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"energy_uncorrected": -189.84296927,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 42.1265827,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:44.657000Z",
"spacegroup": 55
},
{
"id": "mp-1219326",
"created_at": "2022-09-04T14:46:10.019288Z",
"structure_string": "Si3 B3 W10\n1.0\n0.000000 4.418363 5.573010\n4.335566 0.000000 5.573010\n4.335566 4.418363 0.000000\nSi B W\n3 3 10\ndirect\n0.630018 0.369982 0.630018 Si\n0.245885 0.254115 0.245885 Si\n0.745885 0.754115 0.745885 Si\n0.876969 0.123031 0.126800 B\n0.126800 0.873200 0.876969 B\n0.368082 0.631918 0.368082 B\n0.522971 0.191817 0.465395 W\n0.180183 0.534605 0.808183 W\n0.017865 0.699528 0.300472 W\n0.707924 0.001471 0.998529 W\n0.465395 0.819817 0.522971 W\n0.808183 0.477029 0.180183 W\n0.998529 0.292076 0.707924 W\n0.300472 0.982135 0.017865 W\n0.495052 0.504948 0.009787 W\n0.009787 0.990213 0.495052 W\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Si",
"B",
"W"
],
"chemical_system": "B-Si-W",
"density": 15.205080631952601,
"density_atomic": 0.07493642484554243,
"volume": 213.51432274730084,
"volume_molar": 8.036333161626972,
"formula_full": "Si3 B3 W10",
"formula_reduced": "Si3B3W10",
"formula_anonymous": "A3B3C10",
"energy": -168.74094095,
"energy_per_atom": -10.546308809375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -168.95394095,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0092301,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:18.797000Z",
"spacegroup": 42
}
]
}