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"structure_string": "C2\n1.0\n0.000000 1.786855 1.786855\n1.786855 0.000000 1.786855\n1.786855 1.786855 0.000000\nC\n2\ndirect\n0.250000 0.250000 0.250000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 2,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 3.4958233725910053,
"density_atomic": 0.175279879017178,
"volume": 11.410322800393955,
"volume_molar": 3.4357285010504888,
"formula_full": "C2",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy": -18.18073633,
"energy_per_atom": -9.090368165,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.18073633,
"band_gap": 4.1145,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0005442,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:52.938000Z",
"spacegroup": 227
}
]
}