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"updated_at": "2021-11-28T01:34:29.729000Z",
"spacegroup": 221
},
{
"id": "mp-757849",
"created_at": "2022-09-04T14:39:16.897934Z",
"structure_string": "Na6 W8 O24\n1.0\n3.928391 5.589712 0.000000\n-3.928391 5.589712 0.000000\n0.000000 0.023593 11.151246\nNa W O\n6 8 24\ndirect\n0.999396 0.999396 0.998077 Na\n0.249423 0.249423 0.748203 Na\n0.500584 0.500584 0.998245 Na\n0.249400 0.249400 0.252094 Na\n0.500500 0.500500 0.501926 Na\n0.750633 0.750633 0.251687 Na\n0.998842 0.501050 0.998057 W\n0.248813 0.751239 0.748039 W\n0.751239 0.248813 0.748039 W\n0.998735 0.501395 0.502183 W\n0.501050 0.998842 0.998057 W\n0.501395 0.998735 0.502183 W\n0.750830 0.248832 0.252050 W\n0.248832 0.750830 0.252050 W\n0.615943 0.151897 0.883421 O\n0.151897 0.615943 0.883421 O\n0.136716 0.597549 0.626856 O\n0.597549 0.136716 0.626856 O\n0.011102 0.011102 0.250121 O\n0.506731 0.506731 0.750970 O\n0.749392 0.749392 0.988978 O\n0.252449 0.252449 0.487431 O\n0.364570 0.900669 0.873210 O\n0.900669 0.364570 0.873210 O\n0.117097 0.641228 0.379950 O\n0.357994 0.883501 0.617497 O\n0.641228 0.117097 0.379950 O\n0.883501 0.357994 0.617497 O\n0.099339 0.629954 0.129585 O\n0.629954 0.099339 0.129585 O\n0.487056 0.487056 0.248176 O\n0.748000 0.748000 0.510078 O\n0.995126 0.995126 0.749790 O\n0.250248 0.250248 0.014537 O\n0.402337 0.868972 0.370112 O\n0.868972 0.402337 0.370112 O\n0.849076 0.383385 0.118886 O\n0.383385 0.849076 0.118886 O\n",
"nsites": 38,
"nelements": 3,
"elements": [
"Na",
"W",
"O"
],
"chemical_system": "Na-O-W",
"density": 6.756492957842324,
"density_atomic": 0.0775936291355225,
"volume": 489.73092795583057,
"volume_molar": 7.76112784914587,
"formula_full": "Na6 W8 O24",
"formula_reduced": "Na3(WO3)4",
"formula_anonymous": "A3B4C12",
"energy": -312.57634125000004,
"energy_per_atom": -8.225693190789475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -260.58434125,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.9999132,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:29.952000Z",
"spacegroup": 8
}
]
}