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=855",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=853",
"results": [
{
"id": "jvasp-95072",
"created_at": "2022-09-04T14:35:58.848811Z",
"updated_at": "2022-09-04T14:35:58.848848Z",
"structure_string": "Zr4 Rh2\n1.0\n5.195146 -0.004394 -1.461857\n-2.981605 4.254452 -1.461768\n0.002229 0.004394 5.396904\nZr Rh\n4 2\ndirect\n0.163183 0.336817 0.499999 Zr\n0.836817 0.663182 0.499999 Zr\n0.336818 0.836818 0.173634 Zr\n0.663182 0.163182 0.826364 Zr\n0.249999 0.249999 0.999998 Rh\n0.750001 0.750000 0.000000 Rh\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Rh"
],
"chemical_system": "Rh-Zr",
"density": 7.944963442613825,
"density_atomic": 0.05030149081859071,
"volume": 119.28075892697967,
"volume_molar": 11.972092003631635,
"formula_full": "Zr4 Rh2",
"formula_reduced": "Zr2Rh",
"formula_anonymous": "AB2",
"energy_above_hull": 3.212440666666668,
"spacegroup": 140
},
{
"id": "jvasp-91701",
"created_at": "2022-09-04T14:35:52.919132Z",
"updated_at": "2022-09-04T14:35:52.919166Z",
"structure_string": "Fe2 Ni6\n1.0\n0.000000 4.057845 0.000000\n0.000000 0.000000 4.346520\n5.013126 0.000000 0.000000\nFe Ni\n2 6\ndirect\n0.499999 0.333776 0.500000 Fe\n0.000000 0.666224 0.000000 Fe\n0.000000 0.669245 0.500000 Ni\n0.499999 0.330755 0.000000 Ni\n0.499999 0.832595 0.748708 Ni\n0.000000 0.167405 0.248708 Ni\n0.000000 0.167405 0.751293 Ni\n0.499999 0.832595 0.251292 Ni\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Fe",
"Ni"
],
"chemical_system": "Fe-Ni",
"density": 8.711266021573985,
"density_atomic": 0.09047825798637311,
"volume": 88.41903213040283,
"volume_molar": 6.655898216903106,
"formula_full": "Fe2 Ni6",
"formula_reduced": "FeNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.6169231750000002,
"spacegroup": 59
},
{
"id": "jvasp-97988",
"created_at": "2022-09-04T14:35:47.939314Z",
"updated_at": "2022-09-04T14:35:47.939345Z",
"structure_string": "Ho1 Mn12\n1.0\n4.238880 0.000000 1.660254\n2.119440 5.825524 0.830127\n-0.005110 0.000000 6.254426\nHo Mn\n1 12\ndirect\n0.000000 0.000000 0.000000 Ho\n0.725820 0.774179 0.774180 Mn\n0.500000 -0.000000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.500000 0.500000 -0.000000 Mn\n0.000000 -0.000000 0.500000 Mn\n0.364431 0.635569 0.635569 Mn\n0.000000 0.364431 0.635570 Mn\n0.000000 0.635569 0.364432 Mn\n0.635569 0.364431 0.364431 Mn\n0.274180 0.225820 0.225820 Mn\n0.500000 0.774179 0.225820 Mn\n0.500000 0.225820 0.774180 Mn\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Ho",
"Mn"
],
"chemical_system": "Ho-Mn",
"density": 8.8585420927109,
"density_atomic": 0.08414548571893447,
"volume": 154.49432478675124,
"volume_molar": 7.156819772976715,
"formula_full": "Ho1 Mn12",
"formula_reduced": "HoMn12",
"formula_anonymous": "AB12",
"energy_above_hull": 4.936453266401415,
"spacegroup": 139
},
{
"id": "jvasp-17252",
"created_at": "2022-09-04T14:35:58.928791Z",
"updated_at": "2022-09-04T14:35:58.928813Z",
"structure_string": "Cr1 O2\n1.0\n2.688089 -0.054753 3.914892\n1.174348 2.418621 3.914892\n-0.089463 -0.054753 4.748073\nCr O\n1 2\ndirect\n0.500003 0.500000 0.499998 Cr\n0.762509 0.762507 0.762503 O\n0.237495 0.237492 0.237492 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 4.309430399328086,
"density_atomic": 0.09269132936337278,
"volume": 32.365486832530614,
"volume_molar": 6.496983915714198,
"formula_full": "Cr1 O2",
"formula_reduced": "CrO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.211658133333333,
"spacegroup": 166
},
{
"id": "jvasp-93376",
"created_at": "2022-09-04T14:35:58.369961Z",
"updated_at": "2022-09-04T14:35:58.369989Z",
"structure_string": "Co2 Te4\n1.0\n0.000000 0.000000 3.918515\n5.376184 0.000000 0.000000\n0.000000 6.325569 0.000000\nCo Te\n2 4\ndirect\n0.506667 0.500000 0.500000 Co\n0.006668 0.000000 0.000000 Co\n0.506666 0.728102 0.138950 Te\n0.506666 0.271898 0.861050 Te\n0.006667 0.771897 0.638950 Te\n0.006667 0.228102 0.361050 Te\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Co",
"Te"
],
"chemical_system": "Co-Te",
"density": 7.828844906696965,
"density_atomic": 0.04502523781286245,
"volume": 133.25859654395802,
"volume_molar": 13.375033764462746,
"formula_full": "Co2 Te4",
"formula_reduced": "CoTe2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4551554777777778,
"spacegroup": 58
},
{
"id": "jvasp-96848",
"created_at": "2022-09-04T14:35:52.958687Z",
"updated_at": "2022-09-04T14:35:52.958716Z",
"structure_string": "Ti24 Se12\n1.0\n3.459233 0.000000 0.000000\n0.000000 11.757221 0.000000\n0.000000 -0.000000 14.517035\nTi Se\n24 12\ndirect\n0.500000 0.357168 0.521037 Ti\n0.500000 0.685569 0.704603 Ti\n0.000000 0.907124 0.738714 Ti\n0.500000 0.407124 0.761287 Ti\n0.500000 0.314431 0.295397 Ti\n0.000000 0.142832 0.021036 Ti\n0.000000 0.112802 0.573660 Ti\n0.500000 0.592875 0.238713 Ti\n0.000000 0.414033 0.924625 Ti\n0.500000 0.028468 0.892199 Ti\n0.000000 0.528468 0.607801 Ti\n0.000000 0.857168 0.978964 Ti\n0.000000 0.585967 0.075375 Ti\n0.000000 0.814431 0.204603 Ti\n0.000000 0.092876 0.261287 Ti\n0.000000 0.185569 0.795397 Ti\n0.500000 0.387198 0.073660 Ti\n0.000000 0.471532 0.392199 Ti\n0.500000 0.642832 0.478964 Ti\n0.500000 0.612802 0.926340 Ti\n0.500000 0.971531 0.107801 Ti\n0.500000 0.914033 0.575375 Ti\n0.000000 0.887198 0.426340 Ti\n0.500000 0.085967 0.424625 Ti\n0.500000 0.811891 0.849470 Se\n0.500000 0.065824 0.705871 Se\n0.000000 0.245425 0.414180 Se\n0.000000 0.434176 0.205871 Se\n0.000000 0.688109 0.349470 Se\n0.000000 0.311891 0.650531 Se\n0.500000 0.934176 0.294129 Se\n0.000000 0.565824 0.794129 Se\n0.500000 0.188109 0.150530 Se\n0.000000 0.754575 0.585820 Se\n0.500000 0.745425 0.085820 Se\n0.500000 0.254575 0.914180 Se\n",
"nsites": 36,
"nelements": 2,
"elements": [
"Ti",
"Se"
],
"chemical_system": "Se-Ti",
"density": 5.895843019728197,
"density_atomic": 0.06097335325071835,
"volume": 590.4218495573043,
"volume_molar": 9.876676349482306,
"formula_full": "Ti24 Se12",
"formula_reduced": "Ti2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 2.398750011111112,
"spacegroup": 58
},
{
"id": "jvasp-14759",
"created_at": "2022-09-04T14:35:57.613515Z",
"updated_at": "2022-09-04T14:35:57.613535Z",
"structure_string": "Cr2 S2\n1.0\n1.734868 -3.004880 0.000000\n1.734868 3.004880 -0.000000\n0.000000 -0.000000 5.703788\nCr S\n2 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.333333 0.666668 0.750000 S\n0.666668 0.333333 0.250000 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"S"
],
"chemical_system": "Cr-S",
"density": 4.694477063454079,
"density_atomic": 0.06726250710609713,
"volume": 59.46849399607665,
"volume_molar": 8.953191040739712,
"formula_full": "Cr2 S2",
"formula_reduced": "CrS",
"formula_anonymous": "AB",
"energy_above_hull": 1.9648387000000005,
"spacegroup": 194
},
{
"id": "jvasp-86079",
"created_at": "2022-09-04T14:35:57.614198Z",
"updated_at": "2022-09-04T14:35:57.614214Z",
"structure_string": "K4 Ga6\n1.0\n5.749257 -0.000000 -2.200643\n-0.842340 5.687215 -2.200643\n-0.049207 -0.057032 8.481834\nK Ga\n4 6\ndirect\n0.390426 0.390426 0.780853 K\n0.250000 0.750000 0.500000 K\n0.609574 0.609573 0.219147 K\n0.750000 0.250000 0.500000 K\n-0.000000 0.294802 0.000000 Ga\n0.143250 0.143250 0.286498 Ga\n0.294802 0.000000 0.000000 Ga\n-0.000000 0.705197 0.000000 Ga\n0.856750 0.856750 0.713501 Ga\n0.705198 0.000000 0.000000 Ga\n",
"nsites": 10,
"nelements": 2,
"elements": [
"K",
"Ga"
],
"chemical_system": "Ga-K",
"density": 3.459222940410841,
"density_atomic": 0.036246383482529315,
"volume": 275.88959336646593,
"volume_molar": 16.614459654720203,
"formula_full": "K4 Ga6",
"formula_reduced": "K2Ga3",
"formula_anonymous": "A2B3",
"energy_above_hull": 4.163336342344337e-17,
"spacegroup": 139
},
{
"id": "jvasp-86360",
"created_at": "2022-09-04T14:35:52.964696Z",
"updated_at": "2022-09-04T14:35:52.964725Z",
"structure_string": "La1 Pt5\n1.0\n0.000000 0.000000 -4.436165\n-2.728097 -4.725203 0.000000\n-2.728071 4.725187 0.000000\nLa Pt\n1 5\ndirect\n0.000000 -0.000018 -0.000000 La\n0.000000 0.333311 0.666681 Pt\n0.000000 0.666631 0.333320 Pt\n0.499999 0.499994 0.000000 Pt\n0.499999 0.499994 0.500007 Pt\n0.499999 -0.000013 0.499993 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"La",
"Pt"
],
"chemical_system": "La-Pt",
"density": 16.178788355540917,
"density_atomic": 0.052460942584568064,
"volume": 114.37080053084983,
"volume_molar": 11.479284327177673,
"formula_full": "La1 Pt5",
"formula_reduced": "LaPt5",
"formula_anonymous": "AB5",
"energy_above_hull": 2.644438666666667,
"spacegroup": 191
},
{
"id": "jvasp-94300",
"created_at": "2022-09-04T14:35:58.247409Z",
"updated_at": "2022-09-04T14:35:58.247437Z",
"structure_string": "Th4 Ag2\n1.0\n0.000000 0.000000 -5.868323\n-3.807603 3.807603 -2.934162\n3.807603 3.807603 -2.934162\nTh Ag\n4 2\ndirect\n0.343921 0.500000 0.812157 Th\n0.656078 0.500000 0.187843 Th\n0.843921 0.812157 0.500000 Th\n0.156079 0.187843 0.500000 Th\n0.750000 0.000000 0.000000 Ag\n0.250000 0.000000 0.000000 Ag\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Th",
"Ag"
],
"chemical_system": "Ag-Th",
"density": 11.163118070117656,
"density_atomic": 0.03526175504041017,
"volume": 170.15602295245844,
"volume_molar": 17.07839202302493,
"formula_full": "Th4 Ag2",
"formula_reduced": "Th2Ag",
"formula_anonymous": "AB2",
"energy_above_hull": 1.886749486666667,
"spacegroup": 140
},
{
"id": "jvasp-92166",
"created_at": "2022-09-04T14:36:04.448568Z",
"updated_at": "2022-09-04T14:36:04.448591Z",
"structure_string": "Mn4 Si4\n1.0\n4.535093 0.000000 -0.000000\n-0.000000 4.535093 0.000000\n0.000000 -0.000000 4.535093\nMn Si\n4 4\ndirect\n0.364208 0.864207 0.635792 Mn\n0.864207 0.635792 0.364208 Mn\n0.635792 0.364208 0.864207 Mn\n0.135792 0.135792 0.135792 Mn\n0.655404 0.155405 0.344595 Si\n0.155405 0.344595 0.655404 Si\n0.344595 0.655404 0.155405 Si\n0.844595 0.844595 0.844595 Si\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Si"
],
"chemical_system": "Mn-Si",
"density": 5.912236110717026,
"density_atomic": 0.08576920698193981,
"volume": 93.27356846944544,
"volume_molar": 7.021331981381227,
"formula_full": "Mn4 Si4",
"formula_reduced": "MnSi",
"formula_anonymous": "AB",
"energy_above_hull": 2.286502920689655,
"spacegroup": 198
},
{
"id": "jvasp-86810",
"created_at": "2022-09-04T14:35:49.300074Z",
"updated_at": "2022-09-04T14:35:49.300106Z",
"structure_string": "Rb6 Bi2\n1.0\n6.432406 -0.000000 -0.000000\n-3.216203 5.570628 -0.000000\n-0.000000 -0.000000 11.370204\nRb Bi\n6 2\ndirect\n0.333334 0.666667 0.917981 Rb\n0.666668 0.333333 0.417981 Rb\n0.000000 0.000000 0.250000 Rb\n0.666668 0.333333 0.082019 Rb\n0.000000 0.000000 0.750000 Rb\n0.333334 0.666667 0.582019 Rb\n0.666668 0.333333 0.750000 Bi\n0.333334 0.666667 0.250000 Bi\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Rb",
"Bi"
],
"chemical_system": "Bi-Rb",
"density": 3.793538462705742,
"density_atomic": 0.019635597636860427,
"volume": 407.42330067826424,
"volume_molar": 30.66950581985388,
"formula_full": "Rb6 Bi2",
"formula_reduced": "Rb3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0003374999999999,
"spacegroup": 194
}
]
}