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"nsites": 40,
"nelements": 2,
"elements": [
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],
"chemical_system": "Al-O",
"density": 2.9295018304498925,
"density_atomic": 0.0969555914532673,
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"volume_molar": 6.211236164654495,
"formula_full": "Al8 O32",
"formula_reduced": "AlO4",
"formula_anonymous": "AB4",
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"spacegroup": 1
},
{
"id": "oqmd-711439",
"created_at": "2022-09-04T15:20:29.316641Z",
"updated_at": "2022-09-04T15:20:29.316661Z",
"structure_string": "Na39 Ga8 O32\n1.0\n10.360532 0.000832 -0.033658\n0.000496 10.151513 -0.004663\n-0.033940 -0.005935 10.571272\nGa Na O\n8 39 32\ndirect\n0.151598 0.113449 0.129194 Ga\n0.354197 0.613753 0.132634 Ga\n0.858965 0.620220 0.361889 Ga\n0.652957 0.113485 0.366424 Ga\n0.144286 0.392020 0.629142 Ga\n0.352595 0.888409 0.631536 Ga\n0.853452 0.888438 0.866051 Ga\n0.648303 0.385777 0.869278 Ga\n0.885311 0.643065 0.091828 Na\n0.617266 0.143446 0.099373 Na\n0.108387 0.830158 0.110974 Na\n0.653434 0.859040 0.113578 Na\n0.848817 0.360533 0.115469 Na\n0.397955 0.325344 0.122151 Na\n0.881471 0.083115 0.138867 Na\n0.623965 0.577413 0.142721 Na\n0.379266 0.902443 0.167194 Na\n0.124995 0.395378 0.167506 Na\n0.880732 0.901139 0.330335 Na\n0.623870 0.402218 0.353284 Na\n0.125547 0.583256 0.354720 Na\n0.152906 0.857156 0.377239 Na\n0.609122 0.827476 0.382675 Na\n0.383371 0.077667 0.382756 Na\n0.897255 0.337286 0.383696 Na\n0.348194 0.353844 0.391470 Na\n0.114407 0.137738 0.401859 Na\n0.382981 0.642543 0.403126 Na\n0.884945 0.859313 0.594594 Na\n0.106711 0.674850 0.612898 Na\n0.846180 0.142611 0.613697 Na\n0.650447 0.630640 0.614137 Na\n0.621938 0.919747 0.637862 Na\n0.863671 0.414272 0.640482 Na\n0.528938 0.290204 0.642853 Na\n0.134698 0.110498 0.663381 Na\n0.378417 0.602521 0.665453 Na\n0.877584 0.605815 0.830323 Na\n0.620955 0.096373 0.840147 Na\n0.123318 0.921042 0.853904 Na\n0.377990 0.425469 0.868748 Na\n0.347873 0.145851 0.870746 Na\n0.896132 0.170894 0.882397 Na\n0.605819 0.669978 0.882484 Na\n0.153018 0.642662 0.882555 Na\n0.112826 0.364946 0.903577 Na\n0.384414 0.860284 0.904621 Na\n0.246602 0.006990 0.017835 O\n0.254219 0.505805 0.025783 O\n0.028863 0.227543 0.049510 O\n0.475637 0.724868 0.050146 O\n0.054708 0.000679 0.238533 O\n0.256256 0.723630 0.238819 O\n0.249339 0.216794 0.244224 O\n0.448649 0.501270 0.246924 O\n0.952262 0.505071 0.251025 O\n0.757037 0.724739 0.252688 O\n0.553578 0.001668 0.256671 O\n0.752111 0.222187 0.259253 O\n0.979608 0.732492 0.443853 O\n0.532688 0.226125 0.443885 O\n0.767144 0.515470 0.473006 O\n0.746714 0.001861 0.474987 O\n0.241575 0.500077 0.521153 O\n0.245429 0.983491 0.522676 O\n0.025885 0.275010 0.549218 O\n0.474164 0.775066 0.549257 O\n0.045800 0.502073 0.740029 O\n0.256900 0.778250 0.742816 O\n0.449245 0.997779 0.743323 O\n0.245529 0.293892 0.744382 O\n0.948728 0.000913 0.754005 O\n0.549372 0.494569 0.756792 O\n0.752212 0.780690 0.757670 O\n0.739616 0.272178 0.760465 O\n0.976325 0.775286 0.945243 O\n0.525815 0.274172 0.950660 O\n0.745897 0.496882 0.974739 O\n0.759229 0.996139 0.977691 O\n",
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"nelements": 3,
"elements": [
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"Na",
"O"
],
"chemical_system": "Ga-Na-O",
"density": 2.9368243641492313,
"density_atomic": 0.07105451112273323,
"volume": 1111.8224409924155,
"volume_molar": 8.475381316181165,
"formula_full": "Na39 Ga8 O32",
"formula_reduced": "Na39(GaO4)8",
"formula_anonymous": "A8B32C39",
"formation_energy": -1.74673997204221,
"spacegroup": 1
}
]
}