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=4347",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4345",
"results": [
{
"id": "jvasp-90795",
"created_at": "2022-09-04T14:35:48.533170Z",
"updated_at": "2022-09-04T14:35:48.533195Z",
"structure_string": "C6 N2\n1.0\n0.000000 0.000000 -6.605555\n-1.850587 -3.205310 -0.000000\n-1.850587 3.205310 0.000000\nC N\n6 2\ndirect\n0.750001 0.233522 0.000000 C\n0.750001 0.766480 0.766480 C\n0.750001 0.000000 0.233522 C\n0.250000 0.766479 0.000001 C\n0.250000 0.233522 0.233522 C\n0.250000 0.000001 0.766479 C\n0.500000 0.000000 0.000000 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 8,
"nelements": 2,
"elements": [
"C",
"N"
],
"chemical_system": "C-N",
"density": 2.120640860611309,
"density_atomic": 0.10208716250927007,
"volume": 78.36440746674252,
"volume_molar": 5.899018654233981,
"formula_full": "C6 N2",
"formula_reduced": "C3N",
"formula_anonymous": "AB3",
"energy_above_hull": 6.7060458125,
"spacegroup": 193
},
{
"id": "jvasp-46152",
"created_at": "2022-09-04T14:38:10.031641Z",
"updated_at": "2022-09-04T14:38:10.031662Z",
"structure_string": "V2 O2 F2\n1.0\n-3.390771 -0.000008 -0.000001\n-1.695380 2.936568 0.000059\n0.000008 1.957621 -5.902256\nV O F\n2 2 2\ndirect\n0.760110 0.479779 0.280283 V\n0.239890 0.520220 0.719719 V\n0.875089 0.249824 0.625279 O\n0.124911 0.750175 0.374722 O\n0.627146 0.745706 0.881475 F\n0.372853 0.254293 0.118526 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.856359701722484,
"density_atomic": 0.10209187400673886,
"volume": 58.770593236479854,
"volume_molar": 5.898746416979761,
"formula_full": "V2 O2 F2",
"formula_reduced": "VOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0921059941666666,
"spacegroup": 166
},
{
"id": "jvasp-22723",
"created_at": "2022-09-04T14:36:17.257429Z",
"updated_at": "2022-09-04T14:36:17.257448Z",
"structure_string": "Mg2 Mo2 N4\n1.0\n2.924563 0.000000 0.000000\n-1.462282 2.532746 0.000000\n-0.000000 0.000000 10.578468\nMg Mo N\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.666666 0.333332 0.250000 Mo\n0.333336 0.666671 0.750000 Mo\n0.333334 0.666667 0.127311 N\n0.333334 0.666667 0.372689 N\n0.666668 0.333336 0.627311 N\n0.666668 0.333336 0.872689 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Mo",
"N"
],
"chemical_system": "Mg-Mo-N",
"density": 6.283809435356481,
"density_atomic": 0.10209737847382741,
"volume": 78.35656624671117,
"volume_molar": 5.898428392599493,
"formula_full": "Mg2 Mo2 N4",
"formula_reduced": "MgMoN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.5819353625000003,
"spacegroup": 194
},
{
"id": "jvasp-35175",
"created_at": "2022-09-04T14:37:58.637618Z",
"updated_at": "2022-09-04T14:37:58.637640Z",
"structure_string": "Mg8 Si4 O16\n1.0\n5.076796 0.006411 0.002084\n-1.745306 5.489846 0.000917\n-1.585459 -0.886856 9.834503\nMg Si O\n8 4 16\ndirect\n0.012685 0.315527 0.888471 Mg\n0.974200 0.986685 0.079496 Mg\n0.992755 0.267170 0.340922 Mg\n0.493461 0.151104 0.483983 Mg\n0.447403 0.851106 0.205850 Mg\n0.994156 0.035054 0.627051 Mg\n0.539486 0.451110 0.762118 Mg\n0.493454 0.651107 0.483985 Mg\n0.611842 0.399859 0.089437 Si\n0.375047 0.902362 0.878534 Si\n0.984200 0.756067 0.354621 Si\n0.002705 0.546158 0.613352 Si\n0.759528 0.939062 0.414295 O\n0.716456 0.978292 0.904451 O\n0.227375 0.363163 0.553678 O\n0.782653 0.479859 0.433860 O\n0.250529 0.838240 0.017703 O\n0.204253 0.822364 0.534112 O\n0.207420 0.602002 0.311545 O\n0.199577 0.028871 0.304767 O\n0.787327 0.273351 0.663206 O\n0.262246 0.112663 0.798747 O\n0.736364 0.463983 0.950268 O\n0.240799 0.625615 0.775851 O\n0.779483 0.700222 0.656426 O\n0.724651 0.189559 0.169226 O\n0.746101 0.676609 0.192121 O\n0.270440 0.323931 0.063521 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Mg",
"Si",
"O"
],
"chemical_system": "Mg-O-Si",
"density": 3.4077279527115327,
"density_atomic": 0.10210360129299278,
"volume": 274.23126751085124,
"volume_molar": 5.898068906227003,
"formula_full": "Mg8 Si4 O16",
"formula_reduced": "Mg2SiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.3860043857142856,
"spacegroup": 2
},
{
"id": "jvasp-95207",
"created_at": "2022-09-04T14:35:52.927450Z",
"updated_at": "2022-09-04T14:35:52.927466Z",
"structure_string": "Sr2 H12 C8 O14\n1.0\n6.565979 3.185444 -0.944718\n-6.565979 3.185444 0.944718\n0.011571 0.000000 8.426977\nSr H C O\n2 12 8 14\ndirect\n0.986544 0.986544 0.750000 Sr\n0.013455 0.013455 0.250000 Sr\n0.449797 0.538810 0.677895 H\n0.538810 0.449797 0.822105 H\n0.550202 0.461189 0.322105 H\n0.461189 0.550202 0.177895 H\n0.135719 0.412888 0.478920 H\n0.412888 0.135719 0.021080 H\n0.587111 0.864279 0.978920 H\n0.110910 0.492531 0.638212 H\n0.492531 0.110910 0.861789 H\n0.889088 0.507467 0.361789 H\n0.507467 0.889088 0.138212 H\n0.864279 0.587111 0.521081 H\n0.551010 0.013191 0.621455 C\n0.448989 0.986808 0.378545 C\n0.986808 0.448989 0.121455 C\n0.013190 0.551010 0.878545 C\n0.386724 0.033765 0.518469 C\n0.033765 0.386724 0.981532 C\n0.613275 0.966234 0.481532 C\n0.966234 0.613275 0.018468 C\n0.969700 0.378761 0.267915 O\n0.378761 0.969700 0.232085 O\n0.246051 0.072965 0.533740 O\n0.072965 0.246051 0.966260 O\n0.753948 0.927034 0.466260 O\n0.927034 0.753948 0.033740 O\n0.410699 0.410699 0.250000 O\n0.589300 0.589300 0.750000 O\n0.405207 0.156978 0.903380 O\n0.156978 0.405207 0.596620 O\n0.594792 0.843021 0.096620 O\n0.843021 0.594792 0.403380 O\n0.621238 0.030299 0.767915 O\n0.030299 0.621238 0.732085 O\n",
"nsites": 36,
"nelements": 4,
"elements": [
"Sr",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Sr",
"density": 2.3897539195171555,
"density_atomic": 0.1021046312543251,
"volume": 352.5795016127151,
"volume_molar": 5.89800941056227,
"formula_full": "Sr2 H12 C8 O14",
"formula_reduced": "SrH6C4O7",
"formula_anonymous": "AB4C6D7",
"energy_above_hull": 3.8389250450000008,
"spacegroup": 15
},
{
"id": "jvasp-61695",
"created_at": "2022-09-04T14:35:44.993682Z",
"updated_at": "2022-09-04T14:35:44.993704Z",
"structure_string": "Li6 Ga2 B4 O12\n1.0\n4.961387 0.008377 0.006858\n0.022716 6.196920 -0.210078\n0.076079 2.283471 7.567800\nLi Ga B O\n6 2 4 12\ndirect\n0.676635 0.400645 0.425928 Li\n0.323367 0.599356 0.574072 Li\n0.174776 0.468089 0.239866 Li\n0.825225 0.531912 0.760134 Li\n0.833075 0.241486 0.109304 Li\n0.166927 0.758514 0.890695 Li\n0.648242 0.049524 0.768301 Ga\n0.351760 0.950476 0.231699 Ga\n0.660453 0.672828 0.071702 B\n0.339549 0.327172 0.928298 B\n0.162782 0.174984 0.587734 B\n0.837220 0.825017 0.412266 B\n0.289301 0.013671 0.720836 O\n0.780377 0.781791 0.910024 O\n0.219624 0.218210 0.089976 O\n0.880123 0.175966 0.588737 O\n0.119879 0.824034 0.411263 O\n0.301162 0.330085 0.467223 O\n0.698840 0.669915 0.532777 O\n0.794057 0.510640 0.185667 O\n0.205944 0.489360 0.814333 O\n0.389594 0.731384 0.100494 O\n0.610408 0.268617 0.899506 O\n0.710700 -0.013670 0.279164 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Ga",
"B",
"O"
],
"chemical_system": "B-Ga-Li-O",
"density": 2.9412052483072593,
"density_atomic": 0.10210594327643772,
"volume": 235.04998073445458,
"volume_molar": 5.897933623409057,
"formula_full": "Li6 Ga2 B4 O12",
"formula_reduced": "Li3Ga(BO3)2",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 2.3454523743055558,
"spacegroup": 2
},
{
"id": "jvasp-117280",
"created_at": "2022-09-04T14:38:49.542541Z",
"updated_at": "2022-09-04T14:38:49.542566Z",
"structure_string": "Li8 Cr4 O8\n1.0\n5.468772 0.166204 0.000019\n1.464047 6.344712 0.000015\n-0.000020 -0.000009 5.684857\nLi Cr O\n8 4 8\ndirect\n0.634730 0.326527 0.499998 Li\n0.634731 0.826526 0.750000 Li\n0.634730 0.326527 -0.000003 Li\n0.634731 0.826526 0.250000 Li\n0.365271 0.673472 0.499997 Li\n0.365270 0.173473 0.750000 Li\n0.365271 0.673472 -0.000003 Li\n0.365270 0.173473 0.250000 Li\n0.000000 -0.000000 -0.000029 Cr\n0.000000 0.500000 0.750031 Cr\n0.000000 -0.000000 0.499971 Cr\n0.000000 0.500000 0.250030 Cr\n0.263506 0.400447 0.500023 O\n0.263508 0.900447 0.749978 O\n0.263506 0.400448 0.000023 O\n0.263508 0.900447 0.249978 O\n0.736495 0.599551 0.500023 O\n0.736492 0.099552 0.749979 O\n0.736495 0.599551 0.000023 O\n0.736492 0.099552 0.249979 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Li",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O",
"density": 3.319130988862626,
"density_atomic": 0.10210925163504486,
"volume": 195.86863755973127,
"volume_molar": 5.897742529270623,
"formula_full": "Li8 Cr4 O8",
"formula_reduced": "Li2CrO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.97403688,
"spacegroup": 12
},
{
"id": "jvasp-119690",
"created_at": "2022-09-04T14:38:52.216749Z",
"updated_at": "2022-09-04T14:38:52.216778Z",
"structure_string": "Li8 Cr4 O8\n1.0\n3.481875 0.123466 -0.697767\n1.414856 9.776639 1.572172\n-0.003302 0.015627 5.787218\nLi Cr O\n8 4 8\ndirect\n0.807113 0.740342 0.894422 Li\n0.307127 0.990336 0.644448 Li\n0.807137 0.240341 0.394422 Li\n0.307145 0.490338 0.144446 Li\n0.192856 0.759663 0.605552 Li\n0.692868 0.009660 0.355576 Li\n0.192877 0.259665 0.105554 Li\n0.692890 0.509660 0.855580 Li\n0.500021 0.250002 0.749995 Cr\n-0.000024 0.000001 0.000002 Cr\n0.500008 0.750000 0.249990 Cr\n0.000000 0.499998 0.500012 Cr\n0.732507 0.666012 0.597517 O\n0.232521 0.916009 0.347527 O\n0.732524 0.166013 0.097522 O\n0.232540 0.416014 0.847527 O\n0.267462 0.833988 0.902476 O\n0.767483 0.083987 0.652480 O\n0.267483 0.333992 0.402472 O\n0.767492 0.583991 0.152481 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Li",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O",
"density": 3.3191451400431196,
"density_atomic": 0.10210968697985492,
"volume": 195.86780247348884,
"volume_molar": 5.89771738423613,
"formula_full": "Li8 Cr4 O8",
"formula_reduced": "Li2CrO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.97405688,
"spacegroup": 12
},
{
"id": "jvasp-112110",
"created_at": "2022-09-04T14:38:44.831264Z",
"updated_at": "2022-09-04T14:38:44.831291Z",
"structure_string": "Zn1 H2 C3 O4\n1.0\n4.343760 0.111790 0.344744\n1.245361 3.834748 0.853023\n-0.054789 0.462450 6.016452\nZn H C O\n1 2 3 4\ndirect\n0.484773 0.094919 0.392752 Zn\n0.198986 0.692961 0.921745 H\n0.764482 0.893899 0.855463 H\n0.032692 0.506562 0.672677 C\n0.976553 0.648540 0.884368 C\n0.909244 0.373882 0.091193 C\n-0.184009 0.622858 0.512667 O\n0.305334 0.261007 0.666613 O\n0.133525 0.098782 0.202823 O\n0.609336 0.434251 0.138908 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Zn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Zn",
"density": 2.8393664536324774,
"density_atomic": 0.10211165594220153,
"volume": 97.93201283172138,
"volume_molar": 5.897603661827524,
"formula_full": "Zn1 H2 C3 O4",
"formula_reduced": "ZnH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 3.659198439999999,
"spacegroup": 1
},
{
"id": "jvasp-47503",
"created_at": "2022-09-04T14:36:33.166600Z",
"updated_at": "2022-09-04T14:36:33.166619Z",
"structure_string": "Co4 Cu2 O8\n1.0\n-4.239891 4.020980 0.003292\n4.239891 0.003292 4.020980\n4.239891 4.020980 0.003292\nCo Cu O\n4 2 8\ndirect\n0.012018 -0.000000 0.987982 Co\n0.625000 0.249999 0.625000 Co\n0.237982 0.500000 0.262018 Co\n0.125000 0.750000 0.625000 Co\n0.625000 0.250000 0.125000 Cu\n0.625000 0.749999 0.625000 Cu\n0.839379 0.237872 0.398495 O\n0.367554 0.228412 0.404034 O\n0.882445 0.271587 0.845967 O\n0.882445 0.728412 0.389142 O\n0.886368 0.737872 0.851505 O\n0.410621 0.262127 0.851505 O\n0.363631 0.762127 0.398495 O\n0.367554 0.771587 0.860858 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Co",
"Cu",
"O"
],
"chemical_system": "Co-Cu-O",
"density": 5.944606452847875,
"density_atomic": 0.1021127126241192,
"volume": 137.10339917748084,
"volume_molar": 5.897542632294699,
"formula_full": "Co4 Cu2 O8",
"formula_reduced": "Co2CuO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.43263375,
"spacegroup": 74
},
{
"id": "jvasp-114454",
"created_at": "2022-09-04T14:38:41.735528Z",
"updated_at": "2022-09-04T14:38:41.735554Z",
"structure_string": "N1 F1\n1.0\n3.303176 -0.000000 -0.000000\n-1.651588 2.860635 0.000000\n-0.000000 0.000000 2.072720\nN F\n1 1\ndirect\n0.000000 0.000000 0.000000 N\n0.333333 0.666667 0.000000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"N",
"F"
],
"chemical_system": "F-N",
"density": 2.7983072144177767,
"density_atomic": 0.1021163293364341,
"volume": 19.585506186877986,
"volume_molar": 5.897333755661505,
"formula_full": "N1 F1",
"formula_reduced": "NF",
"formula_anonymous": "AB",
"energy_above_hull": 2.77261176625,
"spacegroup": 187
},
{
"id": "jvasp-50747",
"created_at": "2022-09-04T14:37:28.951756Z",
"updated_at": "2022-09-04T14:37:28.951777Z",
"structure_string": "Li5 Cu1 F8\n1.0\n4.998074 -0.018684 0.000000\n-1.716492 4.694118 0.000000\n0.000000 0.000000 5.851415\nLi Cu F\n5 1 8\ndirect\n0.000000 0.500000 0.227969 Li\n0.000000 0.500000 0.772032 Li\n0.500000 0.500001 0.000000 Li\n0.500000 0.000000 0.227969 Li\n0.500000 0.000000 0.772032 Li\n0.500000 0.500001 0.500000 Cu\n0.264232 0.735769 0.000000 F\n0.265971 0.734030 0.500000 F\n0.271179 0.271179 0.260263 F\n0.271179 0.271179 0.739738 F\n0.728821 0.728822 0.260263 F\n0.728821 0.728822 0.739738 F\n0.734029 0.265972 0.500000 F\n0.735768 0.264233 0.000000 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Cu",
"F"
],
"chemical_system": "Cu-F-Li",
"density": 3.03095321186929,
"density_atomic": 0.10211852157259803,
"volume": 137.09560013603536,
"volume_molar": 5.897207154256286,
"formula_full": "Li5 Cu1 F8",
"formula_reduced": "Li5CuF8",
"formula_anonymous": "AB5C8",
"energy_above_hull": 0.1467551008928571,
"spacegroup": 65
}
]
}