0.863531 0.863531 O\n0.863531 0.863531 0.863531 O\n0.385348 0.385348 0.843957 O\n0.385348 0.843957 0.385348 O\n0.843957 0.385348 0.385348 O\n0.385348 0.385348 0.385348 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Zn",
"Cr",
"Ni",
"O"
],
"chemical_system": "Cr-Ni-O-Zn",
"density": 5.036572453410131,
"density_atomic": 0.09229512909002854,
"volume": 151.68731154104364,
"volume_molar": 6.524873868615266,
"formula_full": "Zn1 Cr4 Ni1 O8",
"formula_reduced": "ZnCr4NiO8",
"formula_anonymous": "ABC4D8",
"energy": -114.18291091,
"energy_per_atom": -8.155922207857143,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -98.14991091,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 13.9999985,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:38.798000Z",
"spacegroup": 216
}
]
}