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=-formula_anonymous&page=323",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=321",
"results": [
{
"id": "jvasp-42352",
"created_at": "2022-09-04T14:36:54.725227Z",
"updated_at": "2022-09-04T14:36:54.725254Z",
"structure_string": "Hf4 Cr4 O16\n1.0\n4.668257 0.000000 0.000000\n-0.000000 4.877484 0.000000\n0.000000 0.000000 11.606935\nHf Cr O\n4 4 16\ndirect\n0.000000 0.749999 0.172388 Hf\n0.000000 0.250000 0.827612 Hf\n0.500000 0.749999 0.672388 Hf\n0.500000 0.250000 0.327612 Hf\n0.000000 0.749999 0.435093 Cr\n0.000000 0.250000 0.564908 Cr\n0.500000 0.250000 0.064908 Cr\n0.500000 0.749999 0.935093 Cr\n0.272013 0.428964 0.946627 O\n0.272013 0.928964 0.053374 O\n0.227987 0.928964 0.553374 O\n0.227987 0.428964 0.446626 O\n0.276467 0.911375 0.815288 O\n0.276467 0.411375 0.184713 O\n0.723534 0.588624 0.815288 O\n0.727988 0.071036 0.946627 O\n0.772013 0.571035 0.553374 O\n0.772013 0.071036 0.446626 O\n0.223533 0.411375 0.684713 O\n0.727988 0.571035 0.053374 O\n0.776467 0.088625 0.684713 O\n0.776467 0.588624 0.315287 O\n0.723534 0.088625 0.184713 O\n0.223533 0.911375 0.315287 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Hf",
"Cr",
"O"
],
"chemical_system": "Cr-Hf-O",
"density": 7.401200798773772,
"density_atomic": 0.09081196620113692,
"volume": 264.28235180860486,
"volume_molar": 6.631439679063579,
"formula_full": "Hf4 Cr4 O16",
"formula_reduced": "HfCrO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.201440733333334,
"spacegroup": 60
},
{
"id": "jvasp-103056",
"created_at": "2022-09-04T14:36:55.277906Z",
"updated_at": "2022-09-04T14:36:55.277931Z",
"structure_string": "Pr1 Y1 Al4\n1.0\n4.901320 0.000000 2.829779\n1.633774 4.621009 2.829779\n0.000000 0.000000 5.659557\nPr Y Al\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Pr\n0.000000 0.000000 0.000000 Y\n0.625155 0.625155 0.124535 Al\n0.625155 0.124535 0.625156 Al\n0.124534 0.625155 0.625156 Al\n0.625155 0.625155 0.625156 Al\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"Y",
"Al"
],
"chemical_system": "Al-Pr-Y",
"density": 4.375209381479724,
"density_atomic": 0.046807876568103916,
"volume": 128.1835545620233,
"volume_molar": 12.865656811494073,
"formula_full": "Pr1 Y1 Al4",
"formula_reduced": "PrYAl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0116410833333336,
"spacegroup": 216
},
{
"id": "jvasp-104788",
"created_at": "2022-09-04T14:36:48.670997Z",
"updated_at": "2022-09-04T14:36:48.671021Z",
"structure_string": "W1 O1 F4\n1.0\n4.885851 0.197268 -0.715064\n-3.631649 3.274382 -0.715064\n-0.071267 -0.197268 4.937386\nW O F\n1 1 4\ndirect\n0.000859 0.000859 0.000000 W\n0.559226 0.559226 0.000001 O\n0.351296 -0.009649 0.191237 F\n-0.009650 0.799113 0.639056 F\n0.160059 0.351296 0.360946 F\n0.799113 0.160059 0.808764 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"W",
"O",
"F"
],
"chemical_system": "F-O-W",
"density": 5.643012365439718,
"density_atomic": 0.0739208431403009,
"volume": 81.16790535806079,
"volume_molar": 8.146742521010005,
"formula_full": "W1 O1 F4",
"formula_reduced": "WOF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3610891050000005,
"spacegroup": 79
},
{
"id": "jvasp-101666",
"created_at": "2022-09-04T14:36:41.535195Z",
"updated_at": "2022-09-04T14:36:41.535215Z",
"structure_string": "Zr1 Sc1 Fe4\n1.0\n4.252368 -0.000000 2.455106\n1.417456 4.009171 2.455106\n-0.000000 -0.000000 4.910211\nZr Sc Fe\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Sc\n0.624854 0.624852 0.125444 Fe\n0.624853 0.125443 0.624853 Fe\n0.125444 0.624852 0.624853 Fe\n0.624854 0.624852 0.624853 Fe\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"Sc",
"Fe"
],
"chemical_system": "Fe-Sc-Zr",
"density": 7.1323851391200295,
"density_atomic": 0.07167466535116358,
"volume": 83.711587219885,
"volume_molar": 8.40204935801941,
"formula_full": "Zr1 Sc1 Fe4",
"formula_reduced": "ZrScFe4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.760736958333333,
"spacegroup": 216
},
{
"id": "jvasp-100779",
"created_at": "2022-09-04T14:36:41.545379Z",
"updated_at": "2022-09-04T14:36:41.545398Z",
"structure_string": "Ca1 Bi1 Au4\n1.0\n4.922492 -0.000000 2.842002\n1.640831 4.640970 2.842002\n-0.000000 -0.000000 5.684004\nCa Bi Au\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Bi\n0.624534 0.624534 0.624533 Au\n0.624534 0.624534 0.126399 Au\n0.624534 0.126399 0.624533 Au\n0.126399 0.624534 0.624533 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Bi",
"Au"
],
"chemical_system": "Au-Bi-Ca",
"density": 13.260141306372793,
"density_atomic": 0.04620650235469749,
"volume": 129.85185405166297,
"volume_molar": 13.033102384101515,
"formula_full": "Ca1 Bi1 Au4",
"formula_reduced": "CaBiAu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3682914408333333,
"spacegroup": 216
},
{
"id": "jvasp-11738",
"created_at": "2022-09-04T14:37:00.987383Z",
"updated_at": "2022-09-04T14:37:00.987409Z",
"structure_string": "Lu2 V2 O8\n1.0\n5.621677 -0.012110 -1.668669\n-3.133902 4.667125 -1.668669\n0.006472 0.012110 5.864099\nLu V O\n2 2 8\ndirect\n0.125001 0.875001 0.250000 Lu\n0.875000 0.125000 0.750000 Lu\n0.375001 0.625001 0.750000 V\n0.625001 0.375000 0.250000 V\n0.802477 0.740867 0.438391 O\n0.364086 0.802476 0.561610 O\n0.740867 0.802476 0.938391 O\n0.802476 0.364086 0.061610 O\n0.635915 0.197525 0.438391 O\n0.197525 0.259134 0.561610 O\n0.197525 0.635916 0.938391 O\n0.259134 0.197525 0.061610 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Lu",
"V",
"O"
],
"chemical_system": "Lu-O-V",
"density": 6.257573622263339,
"density_atomic": 0.07799212748339344,
"volume": 153.86168305967948,
"volume_molar": 7.7214726079658105,
"formula_full": "Lu2 V2 O8",
"formula_reduced": "LuVO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.294860658333333,
"spacegroup": 141
},
{
"id": "jvasp-102847",
"created_at": "2022-09-04T14:36:55.604609Z",
"updated_at": "2022-09-04T14:36:55.604644Z",
"structure_string": "Cr1 Ga1 O4\n1.0\n4.462657 0.001954 0.175105\n-4.463938 2.983392 -0.176051\n0.039626 0.001436 4.465149\nCr Ga O\n1 1 4\ndirect\n0.571816 0.067297 0.498181 Cr\n0.484907 0.480382 0.998172 Ga\n0.191913 0.978060 0.788650 O\n0.191046 0.496881 0.688036 O\n0.773233 0.978058 0.207708 O\n0.811708 0.496856 0.308332 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Cr",
"Ga",
"O"
],
"chemical_system": "Cr-Ga-O",
"density": 5.185934779299621,
"density_atomic": 0.10089699813936309,
"volume": 59.46658583154826,
"volume_molar": 5.968602506570089,
"formula_full": "Cr1 Ga1 O4",
"formula_reduced": "CrGaO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.2730439541666674,
"spacegroup": 35
},
{
"id": "jvasp-103676",
"created_at": "2022-09-04T14:36:45.084911Z",
"updated_at": "2022-09-04T14:36:45.084936Z",
"structure_string": "Tm1 Al1 Ni4\n1.0\n4.998292 -0.000000 0.000000\n-2.499146 4.328648 0.000000\n-0.000000 -0.000000 3.842188\nTm Al Ni\n1 1 4\ndirect\n0.333333 0.666667 -0.000000 Tm\n0.666666 0.333333 -0.000000 Al\n0.000000 0.000000 0.000000 Ni\n0.329926 0.164963 0.500000 Ni\n0.835037 0.164963 0.500000 Ni\n0.835036 0.670074 0.500000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tm",
"Al",
"Ni"
],
"chemical_system": "Al-Ni-Tm",
"density": 8.603213934315693,
"density_atomic": 0.07217698624843147,
"volume": 83.12899044230168,
"volume_molar": 8.34357469467059,
"formula_full": "Tm1 Al1 Ni4",
"formula_reduced": "TmAlNi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.2427811083333336,
"spacegroup": 187
},
{
"id": "jvasp-10096",
"created_at": "2022-09-04T14:37:00.904280Z",
"updated_at": "2022-09-04T14:37:00.904311Z",
"structure_string": "Rb2 Pr2 Te8\n1.0\n6.989514 0.000000 0.000000\n0.000000 6.989514 -0.000000\n0.000000 0.000000 9.100749\nRb Pr Te\n2 2 8\ndirect\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.500000 Pr\n0.356373 0.856373 0.288330 Te\n0.143626 0.356373 0.288330 Te\n0.856373 0.643626 0.288330 Te\n0.356373 0.143626 0.711670 Te\n0.643626 0.856373 0.711670 Te\n0.643626 0.143626 0.288330 Te\n0.856373 0.356373 0.711670 Te\n0.143626 0.643626 0.711670 Te\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Rb",
"Pr",
"Te"
],
"chemical_system": "Pr-Rb-Te",
"density": 5.5035528920824,
"density_atomic": 0.02699045160178359,
"volume": 444.6016753275448,
"volume_molar": 22.312115591285785,
"formula_full": "Rb2 Pr2 Te8",
"formula_reduced": "RbPrTe4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.646260152777778,
"spacegroup": 125
},
{
"id": "jvasp-50209",
"created_at": "2022-09-04T14:36:55.471516Z",
"updated_at": "2022-09-04T14:36:55.471538Z",
"structure_string": "Zn1 Re1 O4\n1.0\n3.252801 3.354378 0.000000\n-3.252801 3.354378 0.000000\n0.000000 0.000000 3.095678\nZn Re O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Re\n0.215450 0.784551 0.500000 O\n0.311389 0.311389 0.000000 O\n0.688611 0.688611 0.000000 O\n0.784551 0.215450 0.500000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zn",
"Re",
"O"
],
"chemical_system": "O-Re-Zn",
"density": 7.757995692625139,
"density_atomic": 0.08881697510995908,
"volume": 67.55465374239274,
"volume_molar": 6.780393897162499,
"formula_full": "Zn1 Re1 O4",
"formula_reduced": "ZnReO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.5106954000000004,
"spacegroup": 65
},
{
"id": "jvasp-9393",
"created_at": "2022-09-04T14:36:49.733638Z",
"updated_at": "2022-09-04T14:36:49.733657Z",
"structure_string": "Tb2 As2 O8\n1.0\n5.720125 0.011798 -1.704087\n-3.176462 4.757107 -1.704087\n-0.006293 -0.011798 5.968559\nTb As O\n2 2 8\ndirect\n0.375001 0.625000 0.750000 Tb\n0.625001 0.375000 0.250000 Tb\n0.875001 0.125000 0.750000 As\n0.125001 0.875001 0.250000 As\n0.300960 0.232943 0.431984 O\n0.868977 0.300959 0.568016 O\n0.232943 0.300959 0.931984 O\n0.300960 0.868976 0.068016 O\n0.131025 0.699041 0.431984 O\n0.699042 0.767058 0.568016 O\n0.699042 0.131025 0.931984 O\n0.767059 0.699042 0.068016 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tb",
"As",
"O"
],
"chemical_system": "As-O-Tb",
"density": 6.090697988371007,
"density_atomic": 0.07388896112141963,
"volume": 162.40585627236985,
"volume_molar": 8.150257722671167,
"formula_full": "Tb2 As2 O8",
"formula_reduced": "TbAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.054510691666667,
"spacegroup": 141
},
{
"id": "jvasp-104791",
"created_at": "2022-09-04T14:36:48.748807Z",
"updated_at": "2022-09-04T14:36:48.748823Z",
"structure_string": "Ti1 Cr1 O4\n1.0\n3.488568 -0.029283 -4.209648\n-0.475764 3.456098 -4.209648\n0.025745 0.029283 5.467228\nTi Cr O\n1 1 4\ndirect\n0.750000 0.250000 0.500000 Ti\n0.000000 0.000000 0.000000 Cr\n0.962357 0.462357 0.500000 O\n0.797395 0.797394 0.000001 O\n0.537643 0.037643 0.500000 O\n0.202607 0.202607 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ti",
"Cr",
"O"
],
"chemical_system": "Cr-O-Ti",
"density": 4.078945193454219,
"density_atomic": 0.08994462534016585,
"volume": 66.70771018622085,
"volume_molar": 6.695387008645129,
"formula_full": "Ti1 Cr1 O4",
"formula_reduced": "TiCrO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.9428549555555565,
"spacegroup": 119
}
]
}