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"created_at": "2022-09-04T14:38:10.280004Z",
"updated_at": "2022-09-04T14:38:10.280012Z",
"structure_string": "Ta2 F10\n1.0\n3.627438 0.000000 0.000000\n-1.813719 5.437505 0.000000\n0.000000 -0.000000 8.312925\nTa F\n2 10\ndirect\n0.500000 0.000000 0.500000 Ta\n0.500000 0.000000 0.000000 Ta\n0.470093 0.940185 0.250000 F\n0.529907 0.059815 0.750000 F\n0.076443 0.152886 0.585331 F\n0.923557 0.847113 0.414668 F\n0.338702 0.677406 0.915546 F\n0.661298 0.322594 0.084454 F\n0.661298 0.322594 0.415546 F\n0.338702 0.677406 0.584453 F\n0.076443 0.152886 0.914668 F\n0.923557 0.847113 0.085331 F\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ta",
"F"
],
"chemical_system": "F-Ta",
"density": 5.589076571546783,
"density_atomic": 0.07318595027064408,
"volume": 163.9658972196658,
"volume_molar": 8.228547607471002,
"formula_full": "Ta2 F10",
"formula_reduced": "TaF5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.5932517687499994,
"spacegroup": 63
}
]
}