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{
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O\n0.501782 0.239120 0.574811 O\n-0.000142 0.623900 0.934557 O\n",
"nsites": 196,
"nelements": 2,
"elements": [
"W",
"O"
],
"chemical_system": "O-W",
"density": 6.741921667361569,
"density_atomic": 0.06903033937353742,
"volume": 2839.3312531668653,
"volume_molar": 8.723904321856152,
"formula_full": "W50 O146",
"formula_reduced": "W25O73",
"formula_anonymous": "A25B73",
"energy": -1795.48927899,
"energy_per_atom": -9.160659586683673,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1473.28727899,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.536819,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:41.581000Z",
"spacegroup": 13
},
{
"id": "mp-1204533",
"created_at": "2022-09-04T14:43:00.443139Z",
"structure_string": "Mg45 Si32 H58 O138\n1.0\n-0.004937 0.000000 -7.376995\n-0.000000 -9.341839 0.000000\n-41.203040 4.670920 0.991632\nMg Si H O\n45 32 58 138\ndirect\n0.500000 0.000000 0.000000 Mg\n0.500000 0.334821 0.000000 Mg\n0.500000 0.665179 1.000000 Mg\n0.460032 0.466876 0.933753 Mg\n0.539968 0.533124 0.066247 Mg\n0.460276 0.132185 0.932701 Mg\n0.460276 0.800516 0.932701 Mg\n0.539724 0.867815 0.067299 Mg\n0.539724 0.199484 0.067299 Mg\n0.430495 0.933361 0.866723 Mg\n0.569505 0.066639 0.133277 Mg\n0.427667 0.268311 0.866742 Mg\n0.427667 0.598431 0.866742 Mg\n0.572333 0.731689 0.133258 Mg\n0.572333 0.401569 0.133258 Mg\n0.412704 0.400344 0.800689 Mg\n0.587296 0.599656 0.199311 Mg\n0.414938 0.066249 0.800177 Mg\n0.414938 0.733928 0.800177 Mg\n0.585062 0.933751 0.199823 Mg\n0.585062 0.266072 0.199823 Mg\n0.409757 0.867181 0.734361 Mg\n0.590243 0.132819 0.265639 Mg\n0.409311 0.201430 0.733714 Mg\n0.409311 0.532284 0.733714 Mg\n0.590689 0.798570 0.266286 Mg\n0.590689 0.467716 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{
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{
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},
{
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"elements": [
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"updated_at": "2021-11-28T01:35:07.679000Z",
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},
{
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},
{
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"updated_at": "2021-11-28T01:37:26.553000Z",
"spacegroup": 167
},
{
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}
]
}