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{
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{
"id": "jvasp-34330",
"created_at": "2022-09-04T14:36:38.554894Z",
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"structure_string": "Si6 O12\n1.0\n3.684019 -6.380908 -0.000000\n3.684019 6.380908 0.000000\n0.000000 0.000000 7.072515\nSi O\n6 12\ndirect\n0.766943 0.533885 0.250000 Si\n0.233057 0.466116 0.750000 Si\n0.766943 0.233057 0.583333 Si\n0.533885 0.766943 0.416667 Si\n0.233057 0.766943 0.083333 Si\n0.466116 0.233057 0.916666 Si\n0.612396 0.387604 0.083333 O\n0.683061 -0.000000 0.500000 O\n0.316939 0.316939 0.833332 O\n0.612396 0.224793 0.750000 O\n0.387604 0.612396 0.583333 O\n0.387604 0.775207 0.250000 O\n-0.000000 0.683061 0.166667 O\n0.775207 0.387604 0.416667 O\n0.316939 -0.000000 0.000000 O\n0.224793 0.612396 0.916666 O\n-0.000000 0.316939 0.666667 O\n0.683061 0.683061 0.333333 O\n",
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{
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{
"id": "jvasp-54225",
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"updated_at": "2022-09-04T14:37:05.145239Z",
"structure_string": "Si5 O10\n1.0\n6.979828 0.000000 0.000000\n0.000000 6.979828 -0.000000\n0.000000 0.000000 6.476733\nSi O\n5 10\ndirect\n0.269800 0.000000 0.119332 Si\n0.000000 0.269800 0.880668 Si\n0.000000 0.730200 0.880668 Si\n0.730200 0.000000 0.119332 Si\n0.000000 0.000000 0.500000 Si\n0.191717 0.000000 0.356443 O\n0.000000 0.191717 0.643557 O\n0.000000 0.808283 0.643557 O\n0.808283 0.000000 0.356443 O\n0.191027 0.808973 0.000000 O\n0.191027 0.191027 0.000000 O\n0.808973 0.808973 0.000000 O\n0.808973 0.191027 0.000000 O\n0.500000 0.000000 0.120253 O\n0.000000 0.500000 0.879747 O\n",
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{
"id": "jvasp-22578",
"created_at": "2022-09-04T14:37:00.346799Z",
"updated_at": "2022-09-04T14:37:00.346826Z",
"structure_string": "Si4 O8\n1.0\n4.977943 0.047834 -0.091091\n-2.417447 4.351799 -0.091091\n-0.042404 -0.072861 8.240652\nSi O\n4 8\ndirect\n0.204762 0.647392 0.288410 Si\n0.537204 0.307653 0.162144 Si\n0.647392 0.204761 0.788409 Si\n0.307653 0.537204 0.662143 Si\n0.558263 0.214890 0.975259 O\n0.431570 0.288042 0.670197 O\n0.583793 0.861942 0.734692 O\n0.214890 0.558263 0.475259 O\n0.861941 0.583793 0.234692 O\n0.440988 0.009102 0.271601 O\n0.288041 0.431570 0.170197 O\n0.009103 0.440988 0.771601 O\n",
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"elements": [
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"density": 2.224522110991391,
"density_atomic": 0.06688794883564594,
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},
{
"id": "jvasp-34540",
"created_at": "2022-09-04T14:37:07.673775Z",
"updated_at": "2022-09-04T14:37:07.673801Z",
"structure_string": "Si6 O12\n1.0\n8.537085 0.005748 -4.415405\n-7.256053 4.497947 -4.415405\n0.001635 0.005748 9.611327\nSi O\n6 12\ndirect\n0.817389 0.682613 0.250002 Si\n0.182612 0.317389 0.750001 Si\n0.250001 0.817390 0.682613 Si\n0.750000 0.182612 0.317389 Si\n0.682612 0.250001 0.817390 Si\n0.317389 0.750001 0.182613 Si\n-0.000000 0.000000 0.500000 O\n0.750000 0.489677 0.010325 O\n0.510325 0.989677 0.250002 O\n0.500000 0.000000 0.000000 O\n0.250000 0.510325 0.989677 O\n0.010325 0.750001 0.489677 O\n0.489676 0.010325 0.750001 O\n0.000001 0.500000 0.000001 O\n0.989676 0.250001 0.510325 O\n0.000000 0.500001 0.500001 O\n0.500000 0.000001 0.500001 O\n0.500000 0.500001 0.000001 O\n",
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{
"id": "jvasp-22611",
"created_at": "2022-09-04T14:36:59.625576Z",
"updated_at": "2022-09-04T14:36:59.625598Z",
"structure_string": "Si4 O8\n1.0\n5.051492 -0.000000 -0.000000\n-2.525746 4.374720 0.000000\n0.000000 0.000000 8.647848\nSi O\n4 8\ndirect\n0.666666 0.333333 0.936920 Si\n0.666666 0.333333 0.563080 Si\n0.333332 0.666667 0.063080 Si\n0.333332 0.666667 0.436920 Si\n-0.000000 0.406454 0.000000 O\n0.406453 0.406454 0.500000 O\n0.593546 0.000000 0.500000 O\n0.593546 0.593546 0.000000 O\n-0.000001 0.593546 0.500000 O\n0.666666 0.333333 0.750000 O\n0.333332 0.666667 0.250000 O\n0.406454 0.000000 0.000000 O\n",
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"elements": [
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"density": 2.0882962852061673,
"density_atomic": 0.06279184836526004,
"volume": 191.107608908023,
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"formula_full": "Si4 O8",
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"energy_above_hull": 1.395941866666667,
"spacegroup": 182
},
{
"id": "jvasp-7633",
"created_at": "2022-09-04T14:36:58.781711Z",
"updated_at": "2022-09-04T14:36:58.781727Z",
"structure_string": "Si1 O2\n1.0\n2.802661 -0.000000 1.618117\n0.934221 2.642375 1.618117\n0.000000 0.000000 3.236234\nSi O\n1 2\ndirect\n0.000000 0.000000 0.000000 Si\n0.750000 0.749999 0.750001 O\n0.250000 0.250000 0.250000 O\n",
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},
{
"id": "jvasp-34716",
"created_at": "2022-09-04T14:38:31.727142Z",
"updated_at": "2022-09-04T14:38:31.727169Z",
"structure_string": "Si4 O8\n1.0\n0.000000 4.828866 -0.138123\n5.669940 0.000000 0.000000\n0.000000 -1.374309 -4.823991\nSi O\n4 8\ndirect\n0.530159 0.500000 0.532778 Si\n0.525847 0.000000 0.536396 Si\n0.972591 0.000000 0.227625 Si\n0.016498 0.500000 0.008708 Si\n0.436523 0.749391 0.660274 O\n0.869919 0.742558 0.093811 O\n0.355889 0.500000 0.198400 O\n0.869919 0.257442 0.093811 O\n0.888464 0.500000 0.663170 O\n0.436523 0.250609 0.660274 O\n0.857369 0.000000 0.512935 O\n0.312404 0.000000 0.228833 O\n",
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"spacegroup": 6
},
{
"id": "jvasp-57276",
"created_at": "2022-09-04T14:38:34.329495Z",
"updated_at": "2022-09-04T14:38:34.329520Z",
"structure_string": "Si4 O8\n1.0\n4.820529 -0.003402 1.560058\n1.598101 6.420980 1.997864\n0.005035 -0.291411 6.905753\nSi O\n4 8\ndirect\n0.350897 0.949218 0.742519 Si\n0.649102 0.050783 0.257480 Si\n0.850897 0.742520 0.949217 Si\n0.149102 0.257480 0.050782 Si\n0.926161 0.137893 0.227222 O\n0.750000 0.838988 0.161012 O\n0.249999 0.161013 0.838987 O\n-0.000000 0.500000 -0.000000 O\n0.573837 0.772778 0.862107 O\n0.073837 0.862107 0.772777 O\n0.500000 0.000000 0.500000 O\n0.426161 0.227222 0.137893 O\n",
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{
"id": "jvasp-57816",
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"updated_at": "2022-09-04T14:38:31.246046Z",
"structure_string": "Si8 O16\n1.0\n3.879735 0.000000 0.000000\n0.000000 8.699506 0.000000\n0.000000 0.000000 9.865029\nSi O\n8 16\ndirect\n0.343093 0.325127 0.608076 Si\n0.656906 0.674873 0.608076 Si\n0.343093 0.825127 0.891924 Si\n0.656906 0.174873 0.891924 Si\n0.343093 0.174873 0.108076 Si\n0.656906 0.825127 0.108076 Si\n0.343093 0.674873 0.391924 Si\n0.656906 0.325127 0.391924 Si\n0.499999 0.250000 0.750000 O\n0.499999 0.250000 0.250000 O\n0.499999 0.500000 0.633902 O\n0.499999 0.750000 0.750000 O\n0.000000 0.644680 0.500000 O\n0.499999 0.699420 0.000000 O\n0.499999 0.000000 0.866098 O\n0.499999 0.500000 0.366098 O\n0.499999 0.000000 0.133902 O\n0.000000 0.144680 0.000000 O\n0.000000 0.855321 0.000000 O\n0.499999 0.300580 0.000000 O\n0.499999 0.750000 0.250000 O\n0.000000 0.355320 0.500000 O\n0.499999 0.199420 0.500000 O\n0.499999 0.800581 0.500000 O\n",
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"formula_full": "Si8 O16",
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{
"id": "jvasp-51622",
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"structure_string": "Si3 O6\n1.0\n2.285250 -3.958168 0.000000\n2.285250 3.958168 -0.000000\n0.000000 -0.000000 6.773493\nSi O\n3 6\ndirect\n0.915155 -0.000000 0.666667 Si\n0.084845 0.084845 0.000000 Si\n-0.000000 0.915155 0.333333 Si\n0.119014 0.462566 0.921019 O\n0.537434 0.656448 0.587686 O\n0.462566 0.119014 0.078981 O\n0.343552 0.880986 0.254353 O\n0.880986 0.343552 0.745646 O\n0.656448 0.537434 0.412314 O\n",
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{
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"structure_string": "Si8 O16\n1.0\n6.606101 0.000000 0.000000\n0.000000 6.606101 0.000000\n0.000000 -0.000000 8.147309\nSi O\n8 16\ndirect\n0.239825 0.463282 0.402674 Si\n0.239825 0.536718 0.902674 Si\n0.463282 0.760175 0.597327 Si\n0.536718 0.239825 0.597327 Si\n0.536718 0.760175 0.097327 Si\n0.760175 0.463282 0.902674 Si\n0.463282 0.239825 0.097327 Si\n0.760175 0.536718 0.402674 Si\n0.333695 0.692749 0.432195 O\n0.000000 0.500000 0.381908 O\n0.500000 0.000000 0.118092 O\n0.670054 0.329946 0.750000 O\n0.329946 0.329946 0.250000 O\n0.333695 0.307250 0.932195 O\n0.307250 0.333695 0.567805 O\n0.000000 0.500000 0.881908 O\n0.670054 0.670054 0.250000 O\n0.666305 0.692749 0.932195 O\n0.692749 0.333695 0.067805 O\n0.307250 0.666305 0.067805 O\n0.692749 0.666305 0.567805 O\n0.329946 0.670054 0.750000 O\n0.666305 0.307250 0.432195 O\n0.500000 0.000000 0.618092 O\n",
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"formula_full": "Si8 O16",
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"spacegroup": 116
}
]
}