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=-nelements&page=3523",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=3521",
"results": [
{
"id": "jvasp-2589",
"created_at": "2022-09-04T14:36:54.463249Z",
"updated_at": "2022-09-04T14:36:54.463275Z",
"structure_string": "Ba2 Se4\n1.0\n4.739299 0.000000 1.421251\n2.280886 4.900390 1.006616\n-0.015900 0.056247 8.665473\nBa Se\n2 4\ndirect\n0.125417 0.250000 0.750000 Ba\n0.874583 0.750000 0.250000 Ba\n0.469396 0.284114 0.027876 Se\n0.781386 0.215886 0.472124 Se\n0.218615 0.784114 0.527876 Se\n0.530604 0.715887 0.972124 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 4.871628628969118,
"density_atomic": 0.02980992187311265,
"volume": 201.27526752801583,
"volume_molar": 20.201799876006145,
"formula_full": "Ba2 Se4",
"formula_reduced": "BaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7388244555555553,
"spacegroup": 15
},
{
"id": "jvasp-16210",
"created_at": "2022-09-04T14:36:42.732777Z",
"updated_at": "2022-09-04T14:36:42.732787Z",
"structure_string": "Co2 Te4\n1.0\n3.918418 0.000000 0.000000\n0.000000 5.376017 -0.000000\n0.000000 -0.000000 6.325553\nCo Te\n2 4\ndirect\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.228112 0.361054 Te\n0.000000 0.771888 0.638945 Te\n0.500000 0.728113 0.138946 Te\n0.500000 0.271888 0.861054 Te\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Co",
"Te"
],
"chemical_system": "Co-Te",
"density": 7.829301712841212,
"density_atomic": 0.04502786499548316,
"volume": 133.2508214769204,
"volume_molar": 13.37425338866076,
"formula_full": "Co2 Te4",
"formula_reduced": "CoTe2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4551954777777776,
"spacegroup": 58
},
{
"id": "jvasp-101415",
"created_at": "2022-09-04T14:36:52.451371Z",
"updated_at": "2022-09-04T14:36:52.451397Z",
"structure_string": "Tb3 Sc1\n1.0\n4.873749 -0.000000 0.000000\n0.000000 4.873749 0.000000\n0.000000 0.000000 4.873749\nTb Sc\n3 1\ndirect\n0.000000 0.500000 0.500000 Tb\n0.500000 0.000000 0.500000 Tb\n0.500000 0.500000 0.000000 Tb\n0.000000 0.000000 0.000000 Sc\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tb",
"Sc"
],
"chemical_system": "Sc-Tb",
"density": 7.483539635908039,
"density_atomic": 0.03455178702358398,
"volume": 115.76825237055681,
"volume_molar": 17.429317782867418,
"formula_full": "Tb3 Sc1",
"formula_reduced": "Tb3Sc",
"formula_anonymous": "AB3",
"energy_above_hull": 1.7288451125000002,
"spacegroup": 221
},
{
"id": "jvasp-8160",
"created_at": "2022-09-04T14:36:44.368218Z",
"updated_at": "2022-09-04T14:36:44.368243Z",
"structure_string": "U1 O3\n1.0\n1.900329 -3.291465 -0.000000\n1.900329 3.291465 0.000000\n-0.000000 0.000000 4.150577\nU O\n1 3\ndirect\n0.000000 0.000000 0.000000 U\n0.333333 0.666668 0.116279 O\n0.000000 0.000000 0.500000 O\n0.666668 0.333333 0.883722 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 9.14744458840864,
"density_atomic": 0.07703773103847959,
"volume": 51.92260916929185,
"volume_molar": 7.817131526098555,
"formula_full": "U1 O3",
"formula_reduced": "UO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.493919125000001,
"spacegroup": 164
},
{
"id": "jvasp-5296",
"created_at": "2022-09-04T14:36:52.454502Z",
"updated_at": "2022-09-04T14:36:52.454525Z",
"structure_string": "Ca2 H4\n1.0\n1.902243 -3.294781 0.000000\n1.902243 3.294781 0.000000\n0.000000 0.000000 5.316893\nCa H\n2 4\ndirect\n0.666666 0.333332 0.750000 Ca\n0.333332 0.666666 0.250000 Ca\n0.666666 0.333332 0.250000 H\n0.333332 0.666666 0.750000 H\n0.000000 0.000000 0.000000 H\n0.000000 0.000000 0.500000 H\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"H"
],
"chemical_system": "Ca-H",
"density": 2.097575434480477,
"density_atomic": 0.09002658718220963,
"volume": 66.64697827383236,
"volume_molar": 6.689291406561338,
"formula_full": "Ca2 H4",
"formula_reduced": "CaH2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.1851134733333335,
"spacegroup": 194
},
{
"id": "jvasp-18931",
"created_at": "2022-09-04T14:36:52.455720Z",
"updated_at": "2022-09-04T14:36:52.455743Z",
"structure_string": "Pr1 Ga2\n1.0\n2.140812 -3.707996 -0.000000\n2.140812 3.707996 0.000000\n-0.000000 -0.000000 4.336509\nPr Ga\n1 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.666667 0.333332 0.500000 Ga\n0.333332 0.666667 0.500000 Ga\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pr",
"Ga"
],
"chemical_system": "Ga-Pr",
"density": 6.761877161466533,
"density_atomic": 0.04357458097897388,
"volume": 68.84747787816009,
"volume_molar": 13.820306758442207,
"formula_full": "Pr1 Ga2",
"formula_reduced": "PrGa2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0524222055555556,
"spacegroup": 191
},
{
"id": "jvasp-104976",
"created_at": "2022-09-04T14:36:52.755475Z",
"updated_at": "2022-09-04T14:36:52.755493Z",
"structure_string": "Ag1 Pd1\n1.0\n2.730725 0.007314 4.109336\n1.246293 2.429746 4.109336\n0.011935 0.007314 4.933899\nAg Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.499999 0.500002 Pd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ag",
"Pd"
],
"chemical_system": "Ag-Pd",
"density": 10.939357103234597,
"density_atomic": 0.06148574519954971,
"volume": 32.527864686506994,
"volume_molar": 9.79436898821892,
"formula_full": "Ag1 Pd1",
"formula_reduced": "AgPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.42638648,
"spacegroup": 166
},
{
"id": "jvasp-4912",
"created_at": "2022-09-04T14:36:43.697758Z",
"updated_at": "2022-09-04T14:36:43.697790Z",
"structure_string": "K8 Se20\n1.0\n6.615656 0.000000 0.000000\n0.000000 6.994808 0.000000\n0.000000 0.000000 17.705104\nK Se\n8 20\ndirect\n0.882206 0.585635 0.006986 K\n0.382205 0.914365 0.993014 K\n0.117795 0.085635 0.493014 K\n0.617795 0.414365 0.506986 K\n0.091077 0.259195 0.839331 K\n0.591077 0.240805 0.160669 K\n0.908924 0.759195 0.660669 K\n0.408923 0.740805 0.339331 K\n0.587682 0.742836 0.165547 Se\n0.079747 0.145987 0.124938 Se\n0.579747 0.354013 0.875062 Se\n0.396649 0.424028 0.987273 Se\n0.420253 0.854013 0.624938 Se\n0.896650 0.075972 0.012727 Se\n0.087682 0.757165 0.834453 Se\n0.920254 0.645987 0.375062 Se\n0.412319 0.242836 0.334453 Se\n0.756833 0.131486 0.348738 Se\n0.243167 0.631486 0.151261 Se\n0.743168 0.868514 0.848738 Se\n0.103351 0.575972 0.487273 Se\n0.256833 0.368514 0.651261 Se\n0.027826 0.874011 0.207736 Se\n0.527826 0.625989 0.792264 Se\n0.972175 0.374011 0.292264 Se\n0.472174 0.125989 0.707735 Se\n0.912319 0.257164 0.665546 Se\n0.603351 0.924028 0.512727 Se\n",
"nsites": 28,
"nelements": 2,
"elements": [
"K",
"Se"
],
"chemical_system": "K-Se",
"density": 3.8345986300038355,
"density_atomic": 0.03417518202282337,
"volume": 819.3079990415453,
"volume_molar": 17.621386057221898,
"formula_full": "K8 Se20",
"formula_reduced": "K2Se5",
"formula_anonymous": "A2B5",
"energy_above_hull": 0.975017638095238,
"spacegroup": 19
},
{
"id": "jvasp-57868",
"created_at": "2022-09-04T14:37:00.461897Z",
"updated_at": "2022-09-04T14:37:00.461927Z",
"structure_string": "Cr4 Sn8\n1.0\n5.208717 -0.000000 1.530565\n2.604359 4.679320 0.765283\n0.006316 -0.000000 9.606770\nCr Sn\n4 8\ndirect\n0.251715 0.750000 0.496572 Cr\n0.998286 0.750000 0.003428 Cr\n0.748286 0.250000 0.503428 Cr\n0.001715 0.250000 0.996572 Cr\n0.543680 0.750000 0.912641 Sn\n0.706322 0.750000 0.587359 Sn\n0.456321 0.250000 0.087359 Sn\n0.293680 0.250000 0.412641 Sn\n0.290003 0.419997 0.750000 Sn\n0.959999 0.080003 0.750000 Sn\n0.709999 0.580003 0.250000 Sn\n0.040003 0.919997 0.250000 Sn\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cr",
"Sn"
],
"chemical_system": "Cr-Sn",
"density": 8.211543244381822,
"density_atomic": 0.0512594869030268,
"volume": 234.1030065849414,
"volume_molar": 11.748343816614367,
"formula_full": "Cr4 Sn8",
"formula_reduced": "CrSn2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7240736,
"spacegroup": 70
},
{
"id": "jvasp-12197",
"created_at": "2022-09-04T14:36:46.980964Z",
"updated_at": "2022-09-04T14:36:46.980991Z",
"structure_string": "Sn2 O4\n1.0\n-2.800157 -1.643549 -0.036578\n0.004828 3.210256 -0.489121\n-0.973573 1.867492 -9.297615\nSn O\n2 4\ndirect\n0.997694 -0.000478 0.502079 Sn\n0.997865 -0.000048 0.002074 Sn\n0.740046 0.484281 0.388440 O\n0.589086 0.182346 0.115367 O\n0.255344 0.514771 0.615724 O\n0.406639 0.817567 0.888776 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sn",
"O"
],
"chemical_system": "O-Sn",
"density": 6.252578264228515,
"density_atomic": 0.07495363197062078,
"volume": 80.04948982794845,
"volume_molar": 8.034488258501563,
"formula_full": "Sn2 O4",
"formula_reduced": "SnO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.018639566666667,
"spacegroup": 166
},
{
"id": "jvasp-102458",
"created_at": "2022-09-04T14:36:48.592010Z",
"updated_at": "2022-09-04T14:36:48.592032Z",
"structure_string": "Be3 Cu1\n1.0\n3.182735 -0.000000 1.837553\n1.060912 3.000711 1.837553\n-0.000000 -0.000000 3.675106\nBe Cu\n3 1\ndirect\n0.250000 0.250000 0.250000 Be\n0.750001 0.750000 0.749999 Be\n0.500001 0.500000 0.500000 Be\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Be",
"Cu"
],
"chemical_system": "Be-Cu",
"density": 4.285476328149829,
"density_atomic": 0.11396341931340648,
"volume": 35.09898197244988,
"volume_molar": 5.28427524926989,
"formula_full": "Be3 Cu1",
"formula_reduced": "Be3Cu",
"formula_anonymous": "AB3",
"energy_above_hull": 1.2478621875,
"spacegroup": 225
},
{
"id": "jvasp-16914",
"created_at": "2022-09-04T14:36:54.504191Z",
"updated_at": "2022-09-04T14:36:54.504217Z",
"structure_string": "Mn2 S4\n1.0\n4.646769 -0.000000 -2.113400\n-0.961196 4.546268 -2.113401\n-0.086563 -0.106779 5.974837\nMn S\n2 4\ndirect\n0.250000 0.750000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.895489 0.875000 0.250000 S\n0.625000 0.104510 0.750000 S\n0.354510 0.375000 0.250000 S\n0.125000 0.645490 0.750000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mn",
"S"
],
"chemical_system": "Mn-S",
"density": 3.1858022013661493,
"density_atomic": 0.04833878635558733,
"volume": 124.12392723025985,
"volume_molar": 12.458196024410361,
"formula_full": "Mn2 S4",
"formula_reduced": "MnS2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.2602724137931034,
"spacegroup": 122
}
]
}