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"chemical_system": "Ba-Eu-Nb-O-Sb",
"density": 6.373003645745078,
"density_atomic": 0.06397013621938182,
"volume": 156.3229436577341,
"volume_molar": 9.413987707244239,
"formula_full": "Ba1 Eu1 Nb1 Sb1 O6",
"formula_reduced": "BaEuNbSbO6",
"formula_anonymous": "ABCDE6",
"energy": -83.5200253,
"energy_per_atom": -8.35200253,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -79.3980253,
"band_gap": 0.8037999999999998,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:48.339000Z",
"spacegroup": 216
},
{
"id": "mp-1519573",
"created_at": "2022-09-04T14:43:05.300532Z",
"structure_string": "Na4 Eu4 Sn4 Sb4 O24\n1.0\n8.825145 0.000000 0.000000\n0.000000 8.959906 0.000000\n0.000000 0.000000 8.735650\nNa Eu Sn Sb O\n4 4 4 4 24\ndirect\n0.000000 0.500000 0.500000 Na\n0.500000 0.500000 -0.000000 Na\n0.500000 -0.000000 -0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.500000 0.000000 0.500000 Eu\n-0.000000 0.500000 -0.000000 Eu\n-0.000000 -0.000000 -0.000000 Eu\n0.500000 0.500000 0.500000 Eu\n0.250000 0.250000 0.250000 Sn\n0.750000 0.750000 0.250000 Sn\n0.750000 0.250000 0.750000 Sn\n0.250000 0.750000 0.750000 Sn\n0.750000 0.750000 0.750000 Sb\n0.250000 0.250000 0.750000 Sb\n0.250000 0.750000 0.250000 Sb\n0.750000 0.250000 0.250000 Sb\n0.001873 0.212691 0.253583 O\n-0.001873 0.787309 0.253583 O\n-0.001873 0.212691 0.746417 O\n0.001873 0.787309 0.746417 O\n0.281617 0.002146 0.215790 O\n0.281617 -0.002146 0.784210 O\n0.718383 -0.002146 0.215790 O\n0.718383 0.002146 0.784210 O\n0.190247 0.277073 0.003228 O\n0.809753 0.277073 -0.003228 O\n0.190247 0.722927 -0.003228 O\n0.809753 0.722927 0.003228 O\n0.498127 0.287309 0.246417 O\n0.501873 0.712691 0.246417 O\n0.501873 0.287309 0.753583 O\n0.498127 0.712691 0.753583 O\n0.218383 0.497854 0.284210 O\n0.218383 0.502146 0.715790 O\n0.781617 0.502146 0.284210 O\n0.781617 0.497854 0.715790 O\n0.309753 0.222927 0.496772 O\n0.690247 0.222927 0.503228 O\n0.309753 0.777073 0.503228 O\n0.690247 0.777073 0.496772 O\n",
"nsites": 40,
"nelements": 5,
"elements": [
"Na",
"Eu",
"Sn",
"Sb",
"O"
],
"chemical_system": "Eu-Na-O-Sb-Sn",
"density": 4.917749601875369,
"density_atomic": 0.057908119612990076,
"volume": 690.7494193789555,
"volume_molar": 10.399475583470853,
"formula_full": "Na4 Eu4 Sn4 Sb4 O24",
"formula_reduced": "NaEuSnSbO6",
"formula_anonymous": "ABCDE6",
"energy": -275.28921691,
"energy_per_atom": -6.88223042275,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -258.80121691,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.9285605,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:13.052000Z",
"spacegroup": 48
}
]
}