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=spacegroup&page=335",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=333",
"results": [
{
"id": "jvasp-43113",
"created_at": "2022-09-04T14:36:33.073644Z",
"updated_at": "2022-09-04T14:36:33.073665Z",
"structure_string": "Li2 Ni1 Sn1 O4\n1.0\n0.000000 5.169960 -0.003298\n3.097838 0.000000 0.000000\n0.000000 -1.690465 -4.958112\nLi Ni Sn O\n2 1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n-0.000001 0.500000 0.500000 Li\n0.500000 0.500000 0.000000 Ni\n0.500000 0.000000 0.500000 Sn\n0.730833 0.000000 0.245311 O\n0.740709 0.500000 0.739714 O\n0.269166 0.000000 0.754689 O\n0.259290 0.500000 0.260286 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Li",
"Ni",
"Sn",
"O"
],
"chemical_system": "Li-Ni-O-Sn",
"density": 5.33721043170182,
"density_atomic": 0.10072408267391443,
"volume": 79.42489807427002,
"volume_molar": 5.978848950648837,
"formula_full": "Li2 Ni1 Sn1 O4",
"formula_reduced": "Li2NiSnO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.6057785125,
"spacegroup": 10
},
{
"id": "jvasp-99628",
"created_at": "2022-09-04T14:36:33.453350Z",
"updated_at": "2022-09-04T14:36:33.453374Z",
"structure_string": "Fe1 Co1 O4\n1.0\n2.381225 -0.000000 4.012396\n-0.070747 2.825084 8.873369\n-0.070748 0.000000 8.873369\nFe Co O\n1 1 4\ndirect\n0.500001 0.000000 0.500000 Fe\n0.500000 0.499999 0.500001 Co\n0.238647 0.499999 0.239115 O\n0.761353 0.499999 0.760888 O\n0.230308 0.000000 0.240998 O\n0.769693 0.000000 0.759002 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Fe",
"Co",
"O"
],
"chemical_system": "Co-Fe-O",
"density": 4.907289625959071,
"density_atomic": 0.09918251703311164,
"volume": 60.494532499078716,
"volume_molar": 6.07177649866411,
"formula_full": "Fe1 Co1 O4",
"formula_reduced": "FeCoO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.8331584000000003,
"spacegroup": 10
},
{
"id": "jvasp-100366",
"created_at": "2022-09-04T14:36:33.615464Z",
"updated_at": "2022-09-04T14:36:33.615490Z",
"structure_string": "Na1 Y1 Zr1 S4\n1.0\n3.849916 0.000000 0.000000\n0.000000 6.275926 2.003164\n0.000000 0.038019 6.901029\nNa Y Zr S\n1 1 1 4\ndirect\n0.000000 0.500000 0.500000 Na\n0.500001 0.500000 -0.000000 Y\n0.000000 0.000000 0.000000 Zr\n0.500001 0.776216 0.224873 S\n0.000000 0.243469 0.223853 S\n0.500001 0.223785 0.775127 S\n0.000000 0.756532 0.776146 S\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Na",
"Y",
"Zr",
"S"
],
"chemical_system": "Na-S-Y-Zr",
"density": 3.3059503059858732,
"density_atomic": 0.04205517737283961,
"volume": 166.4479961157123,
"volume_molar": 14.31961802612504,
"formula_full": "Na1 Y1 Zr1 S4",
"formula_reduced": "NaYZrS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.0351384214285715,
"spacegroup": 10
},
{
"id": "jvasp-100936",
"created_at": "2022-09-04T14:36:33.733503Z",
"updated_at": "2022-09-04T14:36:33.733530Z",
"structure_string": "Li2 V1 Fe1 O4\n1.0\n2.882582 0.000000 0.000000\n-0.000000 4.852940 1.632771\n-0.000000 -0.015141 4.768061\nLi V Fe O\n2 1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.500000 0.500000 -0.000000 V\n0.000000 0.500000 0.500000 Fe\n0.000000 0.262962 0.242939 O\n0.500000 0.270685 0.735915 O\n0.000000 0.737038 0.757061 O\n0.500000 0.729316 0.264085 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Li",
"V",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O-V",
"density": 4.592446735160607,
"density_atomic": 0.11981131645276338,
"volume": 66.7716559408148,
"volume_molar": 5.026353885673462,
"formula_full": "Li2 V1 Fe1 O4",
"formula_reduced": "Li2VFeO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.4722904625,
"spacegroup": 10
},
{
"id": "jvasp-99401",
"created_at": "2022-09-04T14:36:33.908166Z",
"updated_at": "2022-09-04T14:36:33.908202Z",
"structure_string": "Nb2 Rh4\n1.0\n2.806098 -0.000000 0.000000\n-0.000000 4.727716 1.012815\n-0.000000 -0.006528 6.927384\nNb Rh\n2 4\ndirect\n0.000000 0.234201 0.326901 Nb\n0.000000 0.765799 0.673099 Nb\n0.500000 0.731364 0.333990 Rh\n0.500000 0.268636 0.666010 Rh\n0.500000 0.500000 0.000000 Rh\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"Rh"
],
"chemical_system": "Nb-Rh",
"density": 10.792658674161137,
"density_atomic": 0.0652739821160331,
"volume": 91.92023843947824,
"volume_molar": 9.225943576255013,
"formula_full": "Nb2 Rh4",
"formula_reduced": "NbRh2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.2218618,
"spacegroup": 10
},
{
"id": "jvasp-106368",
"created_at": "2022-09-04T14:36:34.965169Z",
"updated_at": "2022-09-04T14:36:34.965193Z",
"structure_string": "Cr1 Fe1 As4\n1.0\n2.934723 0.000000 0.000000\n0.000000 5.434228 0.005684\n0.000000 0.000731 6.175918\nCr Fe As\n1 1 4\ndirect\n0.499999 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Fe\n0.499999 0.316328 0.871478 As\n0.499999 0.683672 0.128522 As\n0.000000 0.831736 0.643209 As\n0.000000 0.168264 0.356791 As\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Cr",
"Fe",
"As"
],
"chemical_system": "As-Cr-Fe",
"density": 6.870677738134075,
"density_atomic": 0.060917884270299136,
"volume": 98.49324335325504,
"volume_molar": 9.885669589703937,
"formula_full": "Cr1 Fe1 As4",
"formula_reduced": "CrFeAs4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.2092116500000003,
"spacegroup": 10
},
{
"id": "jvasp-103121",
"created_at": "2022-09-04T14:36:37.104462Z",
"updated_at": "2022-09-04T14:36:37.104479Z",
"structure_string": "Ca1 Ti2 S4\n1.0\n3.558732 0.000000 0.000000\n0.000000 5.714987 1.761520\n0.000000 0.017555 6.854372\nCa Ti S\n1 2 4\ndirect\n0.000000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 -0.000000 Ti\n0.500000 0.765507 0.221016 S\n0.000000 0.257297 0.216861 S\n0.500000 0.234493 0.778983 S\n0.000000 0.742703 0.783139 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ca",
"Ti",
"S"
],
"chemical_system": "Ca-S-Ti",
"density": 3.1480108832647256,
"density_atomic": 0.050253094844241154,
"volume": 139.29490356158985,
"volume_molar": 11.98362166283599,
"formula_full": "Ca1 Ti2 S4",
"formula_reduced": "Ca(TiS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.165498155238096,
"spacegroup": 10
},
{
"id": "jvasp-100851",
"created_at": "2022-09-04T14:36:38.557018Z",
"updated_at": "2022-09-04T14:36:38.557036Z",
"structure_string": "Ca1 Y2 Te4\n1.0\n4.389365 0.000000 0.000000\n-0.000000 7.145102 2.308831\n0.000000 0.028376 7.663392\nCa Y Te\n1 2 4\ndirect\n0.000000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Y\n0.499999 0.500000 -0.000000 Y\n0.499999 0.759855 0.247979 Te\n0.000000 0.252144 0.241617 Te\n0.499999 0.240145 0.752020 Te\n0.000000 0.747856 0.758383 Te\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ca",
"Y",
"Te"
],
"chemical_system": "Ca-Te-Y",
"density": 5.037812975235473,
"density_atomic": 0.029159952706916906,
"volume": 240.05525901760328,
"volume_molar": 20.652093714032375,
"formula_full": "Ca1 Y2 Te4",
"formula_reduced": "Ca(YTe2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2492174838095238,
"spacegroup": 10
},
{
"id": "jvasp-101731",
"created_at": "2022-09-04T14:36:40.445029Z",
"updated_at": "2022-09-04T14:36:40.445049Z",
"structure_string": "Cr1 Fe1 Sb4\n1.0\n3.271176 -0.000000 0.000000\n0.000000 5.926727 0.008554\n0.000000 0.002393 6.710478\nCr Fe Sb\n1 1 4\ndirect\n0.500001 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Fe\n0.500001 0.301244 0.865715 Sb\n0.500001 0.698756 0.134284 Sb\n-0.000000 0.819305 0.651096 Sb\n-0.000000 0.180695 0.348904 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Cr",
"Fe",
"Sb"
],
"chemical_system": "Cr-Fe-Sb",
"density": 7.592891623108647,
"density_atomic": 0.04611892576071441,
"volume": 130.09843358300841,
"volume_molar": 13.057851328206462,
"formula_full": "Cr1 Fe1 Sb4",
"formula_reduced": "CrFeSb4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.720646216666668,
"spacegroup": 10
},
{
"id": "jvasp-101153",
"created_at": "2022-09-04T14:36:41.702581Z",
"updated_at": "2022-09-04T14:36:41.702598Z",
"structure_string": "Mn1 Cu1 Ag2 O4\n1.0\n2.907658 0.000000 0.000000\n-0.000000 5.197120 1.576250\n-0.000000 0.157408 6.465660\nMn Cu Ag O\n1 1 2 4\ndirect\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 -0.000000 Ag\n0.500000 0.369881 0.351584 O\n0.000000 0.946885 0.327773 O\n0.500000 0.630120 0.648416 O\n0.000000 0.053115 0.672226 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Mn",
"Cu",
"Ag",
"O"
],
"chemical_system": "Ag-Cu-Mn-O",
"density": 6.818199685215353,
"density_atomic": 0.08248779032269933,
"volume": 96.98405022977718,
"volume_molar": 7.300645024482856,
"formula_full": "Mn1 Cu1 Ag2 O4",
"formula_reduced": "MnCu(AgO2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.7580670264224136,
"spacegroup": 10
},
{
"id": "jvasp-101080",
"created_at": "2022-09-04T14:36:44.190761Z",
"updated_at": "2022-09-04T14:36:44.190780Z",
"structure_string": "Yb1 Tm2 Se4\n1.0\n4.065590 0.000000 0.000000\n-0.000000 6.597651 2.145510\n-0.000000 0.015703 7.096664\nYb Tm Se\n1 2 4\ndirect\n0.000000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.000000 Tm\n0.500000 0.758567 0.243701 Se\n0.000000 0.256245 0.235141 Se\n0.500000 0.241432 0.756298 Se\n0.000000 0.743755 0.764858 Se\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Yb",
"Tm",
"Se"
],
"chemical_system": "Se-Tm-Yb",
"density": 7.217186443058595,
"density_atomic": 0.036799633516563256,
"volume": 190.21928565808543,
"volume_molar": 16.36467590713771,
"formula_full": "Yb1 Tm2 Se4",
"formula_reduced": "Yb(TmSe2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.9310675238095238,
"spacegroup": 10
},
{
"id": "jvasp-104774",
"created_at": "2022-09-04T14:36:44.294304Z",
"updated_at": "2022-09-04T14:36:44.294336Z",
"structure_string": "Na1 Cr2 S4\n1.0\n3.454905 -0.000000 0.000000\n0.000000 5.884547 -0.015320\n-0.000000 -0.028682 6.734844\nNa Cr S\n1 2 4\ndirect\n-0.000000 0.000000 0.500000 Na\n0.499999 0.500000 -0.000000 Cr\n0.000000 0.000000 0.000000 Cr\n-0.000000 0.338093 0.197792 S\n0.499999 0.835594 0.198364 S\n0.499999 0.164407 0.801636 S\n-0.000000 0.661908 0.802208 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Na",
"Cr",
"S"
],
"chemical_system": "Cr-Na-S",
"density": 3.0954893407125725,
"density_atomic": 0.05112415804075778,
"volume": 136.92157031553225,
"volume_molar": 11.779442421719612,
"formula_full": "Na1 Cr2 S4",
"formula_reduced": "Na(CrS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.555934828571429,
"spacegroup": 10
}
]
}