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=4423",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4421",
"results": [
{
"id": "jvasp-13815",
"created_at": "2022-09-04T14:37:50.812630Z",
"updated_at": "2022-09-04T14:37:50.812656Z",
"structure_string": "Mg2 Ge2 O6\n1.0\n2.845360 0.000000 -0.000000\n-1.422680 4.718688 -0.000000\n-0.000000 -0.000000 7.004423\nMg Ge O\n2 2 6\ndirect\n0.740148 0.480295 0.250000 Mg\n0.259853 0.519705 0.750000 Mg\n0.000000 0.000000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.631966 0.263931 0.939656 O\n0.368035 0.736070 0.060343 O\n0.368035 0.736070 0.439656 O\n0.631966 0.263931 0.560343 O\n0.915047 0.830093 0.750000 O\n0.084954 0.169908 0.250000 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mg",
"Ge",
"O"
],
"chemical_system": "Ge-Mg-O",
"density": 5.118539844676218,
"density_atomic": 0.10633326517201577,
"volume": 94.04394743096582,
"volume_molar": 5.663458890553165,
"formula_full": "Mg2 Ge2 O6",
"formula_reduced": "MgGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.0896410999999997,
"spacegroup": 63
},
{
"id": "jvasp-35108",
"created_at": "2022-09-04T14:37:38.990359Z",
"updated_at": "2022-09-04T14:37:38.990376Z",
"structure_string": "Al3 B1 N4\n1.0\n4.221559 -0.000000 -0.000000\n-0.000000 4.221559 0.000000\n-0.000000 0.000000 4.221559\nAl B N\n3 1 4\ndirect\n0.500000 0.500000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 B\n0.772289 0.772289 0.227711 N\n0.772289 0.227711 0.772289 N\n0.227711 0.772289 0.772289 N\n0.227711 0.227711 0.227711 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"B",
"N"
],
"chemical_system": "Al-B-N",
"density": 3.261769513771827,
"density_atomic": 0.10633381536803294,
"volume": 75.23476866047858,
"volume_molar": 5.663429586492984,
"formula_full": "Al3 B1 N4",
"formula_reduced": "Al3BN4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 4.224169247916667,
"spacegroup": 215
},
{
"id": "jvasp-107085",
"created_at": "2022-09-04T14:36:55.002211Z",
"updated_at": "2022-09-04T14:36:55.002236Z",
"structure_string": "Ta1 V3 N4\n1.0\n4.221498 -0.000000 0.000000\n0.000000 4.221498 0.000000\n0.000000 0.000000 4.221498\nTa V N\n1 3 4\ndirect\n0.500000 0.500000 0.500000 Ta\n0.000000 0.000000 0.500000 V\n-0.000000 0.500000 -0.000000 V\n0.500000 0.000000 -0.000000 V\n0.500000 0.500000 -0.000000 N\n0.500000 0.000000 0.500000 N\n-0.000000 0.500000 0.500000 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ta",
"V",
"N"
],
"chemical_system": "N-Ta-V",
"density": 8.603798982833363,
"density_atomic": 0.10633842495671317,
"volume": 75.23150736205218,
"volume_molar": 5.663184086515682,
"formula_full": "Ta1 V3 N4",
"formula_reduced": "TaV3N4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 5.74383435,
"spacegroup": 221
},
{
"id": "jvasp-9153",
"created_at": "2022-09-04T14:37:33.743532Z",
"updated_at": "2022-09-04T14:37:33.743561Z",
"structure_string": "Ir4 N8\n1.0\n0.000000 4.882553 0.001526\n4.936911 0.000000 0.000000\n0.000000 -1.517086 -4.681582\nIr N\n4 8\ndirect\n0.233395 0.499796 0.720791 Ir\n0.766603 0.999796 0.779207 Ir\n0.766603 0.500204 0.279207 Ir\n0.233395 0.000204 0.220792 Ir\n0.324697 0.913684 0.659060 N\n0.675301 0.413684 0.840939 N\n0.675302 0.086316 0.340939 N\n0.324697 0.586316 0.159060 N\n0.185789 0.402676 0.299408 N\n0.814210 0.902676 0.200591 N\n0.814210 0.597324 0.700591 N\n0.185788 0.097324 0.799408 N\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ir",
"N"
],
"chemical_system": "Ir-N",
"density": 12.963893218202543,
"density_atomic": 0.10634824681506899,
"volume": 112.83683896422882,
"volume_molar": 5.662661059633655,
"formula_full": "Ir4 N8",
"formula_reduced": "IrN2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.5202592,
"spacegroup": 14
},
{
"id": "jvasp-117206",
"created_at": "2022-09-04T14:38:49.354189Z",
"updated_at": "2022-09-04T14:38:49.354227Z",
"structure_string": "Li4 Ti4 Fe4 O16\n1.0\n2.863223 -0.000000 0.000000\n0.000000 8.857636 0.000000\n-0.000000 -0.000000 10.380829\nLi Ti Fe O\n4 4 4 16\ndirect\n0.250000 0.242648 0.642844 Li\n0.250000 0.742648 0.857156 Li\n0.749999 0.757353 0.357156 Li\n0.749999 0.257352 0.142844 Li\n0.250000 0.099311 0.394797 Ti\n0.250000 0.599311 0.105203 Ti\n0.749999 0.900689 0.605203 Ti\n0.749999 0.400689 0.894797 Ti\n0.749999 0.450816 0.389243 Fe\n0.749999 0.950816 0.110757 Fe\n0.250000 0.549184 0.610757 Fe\n0.250000 0.049184 0.889243 Fe\n0.250000 0.587260 0.430858 O\n0.250000 0.087260 0.069142 O\n0.749999 0.034983 0.282342 O\n0.749999 0.534984 0.217658 O\n0.250000 0.965017 0.717658 O\n0.250000 0.465017 0.782342 O\n0.749999 0.120617 0.526446 O\n0.250000 0.807054 0.151827 O\n0.250000 0.879383 0.473554 O\n0.250000 0.379383 0.026446 O\n0.749999 0.192947 0.848173 O\n0.749999 0.692947 0.651827 O\n0.749999 0.912740 0.930858 O\n0.250000 0.307053 0.348173 O\n0.749999 0.620617 0.973554 O\n0.749999 0.412740 0.569142 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O-Ti",
"density": 4.406300689165394,
"density_atomic": 0.10635379490907186,
"volume": 263.2722229041178,
"volume_molar": 5.662365659023906,
"formula_full": "Li4 Ti4 Fe4 O16",
"formula_reduced": "LiTiFeO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.529823976190476,
"spacegroup": 62
},
{
"id": "jvasp-112668",
"created_at": "2022-09-04T14:38:43.191355Z",
"updated_at": "2022-09-04T14:38:43.191381Z",
"structure_string": "Li4 Co1 Te1 O6\n1.0\n5.106866 0.002294 0.911144\n-2.762661 4.295090 0.911144\n-0.000811 -0.001486 5.141744\nLi Co Te O\n4 1 1 6\ndirect\n0.825427 0.174572 0.499999 Li\n0.173703 0.826296 0.499999 Li\n0.501565 0.498434 0.499999 Li\n0.666044 0.333956 -0.000001 Li\n0.334814 0.665186 -0.000001 Co\n-0.000441 0.000441 -0.000000 Te\n0.084057 0.393334 0.763287 O\n0.386356 0.071204 0.762569 O\n0.928795 0.613643 0.237430 O\n0.606666 0.915942 0.236711 O\n0.230589 0.237572 0.227259 O\n0.762428 0.769410 0.772739 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Li",
"Co",
"Te",
"O"
],
"chemical_system": "Co-Li-O-Te",
"density": 4.566737388663542,
"density_atomic": 0.10635682780880072,
"volume": 112.82773515558947,
"volume_molar": 5.6622041894913355,
"formula_full": "Li4 Co1 Te1 O6",
"formula_reduced": "Li4CoTeO6",
"formula_anonymous": "ABC4D6",
"energy_above_hull": 2.033468305555556,
"spacegroup": 5
},
{
"id": "jvasp-92451",
"created_at": "2022-09-04T14:36:13.100898Z",
"updated_at": "2022-09-04T14:36:13.100922Z",
"structure_string": "Ni2 O4\n1.0\n-0.974309 2.823775 -1.773465\n2.300395 3.802303 2.293550\n2.192870 -0.976522 -2.511152\nNi O\n2 4\ndirect\n0.249990 0.249995 0.750009 Ni\n0.750021 0.750013 0.249977 Ni\n0.244555 0.499998 0.244563 O\n0.744553 -0.000001 0.744560 O\n0.255438 -0.000001 0.255446 O\n0.755436 0.499998 0.755444 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ni",
"O"
],
"chemical_system": "Ni-O",
"density": 5.3398176989200765,
"density_atomic": 0.10637232472058948,
"volume": 56.40564889185539,
"volume_molar": 5.661379288098187,
"formula_full": "Ni2 O4",
"formula_reduced": "NiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5884531333333336,
"spacegroup": 71
},
{
"id": "jvasp-104110",
"created_at": "2022-09-04T14:36:46.442596Z",
"updated_at": "2022-09-04T14:36:46.442617Z",
"structure_string": "H6 C14 N2 O2\n1.0\n3.642955 0.068546 0.081845\n0.096018 5.639069 0.798323\n-0.055332 0.240980 11.019288\nH C N O\n6 14 2 2\ndirect\n0.343311 0.730027 0.226626 H\n0.856067 0.024609 0.031273 H\n0.384192 0.467461 0.651979 H\n0.181798 0.664534 0.447296 H\n0.821690 0.282919 0.602761 H\n0.024199 0.083227 0.809385 H\n0.055698 0.992687 0.729925 C\n0.942950 0.103751 0.615474 C\n0.985877 0.988659 0.511955 C\n0.147504 0.758250 0.525559 C\n0.261294 0.646207 0.641141 C\n0.215996 0.760794 0.744232 C\n0.856541 0.118885 0.395933 C\n0.757902 0.186196 0.197227 C\n0.742517 0.173269 0.072586 C\n0.570877 0.376448 0.007906 C\n0.430751 0.573755 0.059948 C\n0.451734 0.580547 0.185398 C\n0.621028 0.379175 0.253461 C\n0.328253 0.651130 0.866256 C\n0.280369 0.741615 0.967097 N\n0.689298 0.328237 0.378580 N\n0.504677 0.425923 0.882746 O\n0.909474 0.017735 0.289258 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O",
"density": 1.7237663131607142,
"density_atomic": 0.10637406773303541,
"volume": 225.61889858562387,
"volume_molar": 5.661286522494966,
"formula_full": "H6 C14 N2 O2",
"formula_reduced": "H3C7NO",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 5.842155562500001,
"spacegroup": 1
},
{
"id": "jvasp-112051",
"created_at": "2022-09-04T14:38:42.114910Z",
"updated_at": "2022-09-04T14:38:42.114931Z",
"structure_string": "H8 C13 O2\n1.0\n3.629835 -0.049656 0.334386\n0.340694 5.565503 0.881331\n0.022482 -0.418332 10.631155\nH C O\n8 13 2\ndirect\n0.800537 0.102291 0.817540 H\n0.240807 0.192825 0.442701 H\n0.254908 0.860266 0.611327 H\n0.690863 0.912407 0.171809 H\n0.312179 0.808931 0.843704 H\n0.697672 0.885765 0.407509 H\n0.732051 0.149464 0.585443 H\n0.222409 0.224962 0.208778 H\n0.333845 0.365423 0.253191 C\n0.640268 0.294465 0.641847 C\n0.343121 0.350376 0.384075 C\n0.678927 0.266686 0.771109 C\n0.463635 0.568312 0.179254 C\n0.494882 0.509904 0.581151 C\n0.378578 0.694545 0.655853 C\n0.564033 0.452595 0.844547 C\n0.588753 0.757739 0.233107 C\n0.587911 0.741581 0.364978 C\n0.407816 0.666061 0.786308 C\n0.621167 0.412931 0.981089 C\n0.471059 0.536550 0.442347 C\n0.455487 0.593157 0.046561 O\n0.800646 0.242923 0.030677 O\n",
"nsites": 23,
"nelements": 3,
"elements": [
"H",
"C",
"O"
],
"chemical_system": "C-H-O",
"density": 1.5069613764652783,
"density_atomic": 0.1063845874500546,
"volume": 216.19673066644202,
"volume_molar": 5.660726712717924,
"formula_full": "H8 C13 O2",
"formula_reduced": "H8C13O2",
"formula_anonymous": "A2B8C13",
"energy_above_hull": 5.741620304347825,
"spacegroup": 1
},
{
"id": "jvasp-35189",
"created_at": "2022-09-04T14:38:03.797330Z",
"updated_at": "2022-09-04T14:38:03.797356Z",
"structure_string": "Zn8 Si4 O16\n1.0\n4.977014 0.000000 0.000000\n-0.000000 5.063446 0.000000\n0.000000 0.000000 10.443896\nZn Si O\n8 4 16\ndirect\n0.499036 0.051564 0.163799 Zn\n0.999035 0.448437 0.836201 Zn\n0.500963 0.551564 0.336201 Zn\n0.000964 0.948437 0.663799 Zn\n0.500963 0.948437 0.836201 Zn\n0.000964 0.551564 0.163799 Zn\n0.499036 0.448437 0.663799 Zn\n0.999035 0.051564 0.336201 Zn\n0.000000 0.000000 0.000000 Si\n0.500000 0.500000 0.000000 Si\n0.000000 0.500000 0.500000 Si\n0.500000 0.000000 0.500000 Si\n0.111633 0.453459 0.340838 O\n0.611633 0.046542 0.659163 O\n0.111633 0.046542 0.840838 O\n0.611633 0.453459 0.159162 O\n0.888366 0.546542 0.659163 O\n0.388366 0.953459 0.340838 O\n0.197375 0.291555 0.047482 O\n0.197375 0.208446 0.547482 O\n0.802625 0.791555 0.452518 O\n0.302625 0.708446 0.547482 O\n0.802625 0.708446 0.952518 O\n0.302625 0.791555 0.047482 O\n0.388366 0.546542 0.840838 O\n0.697374 0.291555 0.452518 O\n0.697374 0.208446 0.952518 O\n0.888366 0.953459 0.159162 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Zn",
"Si",
"O"
],
"chemical_system": "O-Si-Zn",
"density": 5.625274461826892,
"density_atomic": 0.10638501220551703,
"volume": 263.19496909873874,
"volume_molar": 5.660704111558768,
"formula_full": "Zn8 Si4 O16",
"formula_reduced": "Zn2SiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2797776285714284,
"spacegroup": 61
},
{
"id": "jvasp-101932",
"created_at": "2022-09-04T14:36:58.246767Z",
"updated_at": "2022-09-04T14:36:58.246780Z",
"structure_string": "Mg2 H12 C10 O8\n1.0\n6.171692 -0.102156 1.107783\n1.164972 6.540657 0.596264\n0.023679 0.244495 7.448251\nMg H C O\n2 12 10 8\ndirect\n0.032485 0.883003 0.570051 Mg\n0.523060 0.808227 0.692154 Mg\n0.084781 0.228348 0.114562 H\n0.399902 0.317278 0.108705 H\n0.797426 0.371748 0.562168 H\n0.619614 0.464381 0.125611 H\n0.547583 0.742664 0.269247 H\n0.348334 0.953507 0.213919 H\n0.003939 0.478371 0.937232 H\n0.227714 0.626089 0.147938 H\n0.823312 0.714993 0.966782 H\n-0.022228 0.784203 0.218401 H\n0.863472 0.266370 0.877816 H\n0.584723 0.995131 0.297893 H\n0.564809 0.350102 0.060047 C\n0.048586 0.636249 0.165681 C\n0.694737 0.244126 -0.069884 C\n0.969866 0.464870 0.301322 C\n0.461018 0.892754 0.311208 C\n0.009001 0.257724 0.256733 C\n-0.009856 0.634334 0.974572 C\n0.616351 0.089696 0.846757 C\n0.862534 0.499849 0.476508 C\n0.275704 0.329966 0.596389 C\n0.828311 0.673792 0.548426 O\n0.348164 0.871700 0.494635 O\n0.432205 0.338176 0.490977 O\n0.425881 0.041277 0.886523 O\n0.130657 0.737178 0.832439 O\n0.753836 -0.005651 0.720414 O\n0.968327 0.103555 0.366113 O\n0.351188 0.601448 0.827357 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Mg",
"H",
"C",
"O"
],
"chemical_system": "C-H-Mg-O",
"density": 1.70478811862323,
"density_atomic": 0.10638575485150857,
"volume": 300.7921506470961,
"volume_molar": 5.660664595937305,
"formula_full": "Mg2 H12 C10 O8",
"formula_reduced": "MgH6C5O4",
"formula_anonymous": "AB4C5D6",
"energy_above_hull": 4.205131440625,
"spacegroup": 1
},
{
"id": "jvasp-104143",
"created_at": "2022-09-04T14:37:05.024512Z",
"updated_at": "2022-09-04T14:37:05.024533Z",
"structure_string": "H20 C26 O2\n1.0\n5.210263 -0.088523 1.094767\n0.279900 8.729062 0.584224\n-0.602803 -0.621964 9.750277\nH C O\n20 26 2\ndirect\n0.889863 0.788990 0.988100 H\n0.678115 0.576645 0.387293 H\n0.678116 0.576646 0.887294 H\n0.282754 0.097626 0.169772 H\n0.652988 0.336092 0.553005 H\n0.652987 0.336091 0.053003 H\n0.267381 0.832782 0.818633 H\n0.267379 0.832782 0.318633 H\n0.055333 0.616622 0.719240 H\n0.055332 0.616621 0.219240 H\n0.282755 0.097627 0.669772 H\n0.855472 0.104510 0.936394 H\n0.850750 0.897783 0.791419 H\n0.850746 0.897784 0.291416 H\n0.873056 -0.001816 0.636339 H\n0.873054 -0.001816 0.136339 H\n0.079177 0.331811 0.285549 H\n0.079181 0.331811 0.785549 H\n0.889864 0.788990 0.488099 H\n0.855473 0.104510 0.436394 H\n0.584422 0.083440 0.295097 C\n0.353455 0.585008 0.047790 C\n0.353454 0.585007 0.547790 C\n0.704082 0.753491 0.037912 C\n0.704084 0.753493 0.537913 C\n0.363560 0.148392 0.754577 C\n0.248942 0.280393 0.318445 C\n0.588156 0.632906 0.981655 C\n0.588155 0.632905 0.481653 C\n0.363559 0.148392 0.254578 C\n0.584420 0.083443 0.795098 C\n0.248940 0.280394 0.818445 C\n0.352579 0.347406 0.425931 C\n0.356185 0.778034 0.723037 C\n0.590798 0.828869 0.658387 C\n0.590799 0.828869 0.158386 C\n0.683255 0.153023 0.403669 C\n0.683258 0.153024 0.903670 C\n0.237424 0.656674 0.668845 C\n0.237423 0.656674 0.168845 C\n0.571650 0.284272 0.469059 C\n0.571653 0.284272 0.969060 C\n0.356182 0.778033 0.223037 C\n0.734012 0.951730 0.719671 C\n0.734011 0.951731 0.219676 C\n0.352583 0.347404 0.925930 C\n0.218894 0.471804 -0.007178 O\n0.218896 0.471804 0.492822 O\n",
"nsites": 48,
"nelements": 3,
"elements": [
"H",
"C",
"O"
],
"chemical_system": "C-H-O",
"density": 1.3412663071500255,
"density_atomic": 0.10638640222846413,
"volume": 451.1854804237134,
"volume_molar": 5.660630149957972,
"formula_full": "H20 C26 O2",
"formula_reduced": "H10C13O",
"formula_anonymous": "AB10C13",
"energy_above_hull": 5.661648062499999,
"spacegroup": 1
}
]
}