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{
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"is_magnetic": true,
"total_magnetization": 4.0000004,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:49.879000Z",
"spacegroup": 216
},
{
"id": "mp-1049202",
"created_at": "2022-09-04T14:46:58.606568Z",
"structure_string": "La2 Zn2 Cr2 Sn2 O12\n1.0\n5.600662 0.000000 0.000000\n0.000000 5.457268 0.000000\n0.000000 5.423741 7.930752\nLa Zn Cr Sn O\n2 2 2 2 12\ndirect\n0.287035 0.761246 0.249959 La\n0.712965 0.761246 0.749959 La\n0.780772 0.239897 0.249178 Zn\n0.219228 0.239897 0.749178 Zn\n0.246225 0.000868 0.499476 Cr\n0.753775 0.000868 0.999476 Cr\n0.244948 0.500744 0.998658 Sn\n0.755052 0.500744 0.498658 Sn\n0.803993 0.336289 0.754167 O\n0.031937 0.147357 0.058307 O\n0.043179 0.769497 0.444013 O\n0.560826 0.246952 0.063062 O\n0.557545 0.879331 0.436086 O\n0.279481 0.617818 0.747092 O\n0.196007 0.336289 0.254167 O\n0.968063 0.147357 0.558307 O\n0.956821 0.769497 0.944013 O\n0.439174 0.246952 0.563062 O\n0.442455 0.879331 0.936086 O\n0.720519 0.617818 0.247092 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"La",
"Zn",
"Cr",
"Sn",
"O"
],
"chemical_system": "Cr-La-O-Sn-Zn",
"density": 6.45337098771523,
"density_atomic": 0.08250893482235175,
"volume": 242.39799050928946,
"volume_molar": 7.298774093940425,
"formula_full": "La2 Zn2 Cr2 Sn2 O12",
"formula_reduced": "LaZnCrSnO6",
"formula_anonymous": "ABCDE6",
"energy": -148.49064894,
"energy_per_atom": -7.424532447,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -136.24864894,
"band_gap": 2.2934,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.999994,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:45.067000Z",
"spacegroup": 7
}
]
}