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=231",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=229",
"results": [
{
"id": "jvasp-101102",
"created_at": "2022-09-04T14:36:34.804026Z",
"updated_at": "2022-09-04T14:36:34.804053Z",
"structure_string": "Te1 Pb3 Cl2 O4\n1.0\n6.869743 0.038488 0.000000\n-4.603843 5.098968 0.000000\n-0.000000 -0.000000 5.610859\nTe Pb Cl O\n1 3 2 4\ndirect\n0.071903 0.928098 0.500000 Te\n0.611506 0.388495 -0.000000 Pb\n0.389251 0.610749 0.500000 Pb\n0.895121 0.104880 -0.000000 Pb\n0.259757 0.740244 -0.000000 Cl\n0.748874 0.251127 0.500000 Cl\n0.772818 0.761024 0.266570 O\n0.772818 0.761024 0.733430 O\n0.238977 0.227183 0.266570 O\n0.238977 0.227183 0.733430 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Te",
"Pb",
"Cl",
"O"
],
"chemical_system": "Cl-O-Pb-Te",
"density": 7.432052643178868,
"density_atomic": 0.05062400737698638,
"volume": 197.5347373338522,
"volume_molar": 11.895819932140851,
"formula_full": "Te1 Pb3 Cl2 O4",
"formula_reduced": "TePb3(ClO2)2",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 1.2436212361666663,
"spacegroup": 38
},
{
"id": "jvasp-99591",
"created_at": "2022-09-04T14:36:34.652235Z",
"updated_at": "2022-09-04T14:36:34.652257Z",
"structure_string": "K2 Rb1 Bi1 F6\n1.0\n5.960051 -0.000000 3.441037\n1.986684 5.619190 3.441037\n-0.000000 -0.000000 6.882074\nK Rb Bi F\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Bi\n0.767729 0.232270 0.232271 F\n0.232270 0.232270 0.767730 F\n0.232270 0.767730 0.767730 F\n0.232270 0.767730 0.232271 F\n0.767729 0.232270 0.767730 F\n0.767729 0.767730 0.232271 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"Bi",
"F"
],
"chemical_system": "Bi-F-K-Rb",
"density": 3.505981363680398,
"density_atomic": 0.04338673496757155,
"volume": 230.485193400109,
"volume_molar": 13.880142777512797,
"formula_full": "K2 Rb1 Bi1 F6",
"formula_reduced": "K2RbBiF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107806",
"created_at": "2022-09-04T14:36:34.229723Z",
"updated_at": "2022-09-04T14:36:34.229749Z",
"structure_string": "K2 Li1 La1 Cl6\n1.0\n6.419645 -0.000000 3.706384\n2.139882 6.052499 3.706384\n-0.000000 -0.000000 7.412768\nK Li La Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.499999 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 La\n0.738370 0.261629 0.261629 Cl\n0.261629 0.261629 0.738371 Cl\n0.261629 0.738371 0.738371 Cl\n0.261629 0.738371 0.261629 Cl\n0.738370 0.261629 0.738371 Cl\n0.738370 0.738371 0.261629 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Li",
"La",
"Cl"
],
"chemical_system": "Cl-K-La-Li",
"density": 2.5180646235393804,
"density_atomic": 0.03471953123242179,
"volume": 288.02232187575737,
"volume_molar": 17.345109643578382,
"formula_full": "K2 Li1 La1 Cl6",
"formula_reduced": "K2LiLaCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-48722",
"created_at": "2022-09-04T14:36:12.352679Z",
"updated_at": "2022-09-04T14:36:12.352702Z",
"structure_string": "Li10 Fe2 O6 F2\n1.0\n-1.820950 -4.695181 -4.351729\n-1.820950 4.695181 -4.351729\n3.675426 0.000000 -2.915152\nLi Fe O F\n10 2 6 2\ndirect\n0.963516 0.546434 0.254484 Li\n0.467956 0.037878 0.743668 Li\n0.212121 0.782043 0.506333 Li\n0.268610 0.268610 0.241708 Li\n0.981390 0.981390 0.008292 Li\n0.037878 0.467956 0.743668 Li\n0.286483 0.703566 0.995517 Li\n0.546434 0.963516 0.254484 Li\n0.703566 0.286483 0.995517 Li\n0.782043 0.212121 0.506333 Li\n0.494361 0.494361 0.493532 Fe\n0.755639 0.755639 0.756469 Fe\n0.228107 0.525600 0.374222 O\n0.525600 0.228107 0.374222 O\n0.770561 0.479438 0.625001 O\n0.479438 0.770561 0.625001 O\n0.724399 0.021893 0.875779 O\n0.021893 0.724399 0.875779 O\n0.979400 0.270600 0.125000 F\n0.270600 0.979400 0.125000 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-Li-O",
"density": 2.615586167225775,
"density_atomic": 0.09997948387620885,
"volume": 200.04104066753646,
"volume_molar": 6.023376523383946,
"formula_full": "Li10 Fe2 O6 F2",
"formula_reduced": "Li5FeO3F",
"formula_anonymous": "ABC3D5",
"energy_above_hull": 1.4712696282500002,
"spacegroup": 12
},
{
"id": "jvasp-97031",
"created_at": "2022-09-04T14:36:35.569971Z",
"updated_at": "2022-09-04T14:36:35.569998Z",
"structure_string": "La2 Fe2 As2 O2\n1.0\n4.024660 -0.000000 0.000000\n0.000000 4.024660 -0.000000\n0.000000 0.000000 8.562617\nLa Fe As O\n2 2 2 2\ndirect\n0.250000 0.250000 0.146056 La\n0.750000 0.750000 0.853944 La\n0.750000 0.250000 0.500000 Fe\n0.250000 0.750000 0.500000 Fe\n0.250000 0.250000 0.639852 As\n0.750000 0.750000 0.360148 As\n0.750000 0.250000 0.000000 O\n0.250000 0.750000 0.000000 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"La",
"Fe",
"As",
"O"
],
"chemical_system": "As-Fe-La-O",
"density": 6.840392924937613,
"density_atomic": 0.05767997631953673,
"volume": 138.69631214273448,
"volume_molar": 10.440608932705555,
"formula_full": "La2 Fe2 As2 O2",
"formula_reduced": "LaFeAsO",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.0223289375,
"spacegroup": 129
},
{
"id": "jvasp-43581",
"created_at": "2022-09-04T14:36:12.379466Z",
"updated_at": "2022-09-04T14:36:12.379491Z",
"structure_string": "Li4 Fe2 B4 O12\n1.0\n0.000000 5.356082 0.052129\n7.691359 0.000000 0.000000\n0.000000 -2.783538 -5.084594\nLi Fe B O\n4 2 4 12\ndirect\n0.609008 0.435872 0.800051 Li\n0.390990 0.935872 0.699948 Li\n0.609008 0.064128 0.300051 Li\n0.390991 0.564128 0.199948 Li\n0.000000 0.000000 0.000000 Fe\n-0.000000 0.500000 0.500000 Fe\n0.120888 0.258601 0.869182 B\n0.879110 0.758601 0.630817 B\n0.120888 0.241399 0.369182 B\n0.879111 0.741399 0.130817 B\n0.878271 0.264788 0.395323 O\n0.121728 0.764788 0.104677 O\n0.224105 0.081195 0.346475 O\n0.272760 0.394899 0.414897 O\n0.727238 0.605102 0.585102 O\n0.272760 0.105101 0.914896 O\n0.878271 0.235212 0.895322 O\n0.121728 0.735212 0.604676 O\n0.224104 0.418805 0.846475 O\n0.775894 0.581195 0.153524 O\n0.775894 0.918805 0.653524 O\n0.727239 0.894899 0.085103 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Fe",
"B",
"O"
],
"chemical_system": "B-Fe-Li-O",
"density": 2.986315586539296,
"density_atomic": 0.10559327373050069,
"volume": 208.3466041231875,
"volume_molar": 5.703148076808326,
"formula_full": "Li4 Fe2 B4 O12",
"formula_reduced": "Li2Fe(BO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.911670151515151,
"spacegroup": 14
},
{
"id": "jvasp-48112",
"created_at": "2022-09-04T14:36:20.639443Z",
"updated_at": "2022-09-04T14:36:20.639473Z",
"structure_string": "Li1 Mn2 B2 O6\n1.0\n5.143232 -0.003258 -0.074782\n-2.563059 4.554459 0.008929\n-2.225093 -1.423151 5.112395\nLi Mn B O\n1 2 2 6\ndirect\n0.449379 0.397311 0.666412 Li\n0.830516 0.224435 0.243777 Mn\n0.146907 0.764251 0.741929 Mn\n0.182248 0.907848 0.256657 B\n0.818059 0.087780 0.746298 B\n0.025599 0.680884 0.365482 O\n0.336689 0.856292 0.123422 O\n0.213628 0.179798 0.298502 O\n0.782492 0.810230 0.724427 O\n0.620763 0.138205 0.830346 O\n0.028456 0.318967 0.671273 O\n",
"nsites": 11,
"nelements": 4,
"elements": [
"Li",
"Mn",
"B",
"O"
],
"chemical_system": "B-Li-Mn-O",
"density": 3.2782776331021193,
"density_atomic": 0.0926330492882942,
"volume": 118.74811511133144,
"volume_molar": 6.501071492592009,
"formula_full": "Li1 Mn2 B2 O6",
"formula_reduced": "LiMn2(BO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 3.391910059038662,
"spacegroup": 1
},
{
"id": "jvasp-96788",
"created_at": "2022-09-04T14:36:08.593301Z",
"updated_at": "2022-09-04T14:36:08.593329Z",
"structure_string": "Co4 H24 C8 O24\n1.0\n6.963825 0.000000 0.000000\n0.000000 8.515800 -1.178080\n0.000000 -0.083744 9.260312\nCo H C O\n4 24 8 24\ndirect\n0.500000 0.000000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Co\n0.500000 0.500000 -0.000000 Co\n0.959989 0.328921 0.878432 H\n0.540012 0.328921 0.378432 H\n0.040012 0.671079 0.121568 H\n0.737589 0.907390 0.239216 H\n0.237588 0.092610 0.260784 H\n0.262412 0.092611 0.760783 H\n0.762412 0.907390 0.739216 H\n0.105578 0.791051 0.478748 H\n0.605578 0.208949 0.021252 H\n0.894423 0.208949 0.521252 H\n0.880655 0.761022 0.444000 H\n0.459989 0.671079 0.621568 H\n0.380655 0.238979 0.056000 H\n0.119346 0.238979 0.556000 H\n0.619346 0.761022 0.944000 H\n0.905058 0.293313 0.265504 H\n0.405058 0.706688 0.234496 H\n0.094943 0.706688 0.734496 H\n0.594943 0.293313 0.765504 H\n0.843313 0.464676 0.226457 H\n0.343312 0.535324 0.273543 H\n0.394422 0.791052 0.978748 H\n0.156688 0.535325 0.773543 H\n0.656688 0.464676 0.726457 H\n0.396748 0.329005 0.430251 C\n0.704241 0.023318 0.785488 C\n0.204241 0.976682 0.714512 C\n0.295760 0.976682 0.214512 C\n0.896748 0.670995 0.069749 C\n0.103253 0.329005 0.930251 C\n0.603253 0.670996 0.569749 C\n0.795760 0.023318 0.285488 C\n0.717228 0.559537 0.586750 O\n0.217228 0.440463 0.913250 O\n0.282773 0.440463 0.413250 O\n0.782773 0.559537 0.086750 O\n0.354972 0.217296 0.501350 O\n0.854972 0.782704 -0.001350 O\n0.645029 0.782704 0.498650 O\n0.145029 0.217296 0.001350 O\n0.744126 0.081904 0.413722 O\n0.244125 0.918096 0.086278 O\n0.255875 0.918096 0.586278 O\n0.755876 0.081904 0.913722 O\n0.408439 0.907494 0.291819 O\n0.618487 0.405061 0.807308 O\n0.591561 0.092507 0.708181 O\n0.012847 0.719299 0.419984 O\n0.512847 0.280701 0.080015 O\n0.987154 0.280701 0.580015 O\n0.487154 0.719300 0.919984 O\n0.881514 0.405060 0.307308 O\n0.381513 0.594940 0.192692 O\n0.118487 0.594940 0.692692 O\n0.908440 0.092506 0.208181 O\n0.091561 0.907494 0.791819 O\n",
"nsites": 60,
"nelements": 4,
"elements": [
"Co",
"H",
"C",
"O"
],
"chemical_system": "C-Co-H-O",
"density": 2.240383467788063,
"density_atomic": 0.1093946282689531,
"volume": 548.4730004519645,
"volume_molar": 5.50496935296879,
"formula_full": "Co4 H24 C8 O24",
"formula_reduced": "CoH6(CO3)2",
"formula_anonymous": "AB2C6D6",
"energy_above_hull": 3.6861761266666666,
"spacegroup": 14
},
{
"id": "jvasp-108158",
"created_at": "2022-09-04T14:36:12.426516Z",
"updated_at": "2022-09-04T14:36:12.426548Z",
"structure_string": "Ba1 Na1 Fe4 As4\n1.0\n6.946735 0.007998 0.000000\n-4.810136 5.011965 0.000000\n-0.000000 -0.000000 5.459264\nBa Na Fe As\n1 1 4 4\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Na\n0.500000 0.000000 0.751002 Fe\n-0.000001 0.500000 0.248998 Fe\n-0.000001 0.500000 0.751002 Fe\n0.500000 0.000000 0.248998 Fe\n0.351324 0.648676 -0.000000 As\n0.850905 0.149096 0.500000 As\n0.149095 0.850903 0.500000 As\n0.648676 0.351324 -0.000000 As\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Na",
"Fe",
"As"
],
"chemical_system": "As-Ba-Fe-Na",
"density": 5.9636328882222065,
"density_atomic": 0.05255300147951945,
"volume": 190.28408879552052,
"volume_molar": 11.459175671149636,
"formula_full": "Ba1 Na1 Fe4 As4",
"formula_reduced": "BaNa(FeAs)4",
"formula_anonymous": "ABC4D4",
"energy_above_hull": 2.598573397,
"spacegroup": 65
},
{
"id": "jvasp-99996",
"created_at": "2022-09-04T14:36:20.614429Z",
"updated_at": "2022-09-04T14:36:20.614451Z",
"structure_string": "Eu1 Co2 Si1 Ge1\n1.0\n3.682979 -0.040354 -4.383720\n-0.519503 3.646378 -4.383720\n0.035401 0.040354 5.725389\nEu Co Si Ge\n1 2 1 1\ndirect\n0.998564 0.998564 0.000002 Eu\n0.754664 0.254664 0.500001 Co\n0.254664 0.754664 0.500001 Co\n0.365914 0.365914 0.000001 Si\n0.626198 0.626198 0.000001 Ge\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Eu",
"Co",
"Si",
"Ge"
],
"chemical_system": "Co-Eu-Ge-Si",
"density": 7.88017966760547,
"density_atomic": 0.06403291982325497,
"volume": 78.0848353284702,
"volume_molar": 9.404757391389369,
"formula_full": "Eu1 Co2 Si1 Ge1",
"formula_reduced": "EuCo2SiGe",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.42030127,
"spacegroup": 107
},
{
"id": "jvasp-107816",
"created_at": "2022-09-04T14:36:34.953967Z",
"updated_at": "2022-09-04T14:36:34.953987Z",
"structure_string": "K2 Er1 Cu1 Cl6\n1.0\n6.232472 -0.000000 3.598320\n2.077491 5.876031 3.598320\n-0.000000 -0.000000 7.196639\nK Er Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Er\n0.500000 0.500000 0.500000 Cu\n0.745847 0.254153 0.254153 Cl\n0.254152 0.254153 0.745848 Cl\n0.254151 0.745847 0.745848 Cl\n0.254151 0.745847 0.254153 Cl\n0.745847 0.254153 0.745848 Cl\n0.745847 0.745847 0.254153 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Er",
"Cu",
"Cl"
],
"chemical_system": "Cl-Cu-Er-K",
"density": 3.2870939549529967,
"density_atomic": 0.037942493429253744,
"volume": 263.5567432763915,
"volume_molar": 15.87175806257613,
"formula_full": "K2 Er1 Cu1 Cl6",
"formula_reduced": "K2ErCuCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-99677",
"created_at": "2022-09-04T14:36:34.781424Z",
"updated_at": "2022-09-04T14:36:34.781450Z",
"structure_string": "K2 Tl1 Ga1 I6\n1.0\n7.366669 -0.000000 4.253148\n2.455556 6.945361 4.253148\n-0.000000 -0.000000 8.506296\nK Tl Ga I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Ga\n0.766742 0.233258 0.233259 I\n0.233259 0.233258 0.766742 I\n0.233259 0.766741 0.766742 I\n0.233259 0.766741 0.233259 I\n0.766742 0.233258 0.766742 I\n0.766742 0.766741 0.233259 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Tl",
"Ga",
"I"
],
"chemical_system": "Ga-I-K-Tl",
"density": 4.2493493281083925,
"density_atomic": 0.022977010796769958,
"volume": 435.2176220157311,
"volume_molar": 26.209417810112075,
"formula_full": "K2 Tl1 Ga1 I6",
"formula_reduced": "K2TlGaI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}