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"spacegroup": 194
},
{
"id": "mp-1120747",
"created_at": "2022-09-04T14:39:23.788526Z",
"structure_string": "Si6\n1.0\n2.546187 -4.410126 0.000000\n2.546187 4.410126 0.000000\n0.000000 0.000000 4.419092\nSi\n6\ndirect\n0.670035 0.835017 0.250000 Si\n0.835017 0.164983 0.750000 Si\n0.164983 0.329965 0.250000 Si\n0.835017 0.670035 0.750000 Si\n0.329965 0.164983 0.750000 Si\n0.164983 0.835017 0.250000 Si\n",
"nsites": 6,
"nelements": 1,
"elements": [
"Si"
],
"chemical_system": "Si",
"density": 2.8195394459517473,
"density_atomic": 0.06045704519329064,
"volume": 99.24401665375905,
"volume_molar": 9.961023964612021,
"formula_full": "Si6",
"formula_reduced": "Si",
"formula_anonymous": "A",
"energy": -29.82945416,
"energy_per_atom": -4.9715756933333335,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.82945416,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001087,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:36.036000Z",
"spacegroup": 194
}
]
}