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"volume_molar": 10.469820628246051,
"formula_full": "Ba4 W4 N12",
"formula_reduced": "BaWN3",
"formula_anonymous": "ABC3",
"energy": -176.00684613,
"energy_per_atom": -8.800342306500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -171.67484613,
"band_gap": 1.2852,
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"is_magnetic": false,
"total_magnetization": 0.0006737,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:48.294000Z",
"spacegroup": 14
},
{
"id": "mp-989621",
"created_at": "2022-09-04T14:42:12.259647Z",
"structure_string": "La2 Os2 N6\n1.0\n3.665257 0.000000 0.000000\n0.000000 5.700173 0.000000\n0.000000 0.000000 6.747489\nLa Os N\n2 2 6\ndirect\n0.000000 0.250000 0.207788 La\n0.000000 0.750000 0.792212 La\n0.500000 0.250000 0.805246 Os\n0.500000 0.750000 0.194754 Os\n0.500000 0.507349 0.405753 N\n0.500000 0.000000 0.000000 N\n0.500000 0.992651 0.405753 N\n0.500000 0.492651 0.594247 N\n0.500000 0.500000 0.000000 N\n0.500000 0.007349 0.594247 N\n",
"nsites": 10,
"nelements": 3,
"elements": [
"La",
"Os",
"N"
],
"chemical_system": "La-N-Os",
"density": 8.74380415861319,
"density_atomic": 0.07093577962367494,
"volume": 140.97258186279922,
"volume_molar": 8.489567312783999,
"formula_full": "La2 Os2 N6",
"formula_reduced": "LaOsN3",
"formula_anonymous": "ABC3",
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"updated_at": "2021-11-28T01:35:41.855000Z",
"spacegroup": 51
}
]
}