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"structure_string": "Np8\n1.0\n4.666573 0.000000 0.000000\n0.000000 4.796107 0.000000\n0.000000 0.000000 6.586571\nNp\n8\ndirect\n0.250000 0.217798 0.044816 Np\n0.750000 0.782202 0.955184 Np\n0.750000 0.717798 0.455184 Np\n0.250000 0.282202 0.544816 Np\n0.250000 0.860069 0.318009 Np\n0.750000 0.139931 0.681991 Np\n0.750000 0.360069 0.181991 Np\n0.250000 0.639931 0.818009 Np\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Np"
],
"chemical_system": "Np",
"density": 21.357043159256772,
"density_atomic": 0.0542679831927789,
"volume": 147.41657104855352,
"volume_molar": 11.097041765136627,
"formula_full": "Np8",
"formula_reduced": "Np",
"formula_anonymous": "A",
"energy": -103.58223745,
"energy_per_atom": -12.94777968125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -103.58223745,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0032839,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:55.450000Z",
"spacegroup": 62
}
]
}