HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4170",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4168",
"results": [
{
"id": "jvasp-8158",
"created_at": "2022-09-04T14:37:04.556908Z",
"updated_at": "2022-09-04T14:37:04.556937Z",
"structure_string": "Si1 C1\n1.0\n2.686974 -0.000000 1.551325\n0.895658 2.533304 1.551325\n-0.000000 -0.000000 3.102651\nSi C\n1 1\ndirect\n0.250000 0.250000 0.250001 Si\n0.000000 0.000000 0.000000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Si",
"C"
],
"chemical_system": "C-Si",
"density": 3.1525981266331926,
"density_atomic": 0.09469919685585335,
"volume": 21.119503294672135,
"volume_molar": 6.359231081089969,
"formula_full": "Si1 C1",
"formula_reduced": "SiC",
"formula_anonymous": "AB",
"energy_above_hull": 2.9276093,
"spacegroup": 216
},
{
"id": "jvasp-94970",
"created_at": "2022-09-04T14:35:53.437416Z",
"updated_at": "2022-09-04T14:35:53.437444Z",
"structure_string": "Ti2 H2 O3\n1.0\n-1.557061 -2.696454 0.000072\n-1.556667 2.696228 0.000000\n0.000857 0.000494 -8.804272\nTi H O\n2 2 3\ndirect\n0.666570 0.333285 0.876987 Ti\n0.333429 0.666714 0.123013 Ti\n0.333077 0.666538 0.631706 H\n0.666921 0.333462 0.368294 H\n0.333128 0.666564 0.744582 O\n0.666870 0.333435 0.255418 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ti",
"H",
"O"
],
"chemical_system": "H-O-Ti",
"density": 3.2741834169879365,
"density_atomic": 0.09469980937368902,
"volume": 73.91778342845164,
"volume_molar": 6.359189949619017,
"formula_full": "Ti2 H2 O3",
"formula_reduced": "Ti2H2O3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 3.000551023809524,
"spacegroup": 164
},
{
"id": "jvasp-10867",
"created_at": "2022-09-04T14:38:27.197613Z",
"updated_at": "2022-09-04T14:38:27.197635Z",
"structure_string": "Si5 C5\n1.0\n3.078332 0.000449 12.435273\n1.516661 2.678781 12.435273\n0.000769 0.000449 12.810626\nSi C\n5 5\ndirect\n0.916638 0.916639 0.916639 Si\n0.650002 0.650003 0.650003 Si\n0.450042 0.450043 0.450043 Si\n0.183400 0.183400 0.183400 Si\n0.050022 0.050022 0.050022 Si\n0.866653 0.866655 0.866654 C\n0.599862 0.599863 0.599863 C\n0.399901 0.399901 0.399901 C\n0.133420 0.133420 0.133420 C\n0.000057 0.000057 0.000057 C\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Si",
"C"
],
"chemical_system": "C-Si",
"density": 3.152654222820617,
"density_atomic": 0.09470088189900899,
"volume": 105.59563754289226,
"volume_molar": 6.359117929252378,
"formula_full": "Si5 C5",
"formula_reduced": "SiC",
"formula_anonymous": "AB",
"energy_above_hull": 2.9278343,
"spacegroup": 160
},
{
"id": "jvasp-22633",
"created_at": "2022-09-04T14:36:44.370256Z",
"updated_at": "2022-09-04T14:36:44.370272Z",
"structure_string": "Si8 C8\n1.0\n3.101203 0.000000 0.000000\n-1.550601 2.685721 -0.000000\n0.000000 0.000000 20.284928\nSi C\n8 8\ndirect\n0.333333 0.666667 0.875211 Si\n0.333333 0.666667 0.624992 Si\n0.000000 0.000000 0.000105 Si\n0.666666 0.333333 0.750093 Si\n0.666666 0.333333 0.375211 Si\n0.333333 0.666667 0.250093 Si\n0.000000 0.000000 0.500105 Si\n0.666666 0.333333 0.124992 Si\n0.333333 0.666667 0.344114 C\n0.666666 0.333333 0.218706 C\n0.666666 0.333333 0.844114 C\n0.000000 0.000000 0.593852 C\n0.333333 0.666667 0.968929 C\n0.000000 0.000000 0.093852 C\n0.333333 0.666667 0.718706 C\n0.666666 0.333333 0.468929 C\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Si",
"C"
],
"chemical_system": "C-Si",
"density": 3.1526643736875197,
"density_atomic": 0.09470118681543173,
"volume": 168.95247607807985,
"volume_molar": 6.35909745432956,
"formula_full": "Si8 C8",
"formula_reduced": "SiC",
"formula_anonymous": "AB",
"energy_above_hull": 2.9276143,
"spacegroup": 186
},
{
"id": "jvasp-182",
"created_at": "2022-09-04T14:37:40.708553Z",
"updated_at": "2022-09-04T14:37:40.708578Z",
"structure_string": "Si6 C6\n1.0\n1.550354 -2.685291 0.000000\n1.550354 2.685291 0.000000\n0.000000 0.000000 15.218138\nSi C\n6 6\ndirect\n0.333332 0.666666 0.167045 Si\n0.666666 0.333332 0.667045 Si\n0.666666 0.333332 0.333507 Si\n0.333332 0.666666 0.833507 Si\n0.000000 0.000000 0.500266 Si\n0.000000 0.000000 0.000266 Si\n0.000000 0.000000 0.125621 C\n0.000000 0.000000 0.625621 C\n0.333332 0.666666 0.292005 C\n0.666666 0.333332 0.792005 C\n0.666666 0.333332 0.458456 C\n0.333332 0.666666 0.958457 C\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"C"
],
"chemical_system": "C-Si",
"density": 3.152752069031186,
"density_atomic": 0.0947038210486196,
"volume": 126.71083243662756,
"volume_molar": 6.358920572917874,
"formula_full": "Si6 C6",
"formula_reduced": "SiC",
"formula_anonymous": "AB",
"energy_above_hull": 2.9277043,
"spacegroup": 186
},
{
"id": "jvasp-105701",
"created_at": "2022-09-04T14:36:01.158954Z",
"updated_at": "2022-09-04T14:36:01.158979Z",
"structure_string": "Al2 Pd2 O6\n1.0\n3.205229 0.000000 -0.000000\n-1.602615 2.775810 0.000000\n-0.000000 -0.000000 11.868151\nAl Pd O\n2 2 6\ndirect\n0.333334 0.666667 0.250000 Al\n0.666668 0.333333 0.750000 Al\n0.000000 0.000000 0.000000 Pd\n0.000000 0.000000 0.500000 Pd\n0.333334 0.666667 0.087190 O\n0.333334 0.666667 0.412810 O\n0.000000 0.000000 0.250000 O\n0.000000 0.000000 0.750000 O\n0.666668 0.333333 0.587189 O\n0.666668 0.333333 0.912810 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Al",
"Pd",
"O"
],
"chemical_system": "Al-O-Pd",
"density": 5.7053709606643395,
"density_atomic": 0.0947039595816999,
"volume": 105.5922059032086,
"volume_molar": 6.358911271080252,
"formula_full": "Al2 Pd2 O6",
"formula_reduced": "AlPdO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.8964278,
"spacegroup": 194
},
{
"id": "jvasp-107",
"created_at": "2022-09-04T14:36:07.223490Z",
"updated_at": "2022-09-04T14:36:07.223518Z",
"structure_string": "Si4 C4\n1.0\n1.549893 -2.684493 0.000000\n1.549893 2.684493 0.000000\n0.000000 0.000000 10.151392\nSi C\n4 4\ndirect\n0.666666 0.333332 0.937847 Si\n0.333332 0.666666 0.437847 Si\n0.000000 0.000000 0.687848 Si\n0.000000 0.000000 0.187848 Si\n0.666666 0.333332 0.749826 C\n0.333332 0.666666 0.249826 C\n0.000000 0.000000 0.500478 C\n0.000000 0.000000 0.000478 C\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Si",
"C"
],
"chemical_system": "C-Si",
"density": 3.1527731080294927,
"density_atomic": 0.09470445302775626,
"volume": 84.47332458227002,
"volume_molar": 6.358878138744978,
"formula_full": "Si4 C4",
"formula_reduced": "SiC",
"formula_anonymous": "AB",
"energy_above_hull": 2.9280093,
"spacegroup": 186
},
{
"id": "jvasp-22644",
"created_at": "2022-09-04T14:35:46.297583Z",
"updated_at": "2022-09-04T14:35:46.297608Z",
"structure_string": "Si10 C10\n1.0\n3.100305 0.000000 0.000000\n-1.550152 2.684942 -0.000000\n0.000000 -0.000000 25.369412\nSi C\n10 10\ndirect\n0.666668 0.333333 0.199868 Si\n0.333334 0.666666 0.100011 Si\n0.666668 0.333333 0.800073 Si\n0.333334 0.666666 0.899930 Si\n0.000000 0.000000 0.700029 Si\n0.333334 0.666666 0.499967 Si\n0.666668 0.333333 0.600002 Si\n0.000000 0.000000 0.299903 Si\n0.666668 0.333333 0.399936 Si\n0.000000 0.000000 0.999964 Si\n0.000000 0.000000 0.375116 C\n0.000000 0.000000 0.775238 C\n0.000000 0.000000 0.075178 C\n0.666668 0.333333 0.674949 C\n0.666668 0.333333 0.274838 C\n0.333334 0.666666 0.174987 C\n0.333334 0.666666 0.575178 C\n0.666668 0.333333 0.474884 C\n0.333334 0.666666 0.974900 C\n0.666668 0.333333 0.875048 C\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Si",
"C"
],
"chemical_system": "C-Si",
"density": 3.15284472292812,
"density_atomic": 0.09470660422911796,
"volume": 211.1785145586596,
"volume_molar": 6.358733700799786,
"formula_full": "Si10 C10",
"formula_reduced": "SiC",
"formula_anonymous": "AB",
"energy_above_hull": 2.9277893,
"spacegroup": 156
},
{
"id": "jvasp-55185",
"created_at": "2022-09-04T14:38:28.300906Z",
"updated_at": "2022-09-04T14:38:28.300925Z",
"structure_string": "Nd2 Co8 B8\n1.0\n7.079876 0.000000 0.000000\n-0.000000 7.079876 0.000000\n-0.000000 -0.000000 3.791561\nNd Co B\n2 8 8\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Nd\n0.114403 0.356550 0.606946 Co\n0.856550 0.385598 0.106946 Co\n0.885598 0.643451 0.606946 Co\n0.385598 0.143451 0.893054 Co\n0.643451 0.114403 0.393054 Co\n0.614403 0.856550 0.893054 Co\n0.356550 0.885598 0.393054 Co\n0.143451 0.614403 0.106946 Co\n0.704575 0.837995 0.395919 B\n0.837995 0.295426 0.604081 B\n0.162006 0.704575 0.604081 B\n0.795426 0.662006 0.104081 B\n0.337994 0.795426 0.895919 B\n0.662006 0.204575 0.895919 B\n0.295426 0.162006 0.395919 B\n0.204575 0.337994 0.104081 B\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Nd",
"Co",
"B"
],
"chemical_system": "B-Co-Nd",
"density": 7.39562145903063,
"density_atomic": 0.09471159598450522,
"volume": 190.05064599423278,
"volume_molar": 6.358398565034444,
"formula_full": "Nd2 Co8 B8",
"formula_reduced": "Nd(CoB)4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 4.245030603703704,
"spacegroup": 86
},
{
"id": "jvasp-97973",
"created_at": "2022-09-04T14:36:01.624990Z",
"updated_at": "2022-09-04T14:36:01.625021Z",
"structure_string": "Mg16 Si16 O48\n1.0\n18.372208 0.000000 0.012978\n0.000000 8.843102 0.000000\n0.006382 0.000000 5.199006\nMg Si O\n16 16 48\ndirect\n0.874295 0.846125 0.072122 Mg\n0.380251 0.011358 0.855483 Mg\n0.619749 0.511357 0.644519 Mg\n0.619749 0.988642 0.144518 Mg\n0.380251 0.488642 0.355483 Mg\n0.625353 0.153740 0.642763 Mg\n0.625354 0.346259 0.142762 Mg\n0.374646 0.846259 0.357239 Mg\n0.374646 0.653740 0.857239 Mg\n0.126649 0.513004 0.931222 Mg\n0.126649 0.986996 0.431221 Mg\n0.873351 0.486996 0.068779 Mg\n0.874295 0.653875 0.572123 Mg\n0.125705 0.153875 0.927879 Mg\n0.125705 0.346125 0.427878 Mg\n0.873351 0.013004 0.568780 Mg\n0.772994 0.339630 0.490804 Si\n0.473185 0.162956 0.306787 Si\n0.526815 0.662956 0.193214 Si\n0.526815 0.837044 0.693215 Si\n0.473185 0.337044 0.806787 Si\n0.772994 0.160370 0.990804 Si\n0.227006 0.839630 0.009197 Si\n0.227006 0.660369 0.509198 Si\n0.725955 0.839551 0.423551 Si\n0.725955 0.660448 0.923551 Si\n0.274045 0.160449 0.576451 Si\n0.274045 0.339551 0.076450 Si\n0.977475 0.158889 0.267351 Si\n0.022525 0.658889 0.232650 Si\n0.022525 0.841110 0.732650 Si\n0.977475 0.341111 0.767352 Si\n0.198962 0.799196 0.709357 O\n0.185969 0.510336 0.608051 O\n0.814031 0.010336 0.891951 O\n0.683939 0.158811 0.980593 O\n0.185969 0.989664 0.108050 O\n0.316061 0.658811 0.519409 O\n0.801038 0.299196 0.790645 O\n0.683939 0.341189 0.480592 O\n0.814031 0.489664 0.391950 O\n0.801038 0.200804 0.290644 O\n0.437931 0.662537 0.191442 O\n0.562069 0.337463 0.808559 O\n0.437931 0.837463 0.691443 O\n0.562069 0.162537 0.308559 O\n0.433737 0.483149 0.688888 O\n0.566263 0.983149 0.811114 O\n0.566263 0.516851 0.311114 O\n0.433737 0.016851 0.188887 O\n0.446633 0.191363 0.615883 O\n0.553367 0.691363 0.884119 O\n0.316061 0.841189 0.019409 O\n0.198962 0.700804 0.209357 O\n0.304558 0.289764 0.369794 O\n0.937420 -0.001343 0.247098 O\n0.695442 0.710236 0.630207 O\n0.065851 0.340260 0.760865 O\n0.934149 0.840260 0.739137 O\n0.934149 0.659740 0.239137 O\n0.065851 0.159740 0.260864 O\n0.937420 0.501343 0.747099 O\n0.062580 0.001343 0.752903 O\n0.062580 0.498657 0.252903 O\n0.553367 0.808637 0.384118 O\n0.945757 0.216391 0.554963 O\n0.054243 0.716391 0.945038 O\n0.054243 0.783609 0.445038 O\n0.945757 0.283609 0.054963 O\n0.185580 0.162211 0.585952 O\n0.814420 0.662211 0.914050 O\n0.814420 0.837789 0.414050 O\n0.185580 0.337789 0.085951 O\n0.314415 0.002166 0.540323 O\n0.685584 0.502165 0.959679 O\n0.685584 0.997834 0.459678 O\n0.314416 0.497834 0.040322 O\n0.304558 0.210236 0.869794 O\n0.695442 0.789764 0.130207 O\n0.446633 0.308637 0.115882 O\n",
"nsites": 80,
"nelements": 3,
"elements": [
"Mg",
"Si",
"O"
],
"chemical_system": "Mg-O-Si",
"density": 3.1576790110005772,
"density_atomic": 0.09471179269038539,
"volume": 844.6677834672762,
"volume_molar": 6.358385359346423,
"formula_full": "Mg16 Si16 O48",
"formula_reduced": "MgSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.4200916300000002,
"spacegroup": 14
},
{
"id": "jvasp-106929",
"created_at": "2022-09-04T14:36:53.279994Z",
"updated_at": "2022-09-04T14:36:53.280022Z",
"structure_string": "Cu3 N1 F3\n1.0\n4.196585 -0.000000 0.000000\n0.000000 4.196585 0.000000\n-0.000000 -0.000000 4.196585\nCu N F\n3 1 3\ndirect\n0.500001 0.000000 0.500001 Cu\n0.500001 0.500001 -0.000000 Cu\n-0.000000 0.500001 0.500001 Cu\n0.500001 0.500001 0.500001 N\n-0.000000 0.500001 -0.000000 F\n0.000000 0.000000 0.500001 F\n0.500001 0.000000 -0.000000 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Cu",
"N",
"F"
],
"chemical_system": "Cu-F-N",
"density": 5.878479606885302,
"density_atomic": 0.09471308180646386,
"volume": 73.9074251042085,
"volume_molar": 6.358298816952876,
"formula_full": "Cu3 N1 F3",
"formula_reduced": "Cu3NF3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.4498350639285713,
"spacegroup": 221
},
{
"id": "jvasp-101168",
"created_at": "2022-09-04T14:36:56.003421Z",
"updated_at": "2022-09-04T14:36:56.003453Z",
"structure_string": "Li1 V3 O6\n1.0\n4.932043 -0.056215 0.816202\n-2.632447 4.171142 0.816202\n-0.056274 -0.100698 5.129112\nLi V O\n1 3 6\ndirect\n0.500000 0.500000 0.499999 Li\n0.327416 0.672584 -0.000000 V\n0.000000 0.000000 0.000000 V\n0.672584 0.327417 -0.000000 V\n0.275054 0.275054 0.208441 O\n0.925073 0.598898 0.216130 O\n0.598897 0.925073 0.216130 O\n0.074927 0.401102 0.783869 O\n0.724946 0.724946 0.791558 O\n0.401103 0.074927 0.783869 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Li",
"V",
"O"
],
"chemical_system": "Li-O-V",
"density": 4.022786000549478,
"density_atomic": 0.0947200640558203,
"volume": 105.57425292815273,
"volume_molar": 6.357830117651779,
"formula_full": "Li1 V3 O6",
"formula_reduced": "LiV3O6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 3.13653736,
"spacegroup": 12
}
]
}