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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=1132",
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{
"id": "jvasp-26341",
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"structure_string": "Si2 O4\n1.0\n4.516480 -0.772413 -2.188273\n-2.571472 4.334240 -0.621306\n-0.458145 0.772360 4.997764\nSi O\n2 4\ndirect\n0.000004 -0.000000 0.000003 Si\n0.500005 0.750005 0.250002 Si\n0.357588 0.375003 0.232585 O\n0.857589 0.982587 0.625003 O\n0.142408 0.767406 0.125001 O\n0.642406 0.875002 0.017404 O\n",
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{
"id": "jvasp-57447",
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"structure_string": "Si6 O12\n1.0\n4.568097 0.000105 -0.821579\n-0.332101 4.695044 -1.845923\n-0.009359 -0.030966 6.846603\nSi O\n6 12\ndirect\n0.670742 0.691040 0.673335 Si\n0.329259 0.308957 0.326664 Si\n0.750000 0.356627 -0.000000 Si\n0.170741 0.982292 0.673335 Si\n0.250000 0.643371 0.000000 Si\n0.829259 0.017705 0.326664 Si\n0.539201 0.547935 0.850587 O\n0.317768 0.656199 0.517086 O\n0.539699 0.036543 0.818977 O\n0.182232 0.139113 0.482913 O\n0.682232 0.343798 0.482913 O\n0.960301 0.217565 0.181022 O\n0.960800 0.697348 0.149412 O\n0.039699 0.782432 0.818978 O\n0.039200 0.302650 0.850587 O\n0.460301 0.963454 0.181022 O\n0.817768 0.860884 0.517086 O\n0.460800 0.452062 0.149412 O\n",
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{
"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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"volume": 215.81751857955223,
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"formula_full": "Si4 O8",
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"spacegroup": 15
},
{
"id": "jvasp-34447",
"created_at": "2022-09-04T14:38:30.073542Z",
"updated_at": "2022-09-04T14:38:30.073569Z",
"structure_string": "Si4 O8\n1.0\n5.343226 0.029706 -0.598552\n-1.065465 5.236004 -0.598552\n-0.016440 -0.020237 5.485653\nSi O\n4 8\ndirect\n0.954991 0.051856 0.501790 Si\n0.372738 0.527856 0.084583 Si\n0.527857 0.372737 0.584583 Si\n0.051856 0.954989 0.001790 Si\n0.566894 0.484255 0.879934 O\n0.874063 0.898483 0.220142 O\n0.273731 0.787135 0.029130 O\n0.151780 0.265943 0.034892 O\n0.898485 0.874061 0.720142 O\n0.787136 0.273730 0.529130 O\n0.484257 0.566893 0.379934 O\n0.265944 0.151779 0.534892 O\n",
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{
"id": "jvasp-51622",
"created_at": "2022-09-04T14:38:34.309986Z",
"updated_at": "2022-09-04T14:38:34.310011Z",
"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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"volume": 122.53795352218609,
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"formula_full": "Si3 O6",
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"spacegroup": 154
},
{
"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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"elements": [
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"density": 2.997197143176241,
"density_atomic": 0.09012109530067622,
"volume": 133.15417394743935,
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"formula_full": "Si4 O8",
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"formula_anonymous": "AB2",
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"spacegroup": 6
},
{
"id": "jvasp-88107",
"created_at": "2022-09-04T14:36:04.514748Z",
"updated_at": "2022-09-04T14:36:04.514775Z",
"structure_string": "Si12 O24\n1.0\n6.859275 0.000000 0.000000\n-3.429638 5.940307 -0.000000\n-0.000000 0.000000 13.574429\nSi O\n12 24\ndirect\n0.176540 0.772460 0.048717 Si\n0.227540 0.823460 0.284617 Si\n0.404080 0.227540 0.951283 Si\n0.595919 0.772460 0.951283 Si\n0.823459 0.595920 0.617950 Si\n0.176540 0.404081 0.617950 Si\n0.823459 0.227540 0.048717 Si\n0.772459 0.176541 0.284617 Si\n0.227540 0.404081 0.382050 Si\n0.595919 0.823460 0.715383 Si\n0.772459 0.595920 0.382050 Si\n0.404080 0.176541 0.715383 Si\n0.817418 0.817419 0.666667 O\n0.605654 0.394345 0.666667 O\n0.182582 -0.000000 0.000000 O\n0.211310 0.605655 0.333333 O\n0.812857 0.187142 0.166667 O\n0.187142 0.812858 0.166667 O\n0.605654 0.211310 0.000000 O\n0.500000 0.500000 0.362711 O\n0.500000 -0.000000 0.303955 O\n-0.000000 0.500000 0.029378 O\n0.394345 0.605655 0.666667 O\n0.394345 0.788691 0.000000 O\n0.187142 0.374285 0.500000 O\n0.182582 0.182582 0.666667 O\n0.500000 -0.000000 0.696045 O\n0.500000 0.500000 0.970622 O\n0.625715 0.812858 0.833333 O\n0.788690 0.394345 0.333333 O\n-0.000000 0.817419 0.333333 O\n-0.000000 0.500000 0.637289 O\n-0.000000 0.182582 0.333333 O\n0.812857 0.625715 0.500000 O\n0.817418 -0.000000 0.000000 O\n0.374285 0.187142 0.833333 O\n",
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{
"id": "jvasp-91213",
"created_at": "2022-09-04T14:36:07.076526Z",
"updated_at": "2022-09-04T14:36:07.076544Z",
"structure_string": "Si6 O12\n1.0\n4.577211 -0.000000 1.611295\n1.817332 6.777340 2.144396\n-0.016873 0.047090 7.354828\nSi O\n6 12\ndirect\n0.037145 0.750000 0.250001 Si\n0.904498 0.818642 0.848713 Si\n0.571852 0.681358 0.651290 Si\n0.095501 0.181358 0.151289 Si\n0.428148 0.318642 0.348712 Si\n0.962855 0.250000 0.750001 Si\n0.732839 0.785681 0.430471 O\n0.948990 0.714319 0.069531 O\n0.371232 0.239547 0.181238 O\n0.705041 0.442565 0.680356 O\n0.207984 0.739547 0.681238 O\n0.051010 0.285681 0.930470 O\n0.267161 0.214319 0.569530 O\n0.172038 0.942565 0.180356 O\n0.294959 0.557435 0.319645 O\n0.827962 0.057435 0.819645 O\n0.628768 0.760453 0.818764 O\n0.792016 0.260453 0.318763 O\n",
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{
"id": "jvasp-97720",
"created_at": "2022-09-04T14:36:12.400497Z",
"updated_at": "2022-09-04T14:36:12.400512Z",
"structure_string": "Si12 O24\n1.0\n8.711579 0.000000 -3.080009\n-4.355790 7.544449 -3.080009\n-0.000000 -0.000000 9.240025\nSi O\n12 24\ndirect\n0.249243 0.624622 0.124622 Si\n0.624622 0.500000 0.375378 Si\n0.875378 0.500000 0.124622 Si\n0.875378 0.375378 0.750757 Si\n0.624622 0.124622 0.249243 Si\n0.124622 0.875379 0.500000 Si\n0.500000 0.124622 0.875379 Si\n0.500000 0.375378 0.624622 Si\n0.750757 0.875379 0.375378 Si\n0.375378 0.750757 0.875379 Si\n0.124622 0.249243 0.624622 Si\n0.375378 0.624622 0.500000 Si\n0.262337 0.631169 0.631169 O\n0.368831 0.631169 -0.000000 O\n0.500000 0.912451 0.087549 O\n0.631169 0.000000 0.368831 O\n0.000000 0.631169 0.368831 O\n0.912451 0.087549 0.500000 O\n0.368831 0.737663 0.368831 O\n0.500000 0.587549 0.412451 O\n0.824902 0.412451 0.912451 O\n0.737663 0.368831 0.368831 O\n0.631169 0.368831 -0.000000 O\n0.087549 0.500000 0.912451 O\n0.000000 0.368831 0.631169 O\n0.412451 0.500000 0.587549 O\n0.587549 0.175098 0.087549 O\n0.587549 0.412451 0.500000 O\n0.631169 0.631169 0.262337 O\n0.087549 0.587549 0.175098 O\n0.368831 0.368831 0.737663 O\n0.631169 0.262337 0.631169 O\n0.912451 0.824902 0.412451 O\n0.412451 0.912451 0.824902 O\n0.175098 0.087549 0.587549 O\n0.368831 0.000000 0.631169 O\n",
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{
"id": "jvasp-97422",
"created_at": "2022-09-04T14:36:08.780748Z",
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"structure_string": "Si12 O24\n1.0\n5.007229 0.000000 0.000000\n-0.000000 10.892798 -2.390986\n0.000000 0.133602 11.151324\nSi O\n12 24\ndirect\n0.230471 0.994342 0.417524 Si\n0.148233 0.380311 0.619689 Si\n0.230471 0.582475 0.005658 Si\n0.229477 0.246171 0.343213 Si\n0.648233 0.619689 0.380310 Si\n0.648090 0.275176 0.724823 Si\n0.730471 0.417525 0.994341 Si\n0.729477 0.753829 0.656786 Si\n0.729477 0.343213 0.246170 Si\n0.730471 0.005658 0.582475 Si\n0.148090 0.724824 0.275176 Si\n0.229477 0.656787 0.753829 Si\n0.033435 0.292580 0.245743 O\n0.036745 0.988046 0.533408 O\n0.033435 0.754257 0.707420 O\n0.205526 0.870178 0.314265 O\n0.146900 0.108854 0.356195 O\n0.533436 0.707420 0.754257 O\n0.536745 0.011954 0.466591 O\n0.646900 0.891146 0.643804 O\n0.837836 0.696444 0.303556 O\n0.206489 0.340332 0.474564 O\n0.837756 0.351980 0.648019 O\n0.706489 0.474564 0.340331 O\n0.337756 0.648020 0.351980 O\n0.706489 0.659668 0.525436 O\n0.646900 0.356195 0.108854 O\n0.146900 0.643805 0.891146 O\n0.533436 0.245743 0.292580 O\n0.337836 0.303556 0.696443 O\n0.206489 0.525436 0.659668 O\n0.705526 0.314265 0.870178 O\n0.036745 0.466591 0.011954 O\n0.705526 0.129822 0.685735 O\n0.536745 0.533408 0.988045 O\n0.205526 0.685735 0.129822 O\n",
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},
{
"id": "jvasp-98776",
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"updated_at": "2022-09-04T14:35:44.747901Z",
"structure_string": "Si16 O32\n1.0\n4.966429 0.001865 -0.072412\n-2.381590 11.947439 -2.874950\n-0.079527 0.126437 14.875628\nSi O\n16 32\ndirect\n0.879519 0.906188 0.355435 Si\n0.320578 0.784009 0.272502 Si\n0.212853 0.580033 0.370237 Si\n0.161730 0.147728 0.443576 Si\n0.787148 0.419968 0.629764 Si\n0.838270 0.852273 0.556425 Si\n0.274425 0.713046 0.570789 Si\n0.679422 0.215992 0.727499 Si\n0.357168 0.560447 0.700344 Si\n0.120481 0.093813 0.644565 Si\n0.215791 0.529781 0.891927 Si\n0.346037 0.613377 0.096834 Si\n0.653963 0.386624 0.903166 Si\n0.642832 0.439553 0.299657 Si\n0.725575 0.286954 0.429212 Si\n0.784210 0.470220 0.108073 Si\n0.030931 0.035245 0.366629 O\n0.101703 0.128510 0.546099 O\n0.329952 0.670573 0.663427 O\n0.508866 0.821419 0.566080 O\n0.491134 0.178582 0.433921 O\n0.886444 0.480951 0.872387 O\n0.027722 0.823705 0.281031 O\n0.437200 0.109144 0.683091 O\n0.641436 0.577064 0.105884 O\n-0.023917 0.749146 0.572393 O\n0.279952 0.610849 0.481574 O\n0.662964 0.312065 0.670477 O\n0.720048 0.389152 0.518427 O\n0.898297 0.871491 0.453901 O\n0.358564 0.422937 0.894117 O\n0.641950 0.264483 0.836244 O\n0.969069 0.964756 0.633371 O\n0.722757 0.380138 0.009099 O\n0.972278 0.176296 0.718969 O\n0.118074 0.453303 0.652280 O\n0.348129 0.473890 0.323888 O\n0.023917 0.250854 0.427607 O\n0.562800 0.890857 0.316910 O\n0.670048 0.329428 0.336573 O\n0.881926 0.546697 0.347721 O\n0.668878 0.408775 0.188475 O\n0.337036 0.687936 0.329524 O\n0.651872 0.526111 0.676113 O\n0.358050 0.735518 0.163756 O\n0.113556 0.519050 0.127614 O\n0.277243 0.619862 0.990901 O\n0.331122 0.591225 0.811525 O\n",
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"volume": 884.4866616428956,
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"formula_full": "Si16 O32",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
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"spacegroup": 2
},
{
"id": "jvasp-88078",
"created_at": "2022-09-04T14:35:41.186631Z",
"updated_at": "2022-09-04T14:35:41.186661Z",
"structure_string": "Si16 O32\n1.0\n9.244882 0.000000 4.721878\n4.622441 10.093830 2.360939\n0.031159 -0.000000 11.350129\nSi O\n16 32\ndirect\n0.359896 0.280208 0.500000 Si\n0.859896 0.500000 0.280208 Si\n0.359896 0.500000 0.280208 Si\n0.733804 0.154748 0.377644 Si\n0.266196 0.622356 0.845252 Si\n0.640104 0.500000 0.719792 Si\n0.140104 0.719792 0.500000 Si\n0.888552 0.377644 0.845253 Si\n0.111448 0.622356 0.154748 Si\n0.266196 0.845252 0.622357 Si\n0.640104 0.719792 0.500000 Si\n0.140104 0.500000 0.719792 Si\n0.733804 0.377644 0.154748 Si\n0.888552 0.845252 0.377644 Si\n0.859896 0.280208 0.500000 Si\n0.111448 0.154748 0.622356 Si\n0.167844 -0.000000 0.664313 O\n0.266837 0.534476 0.186860 O\n0.733162 0.465524 0.813140 O\n0.000000 0.243487 0.756513 O\n0.832156 0.335688 0.000000 O\n0.266837 0.186860 0.534476 O\n0.546303 0.465524 0.186860 O\n0.198686 0.534476 0.813140 O\n0.988173 0.465524 0.813140 O\n0.453697 0.813140 0.534477 O\n0.011826 0.534476 0.186860 O\n0.167844 0.664312 0.000000 O\n0.660166 0.626556 0.626557 O\n0.913277 0.373444 0.373444 O\n0.801314 0.186860 0.465524 O\n0.011826 0.186860 0.534476 O\n0.756512 0.243487 0.243488 O\n-0.000000 0.756513 0.243488 O\n0.988173 0.813140 0.465524 O\n0.453697 0.534476 0.813140 O\n0.198686 0.813140 0.534477 O\n0.713279 0.373444 0.626557 O\n0.286721 0.626556 0.373444 O\n0.801314 0.465524 0.186860 O\n0.832156 -0.000000 0.335688 O\n0.546303 0.186860 0.465524 O\n0.713279 0.626556 0.373444 O\n0.286721 0.373444 0.626556 O\n0.733162 0.813140 0.465524 O\n0.243487 0.756513 0.756513 O\n0.086723 0.626556 0.626556 O\n0.339834 0.373444 0.373444 O\n",
"nsites": 48,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 1.50931992630064,
"density_atomic": 0.045382922250220246,
"volume": 1057.666576324689,
"volume_molar": 13.269618749530336,
"formula_full": "Si16 O32",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4044685333333335,
"spacegroup": 139
}
]
}