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"created_at": "2022-09-04T14:42:46.204963Z",
"structure_string": "Sm8 U4 S20\n1.0\n7.461092 0.000000 0.000000\n0.000000 7.998210 0.000000\n0.000000 0.000000 11.875763\nSm U S\n8 4 20\ndirect\n0.478814 0.998893 0.322081 Sm\n0.978814 0.498893 0.177919 Sm\n0.021186 0.998893 0.822081 Sm\n0.521186 0.498893 0.677919 Sm\n0.521186 0.001107 0.677919 Sm\n0.021186 0.501107 0.822081 Sm\n0.478814 0.501107 0.322081 Sm\n0.978814 0.001107 0.177919 Sm\n0.427654 0.750000 0.009146 U\n0.072346 0.750000 0.509146 U\n0.927654 0.250000 0.490854 U\n0.572346 0.250000 0.990854 U\n0.660848 0.543110 0.902788 S\n0.160848 0.043111 0.597212 S\n0.955631 0.250000 0.999948 S\n0.301679 0.750000 0.785274 S\n0.544369 0.250000 0.499948 S\n0.160848 0.456890 0.597212 S\n0.339152 0.456890 0.097212 S\n0.328334 0.250000 0.813995 S\n0.044369 0.750000 0.000052 S\n0.801679 0.250000 0.714726 S\n0.660848 0.956890 0.902788 S\n0.198321 0.750000 0.285274 S\n0.339152 0.043111 0.097212 S\n0.171666 0.250000 0.313995 S\n0.698321 0.250000 0.214726 S\n0.839152 0.543110 0.402788 S\n0.839152 0.956890 0.402788 S\n0.671666 0.750000 0.186005 S\n0.455631 0.750000 0.500052 S\n0.828334 0.750000 0.686005 S\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Sm",
"U",
"S"
],
"chemical_system": "S-Sm-U",
"density": 6.552023752454983,
"density_atomic": 0.045153691189857584,
"volume": 708.6906774786074,
"volume_molar": 13.3369844221123,
"formula_full": "Sm8 U4 S20",
"formula_reduced": "Sm2US5",
"formula_anonymous": "AB2C5",
"energy": -232.29813323,
"energy_per_atom": -7.2593166634375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -222.23813323,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.4468496,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:51.999000Z",
"spacegroup": 62
}
]
}