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"formula_full": "Sb2",
"formula_reduced": "Sb",
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"energy": -8.25800248,
"energy_per_atom": -4.12900124,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -8.25800248,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0009531,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:33.169000Z",
"spacegroup": 166
},
{
"id": "mp-567540",
"created_at": "2022-09-04T14:42:07.198629Z",
"structure_string": "Ga20\n1.0\n5.326874 -6.851617 0.000000\n5.326874 6.851617 0.000000\n0.000000 0.000000 5.275632\nGa\n20\ndirect\n0.328379 0.226486 0.750000 Ga\n0.606967 0.393033 0.497386 Ga\n0.671621 0.773514 0.250000 Ga\n0.911665 0.633188 0.250000 Ga\n0.331826 0.919343 0.750000 Ga\n0.668174 0.080657 0.250000 Ga\n0.080657 0.668174 0.750000 Ga\n0.000528 0.999472 0.750000 Ga\n0.088335 0.366812 0.750000 Ga\n0.366812 0.088335 0.250000 Ga\n0.606967 0.393033 0.002614 Ga\n0.214029 0.785971 0.250000 Ga\n0.226486 0.328379 0.250000 Ga\n0.785971 0.214029 0.750000 Ga\n0.393033 0.606967 0.997386 Ga\n0.919343 0.331826 0.250000 Ga\n0.999472 0.000528 0.250000 Ga\n0.773514 0.671621 0.750000 Ga\n0.393033 0.606967 0.502614 Ga\n0.633188 0.911665 0.750000 Ga\n",
"nsites": 20,
"nelements": 1,
"elements": [
"Ga"
],
"chemical_system": "Ga",
"density": 6.012916410864471,
"density_atomic": 0.051934984175743236,
"volume": 385.0968728963473,
"volume_molar": 11.59553787408816,
"formula_full": "Ga20",
"formula_reduced": "Ga",
"formula_anonymous": "A",
"energy": -60.32827181,
"energy_per_atom": -3.0164135905,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
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"energy_uncorrected": -60.32827181,
"band_gap": 0.0,
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"total_magnetization": 0.0010182,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:31.253000Z",
"spacegroup": 63
}
]
}