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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=363",
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{
"id": "jvasp-99276",
"created_at": "2022-09-04T14:36:20.021680Z",
"updated_at": "2022-09-04T14:36:20.021692Z",
"structure_string": "Si4 O8\n1.0\n4.300199 -0.012187 -0.186557\n0.012530 4.268905 0.005724\n0.372337 -0.010157 6.859759\nSi O\n4 8\ndirect\n0.795265 0.961284 0.063019 Si\n0.708199 0.624079 0.439812 Si\n0.295295 0.038721 0.563014 Si\n0.208139 0.375906 0.939787 Si\n0.103688 0.253778 0.719113 O\n0.554970 0.205002 -0.051613 O\n0.043500 0.726595 -0.059078 O\n0.544343 -0.223934 0.638743 O\n0.603726 0.746236 0.219143 O\n0.543560 0.273397 0.440933 O\n0.044302 0.223935 0.138726 O\n0.055020 -0.205007 0.448396 O\n",
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{
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"structure_string": "Si8 O16\n1.0\n4.193177 -0.000000 0.000000\n-0.000000 7.697544 0.000000\n0.000000 0.000000 8.325300\nSi O\n8 16\ndirect\n0.233398 0.880138 0.884768 Si\n0.766603 0.380139 0.615232 Si\n0.233398 0.119861 0.615232 Si\n0.233398 0.619861 0.384768 Si\n0.766603 0.619861 0.884768 Si\n0.233398 0.380139 0.115232 Si\n0.766603 0.880138 0.384768 Si\n0.766603 0.119861 0.115232 Si\n0.586902 0.000000 0.250000 O\n0.000000 0.500000 0.500000 O\n0.000000 0.750000 0.785149 O\n0.000000 0.000000 0.000000 O\n0.500000 0.750000 0.971686 O\n0.500000 0.750000 0.471686 O\n0.500000 0.250000 0.028314 O\n0.000000 0.250000 0.214851 O\n0.413098 0.500000 0.250000 O\n0.500000 0.250000 0.528314 O\n0.000000 0.500000 0.000000 O\n0.413098 0.000000 0.750000 O\n0.000000 0.750000 0.285149 O\n0.000000 0.250000 0.714851 O\n0.586902 0.500000 0.750000 O\n0.000000 0.000000 0.500000 O\n",
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},
{
"id": "jvasp-34733",
"created_at": "2022-09-04T14:37:10.729829Z",
"updated_at": "2022-09-04T14:37:10.729865Z",
"structure_string": "Si4 O8\n1.0\n4.592410 -0.000023 1.368214\n2.167217 4.467757 1.117036\n0.028292 0.165200 8.296093\nSi O\n4 8\ndirect\n0.701114 0.061882 0.313697 Si\n0.298886 0.938119 0.686302 Si\n0.923319 0.561864 0.813693 Si\n0.076681 0.438137 0.186307 Si\n0.854595 0.283815 0.320900 O\n0.459297 0.216220 0.179103 O\n0.004309 0.249992 0.749994 O\n0.995690 0.750009 0.250005 O\n0.145405 0.716186 0.679100 O\n0.540703 0.783781 0.820896 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n",
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"elements": [
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"volume": 169.68720855859257,
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"formula_full": "Si4 O8",
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"spacegroup": 15
},
{
"id": "jvasp-34188",
"created_at": "2022-09-04T14:37:09.018801Z",
"updated_at": "2022-09-04T14:37:09.018821Z",
"structure_string": "Si6 O6\n1.0\n2.260048 -3.914518 0.000000\n2.260048 3.914518 -0.000000\n-0.000000 -0.000000 9.577221\nSi O\n6 6\ndirect\n0.500000 0.000000 0.274560 Si\n0.500000 0.000000 0.725440 Si\n0.000000 0.500000 0.058774 Si\n0.000000 0.500000 0.607893 Si\n0.500000 0.500000 0.941226 Si\n0.500000 0.500000 0.392107 Si\n0.336038 0.168020 0.833333 O\n0.831981 0.168020 0.166667 O\n0.831981 0.663963 0.500000 O\n0.168020 0.336038 0.500000 O\n0.168020 0.831981 0.166667 O\n0.663963 0.831981 0.833333 O\n",
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"elements": [
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"formula_full": "Si6 O6",
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},
{
"id": "jvasp-34659",
"created_at": "2022-09-04T14:37:09.029476Z",
"updated_at": "2022-09-04T14:37:09.029496Z",
"structure_string": "Si4 O8\n1.0\n4.954618 -0.021621 -0.043016\n-1.532971 6.978970 -0.053275\n-1.786389 -3.447669 6.104939\nSi O\n4 8\ndirect\n0.795733 0.152513 0.284295 Si\n0.431674 0.152449 0.538713 Si\n0.821753 0.569161 0.619941 Si\n0.472735 0.871499 0.771027 Si\n0.689188 0.404326 0.707604 O\n0.621296 0.721749 0.619106 O\n0.789684 0.404382 0.367509 O\n0.174631 0.721770 0.773326 O\n0.722360 0.024961 0.022570 O\n0.376316 0.024827 0.672689 O\n0.549002 0.021902 0.346575 O\n0.124415 0.173400 0.421489 O\n",
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"volume": 209.21930310776574,
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"formula_full": "Si4 O8",
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"spacegroup": 5
},
{
"id": "jvasp-34584",
"created_at": "2022-09-04T14:37:17.061284Z",
"updated_at": "2022-09-04T14:37:17.061305Z",
"structure_string": "Si4 O8\n1.0\n0.000000 4.330307 -0.002258\n4.254087 0.000000 0.000000\n0.000000 -0.518344 -7.930356\nSi O\n4 8\ndirect\n0.554106 0.417150 0.805349 Si\n0.862326 0.010323 0.321456 Si\n0.137675 0.010323 0.678544 Si\n0.445896 0.417150 0.194652 Si\n0.500000 0.329569 0.000000 O\n0.372380 0.771070 0.793909 O\n0.000000 0.850586 0.500000 O\n0.891372 0.225266 0.785461 O\n0.375088 0.282955 0.633676 O\n0.624914 0.282955 0.366325 O\n0.627622 0.771070 0.206092 O\n0.108629 0.225266 0.214540 O\n",
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"elements": [
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"density": 2.73172863490787,
"density_atomic": 0.08213886670838925,
"volume": 146.09405365431442,
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"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5195852000000003,
"spacegroup": 3
},
{
"id": "jvasp-34375",
"created_at": "2022-09-04T14:37:19.248166Z",
"updated_at": "2022-09-04T14:37:19.248189Z",
"structure_string": "Si8 O16\n1.0\n8.225999 0.000000 0.000000\n-0.000000 8.225999 0.000000\n0.000000 0.000000 5.563821\nSi O\n8 16\ndirect\n0.313431 0.931221 0.500000 Si\n0.686569 0.931221 0.000000 Si\n0.686569 0.068780 0.500000 Si\n0.931221 0.686569 0.000000 Si\n0.931221 0.313431 0.500000 Si\n0.313431 0.068780 0.000000 Si\n0.068780 0.313431 0.000000 Si\n0.068780 0.686569 0.500000 Si\n0.764162 0.000000 0.250000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.235838 0.250000 O\n0.764162 0.000000 0.750000 O\n0.000000 0.500000 0.500000 O\n0.000000 0.764162 0.250000 O\n0.000000 0.764162 0.750000 O\n0.733716 0.266284 0.500000 O\n0.235838 0.000000 0.750000 O\n0.266284 0.266284 0.000000 O\n0.500000 0.000000 0.500000 O\n0.235838 0.000000 0.250000 O\n0.733716 0.733716 0.000000 O\n0.266284 0.733716 0.500000 O\n0.000000 0.235838 0.750000 O\n0.000000 0.500000 0.000000 O\n",
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"volume": 376.4874069214184,
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"formula_full": "Si8 O16",
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"spacegroup": 132
},
{
"id": "jvasp-34291",
"created_at": "2022-09-04T14:37:13.415396Z",
"updated_at": "2022-09-04T14:37:13.415427Z",
"structure_string": "Si4 O8\n1.0\n0.000000 4.304160 0.011656\n4.268538 0.000000 0.000000\n0.000000 -4.209095 -6.882113\nSi O\n4 8\ndirect\n0.305855 0.124101 0.880652 Si\n0.016182 0.538715 0.003894 Si\n0.016181 0.461285 0.503893 Si\n0.305856 0.875899 0.380652 Si\n0.980797 0.246210 0.660023 O\n0.340897 0.723954 0.579579 O\n0.340898 0.276046 0.079579 O\n0.661292 0.704977 0.389257 O\n0.142339 0.773389 0.881783 O\n0.142340 0.226611 0.381783 O\n0.980798 0.753790 0.160023 O\n0.661291 0.295024 0.889257 O\n",
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"formula_full": "Si4 O8",
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"spacegroup": 7
},
{
"id": "jvasp-34491",
"created_at": "2022-09-04T14:37:19.830923Z",
"updated_at": "2022-09-04T14:37:19.830945Z",
"structure_string": "Si8 O16\n1.0\n4.805242 0.000000 1.129147\n2.402620 7.601787 0.564574\n0.009096 0.000000 10.750546\nSi O\n8 16\ndirect\n0.886425 0.379843 0.615971 Si\n0.113575 0.620157 0.384029 Si\n0.382239 0.120157 0.884030 Si\n0.497604 0.120157 0.615971 Si\n0.617761 0.879843 0.115971 Si\n0.502396 0.879843 0.384029 Si\n0.266268 0.620157 0.115971 Si\n0.733732 0.379843 0.884030 Si\n0.500000 -0.000000 0.500000 O\n0.423012 0.750000 0.153975 O\n0.038162 0.250000 0.923676 O\n0.498729 0.002542 0.750000 O\n0.500000 0.500000 -0.000000 O\n0.826987 0.750000 0.346025 O\n0.173013 0.250000 0.653976 O\n0.248729 0.502543 0.250000 O\n0.961838 0.750000 0.076324 O\n0.501271 0.997458 0.250000 O\n0.000000 0.500000 0.500000 O\n0.711838 0.250000 0.576324 O\n0.576988 0.250000 0.846025 O\n0.288162 0.750000 0.423676 O\n0.751271 0.497458 0.750000 O\n0.500000 -0.000000 0.000000 O\n",
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"spacegroup": 70
},
{
"id": "jvasp-34650",
"created_at": "2022-09-04T14:37:19.332917Z",
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"structure_string": "Si4 O8\n1.0\n-5.179253 -0.004868 0.091283\n0.682957 5.488951 -0.097670\n0.044482 -2.205989 -6.071411\nSi O\n4 8\ndirect\n0.684892 0.769790 0.748565 Si\n0.947018 0.301885 0.797792 Si\n0.842450 0.900592 0.351753 Si\n0.312921 0.735862 0.045275 Si\n0.952851 0.182756 0.530471 O\n0.830156 0.063196 0.879915 O\n0.758822 0.704342 0.492976 O\n0.571822 0.872396 0.208058 O\n0.075344 0.845315 0.188599 O\n0.221700 0.420607 0.949551 O\n0.377850 0.791833 0.811784 O\n0.771546 0.538900 0.831643 O\n",
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"spacegroup": 1
},
{
"id": "jvasp-8150",
"created_at": "2022-09-04T14:37:05.474771Z",
"updated_at": "2022-09-04T14:37:05.474790Z",
"structure_string": "Si2 O4\n1.0\n5.083109 0.000000 -2.442157\n-1.083838 4.054854 -2.255901\n-0.954122 -0.537284 4.525164\nSi O\n2 4\ndirect\n-0.000001 0.749999 -0.000001 Si\n-0.000000 0.250000 -0.000000 Si\n-0.001343 0.646792 0.293584 O\n0.705072 0.853207 0.706414 O\n0.294928 0.146793 0.293585 O\n0.001343 0.353208 0.706415 O\n",
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"formula_full": "Si2 O4",
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"spacegroup": 140
},
{
"id": "jvasp-57434",
"created_at": "2022-09-04T14:37:08.414932Z",
"updated_at": "2022-09-04T14:37:08.414951Z",
"structure_string": "Si8 O16\n1.0\n5.748884 0.070715 0.000000\n-0.529226 5.724909 0.000000\n0.000000 0.000000 11.345948\nSi O\n8 16\ndirect\n0.510968 0.383115 0.871046 Si\n0.616884 0.489031 0.371046 Si\n0.989031 0.116884 0.871046 Si\n0.010968 0.883116 0.128954 Si\n0.883115 0.010967 0.371046 Si\n0.489031 0.616884 0.128954 Si\n0.116884 0.989032 0.628954 Si\n0.383115 0.510968 0.628954 Si\n0.250000 0.250000 0.637540 O\n0.749999 0.749999 0.362460 O\n0.458862 0.458863 0.250000 O\n0.000000 0.000000 0.000000 O\n0.499999 0.500000 0.000000 O\n0.041137 0.041137 0.250000 O\n0.749999 0.749999 0.137540 O\n0.499999 0.500000 0.500000 O\n0.749999 0.249999 0.373278 O\n0.958862 0.958862 0.750000 O\n0.249999 0.750000 0.626723 O\n0.250000 0.250000 0.862460 O\n0.749999 0.249999 0.873278 O\n0.541136 0.541137 0.750000 O\n0.249999 0.750000 0.126723 O\n0.000000 0.000000 0.500000 O\n",
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"volume": 373.8406129289621,
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"formula_full": "Si8 O16",
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"spacegroup": 68
}
]
}