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=4206",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=4204",
"results": [
{
"id": "jvasp-57752",
"created_at": "2022-09-04T14:38:31.288178Z",
"updated_at": "2022-09-04T14:38:31.288195Z",
"structure_string": "U2 Si2 O8\n1.0\n5.620738 0.024558 -1.691996\n-3.099537 4.688941 -1.691996\n-0.013136 -0.024558 5.869870\nU Si O\n2 2 8\ndirect\n0.625000 0.375000 0.249999 U\n0.374999 0.625000 0.749999 U\n0.124999 0.875000 0.249999 Si\n0.875000 0.125000 0.749999 Si\n0.138349 0.707563 0.430786 O\n0.707563 0.776776 0.569212 O\n0.707563 0.138350 0.930786 O\n0.776776 0.707563 0.069212 O\n0.292436 0.861650 0.069212 O\n0.223223 0.292436 0.930786 O\n0.861650 0.292437 0.569212 O\n0.292436 0.223224 0.430786 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"U",
"Si",
"O"
],
"chemical_system": "O-Si-U",
"density": 7.087576484277997,
"density_atomic": 0.07757800132810341,
"volume": 154.68302604559213,
"volume_molar": 7.7626913002441835,
"formula_full": "U2 Si2 O8",
"formula_reduced": "USiO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.934206433333334,
"spacegroup": 141
},
{
"id": "jvasp-51629",
"created_at": "2022-09-04T14:38:35.880713Z",
"updated_at": "2022-09-04T14:38:35.880739Z",
"structure_string": "Pb2 W2 O8\n1.0\n5.498980 0.311715 -0.002824\n-0.313331 5.501595 -0.003277\n-2.590023 -2.903158 6.047133\nPb W O\n2 2 8\ndirect\n0.625893 0.375447 0.248589 Pb\n0.375916 0.625463 0.748631 Pb\n0.125936 0.875490 0.248680 W\n0.875858 0.125421 0.748541 W\n0.810205 0.648853 0.082866 O\n0.649282 0.275374 0.582864 O\n0.352568 0.725628 0.414408 O\n0.275835 0.936270 0.082855 O\n0.065031 0.191115 0.414365 O\n0.191604 0.352024 0.914373 O\n0.725953 0.064589 0.914347 O\n-0.063231 0.809837 0.582801 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Pb",
"W",
"O"
],
"chemical_system": "O-Pb-W",
"density": 8.238063903461928,
"density_atomic": 0.06541540360664773,
"volume": 183.44303234996048,
"volume_molar": 9.205998018772462,
"formula_full": "Pb2 W2 O8",
"formula_reduced": "PbWO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.943284136666667,
"spacegroup": 88
},
{
"id": "jvasp-57141",
"created_at": "2022-09-04T14:38:34.086751Z",
"updated_at": "2022-09-04T14:38:34.086780Z",
"structure_string": "Nb2 Co2 O8\n1.0\n3.828254 -0.000010 -0.000062\n-1.914113 5.831387 -1.879021\n-0.000105 0.002904 6.528818\nNb Co O\n2 2 8\ndirect\n0.104445 0.208868 0.237895 Nb\n0.895553 0.791131 0.762105 Nb\n0.796512 0.593020 0.172538 Co\n0.203486 0.406980 0.827463 Co\n0.941936 0.883856 0.135350 O\n0.058063 0.116144 0.864650 O\n0.737450 0.474906 0.863880 O\n0.142782 0.285541 0.530376 O\n0.643636 0.287262 0.199534 O\n0.857216 0.714459 0.469625 O\n0.262549 0.525094 0.136121 O\n0.356362 0.712738 0.800467 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nb",
"Co",
"O"
],
"chemical_system": "Co-Nb-O",
"density": 4.917408644230451,
"density_atomic": 0.08232129717291825,
"volume": 145.77029774924046,
"volume_molar": 7.315410430608644,
"formula_full": "Nb2 Co2 O8",
"formula_reduced": "NbCoO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.067812383333333,
"spacegroup": 12
},
{
"id": "jvasp-16823",
"created_at": "2022-09-04T14:38:31.054461Z",
"updated_at": "2022-09-04T14:38:31.054494Z",
"structure_string": "Cr1 Te4 Au1\n1.0\n0.000000 5.526271 0.013452\n4.063533 0.000000 0.000000\n0.000000 -0.061856 -7.444497\nCr Te Au\n1 4 1\ndirect\n-0.000000 0.500000 0.500000 Cr\n0.230450 0.500000 0.826607 Te\n0.292674 0.000000 0.377280 Te\n0.769549 0.500000 0.173394 Te\n0.707326 0.000000 0.622721 Te\n0.000000 0.000000 0.000000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Cr",
"Te",
"Au"
],
"chemical_system": "Au-Cr-Te",
"density": 7.5428556385311545,
"density_atomic": 0.03589126007190531,
"volume": 167.1716174907059,
"volume_molar": 16.77885019343182,
"formula_full": "Cr1 Te4 Au1",
"formula_reduced": "CrTe4Au",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.619749339444445,
"spacegroup": 10
},
{
"id": "jvasp-112496",
"created_at": "2022-09-04T14:38:41.851664Z",
"updated_at": "2022-09-04T14:38:41.851698Z",
"structure_string": "Na4 Ti4 F16\n1.0\n5.374751 -0.000000 0.000000\n0.000000 7.519429 1.437541\n-0.000000 -0.054230 7.886615\nNa Ti F\n4 4 16\ndirect\n0.221830 0.378578 0.855002 Na\n0.721830 0.121422 0.144998 Na\n0.778170 0.621422 0.144997 Na\n0.278170 0.878579 0.855002 Na\n0.740015 0.195709 0.673231 Ti\n0.240015 0.304291 0.326768 Ti\n0.259985 0.804291 0.326768 Ti\n0.759985 0.695710 0.673231 Ti\n0.925698 0.207069 0.451367 F\n0.425698 0.292931 0.548632 F\n0.635690 0.944331 0.672809 F\n0.135690 0.555669 0.327190 F\n0.364310 0.055669 0.327190 F\n0.864310 0.444331 0.672809 F\n0.548943 0.186523 0.882642 F\n0.032597 0.115459 0.803443 F\n0.451057 0.813478 0.117357 F\n0.951057 0.686523 0.882642 F\n0.574301 0.707069 0.451367 F\n0.532597 0.384541 0.196556 F\n0.967403 0.884541 0.196556 F\n0.467403 0.615460 0.803443 F\n0.048943 0.313478 0.117357 F\n0.074302 0.792931 0.548632 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Na",
"Ti",
"F"
],
"chemical_system": "F-Na-Ti",
"density": 3.0561859906440096,
"density_atomic": 0.07519809742435192,
"volume": 319.1570109090009,
"volume_molar": 8.008368517645247,
"formula_full": "Na4 Ti4 F16",
"formula_reduced": "NaTiF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0421457415277777,
"spacegroup": 14
},
{
"id": "jvasp-109195",
"created_at": "2022-09-04T14:38:27.507303Z",
"updated_at": "2022-09-04T14:38:27.507324Z",
"structure_string": "Ce1 Pr1 O4\n1.0\n3.917111 0.000000 0.000000\n0.000000 3.917111 0.000000\n-0.000000 -0.000000 5.659085\nCe Pr O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Pr\n0.500000 0.000000 0.762779 O\n-0.000000 0.500000 0.237222 O\n0.500000 0.000000 0.237222 O\n-0.000000 0.500000 0.762779 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Pr",
"O"
],
"chemical_system": "Ce-O-Pr",
"density": 6.598070745044086,
"density_atomic": 0.06909924090442249,
"volume": 86.83163405947037,
"volume_molar": 8.715205378782347,
"formula_full": "Ce1 Pr1 O4",
"formula_reduced": "CePrO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.9554432250000005,
"spacegroup": 123
},
{
"id": "jvasp-118092",
"created_at": "2022-09-04T14:38:52.030524Z",
"updated_at": "2022-09-04T14:38:52.030543Z",
"structure_string": "Sc1 N1 Cl4\n1.0\n-3.926055 3.926055 2.197252\n3.926055 -3.926055 2.197252\n3.926055 3.926055 -2.197252\nSc N Cl\n1 1 4\ndirect\n-0.057527 -0.057527 -0.000000 Sc\n0.442475 0.442475 0.000000 N\n0.237238 0.050827 0.402990 Cl\n0.834248 0.237239 0.186411 Cl\n0.050827 0.647836 0.813588 Cl\n0.647836 0.834248 0.597009 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sc",
"N",
"Cl"
],
"chemical_system": "Cl-N-Sc",
"density": 2.460964077187226,
"density_atomic": 0.04428928120627089,
"volume": 135.47295951938963,
"volume_molar": 13.59728718999244,
"formula_full": "Sc1 N1 Cl4",
"formula_reduced": "ScNCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.444994128333333,
"spacegroup": 87
},
{
"id": "jvasp-119436",
"created_at": "2022-09-04T14:38:49.711765Z",
"updated_at": "2022-09-04T14:38:49.711785Z",
"structure_string": "U4 Mn4 B16\n1.0\n3.462695 -0.000000 0.000000\n0.000000 5.840725 0.000000\n0.000000 -0.000000 11.320843\nU Mn B\n4 4 16\ndirect\n-0.000000 0.626542 0.349509 U\n-0.000000 0.373459 0.650491 U\n-0.000000 0.126541 0.150491 U\n-0.000000 0.873459 0.849509 U\n-0.000000 0.635602 0.091283 Mn\n-0.000000 0.364398 0.908717 Mn\n-0.000000 0.135602 0.408717 Mn\n-0.000000 0.864399 0.591283 Mn\n0.500001 0.026112 0.691129 B\n0.500001 0.973889 0.308870 B\n0.500001 0.613108 0.954192 B\n0.500001 0.386893 0.045808 B\n0.500001 0.113108 0.545808 B\n0.500001 0.886893 0.454192 B\n0.500001 0.636010 0.533186 B\n0.500001 0.716041 0.686751 B\n0.500001 0.136010 0.966813 B\n0.500001 0.863991 0.033186 B\n0.500001 0.473889 0.191129 B\n0.500001 0.283959 0.313248 B\n0.500001 0.216041 0.813248 B\n0.500001 0.783960 0.186751 B\n0.500001 0.363991 0.466814 B\n0.500001 0.526112 0.808870 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"U",
"Mn",
"B"
],
"chemical_system": "B-Mn-U",
"density": 9.75351559970963,
"density_atomic": 0.10482176679806071,
"volume": 228.96007893318603,
"volume_molar": 5.745124265651487,
"formula_full": "U4 Mn4 B16",
"formula_reduced": "UMnB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.100722262452107,
"spacegroup": 55
},
{
"id": "jvasp-119702",
"created_at": "2022-09-04T14:38:49.756231Z",
"updated_at": "2022-09-04T14:38:49.756258Z",
"structure_string": "Eu2 V2 O8\n1.0\n5.846920 0.011523 -1.697772\n-3.294440 4.830452 -1.697772\n-0.006075 -0.011523 6.088421\nEu V O\n2 2 8\ndirect\n0.500000 0.499999 0.000000 Eu\n0.750000 0.250000 0.500000 Eu\n0.250000 0.750000 0.500000 V\n0.000000 0.000000 0.000000 V\n0.829741 0.012482 0.182741 O\n0.897001 0.579741 0.317260 O\n0.262483 0.579741 0.682741 O\n0.829742 0.647001 0.817260 O\n0.352999 0.170258 0.182741 O\n0.420259 0.737518 0.317260 O\n0.420259 0.102999 0.682741 O\n0.987519 0.170258 0.817260 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Eu",
"V",
"O"
],
"chemical_system": "Eu-O-V",
"density": 5.154737741795221,
"density_atomic": 0.06978387948143652,
"volume": 171.95948533059368,
"volume_molar": 8.62970188064992,
"formula_full": "Eu2 V2 O8",
"formula_reduced": "EuVO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.2671697,
"spacegroup": 141
},
{
"id": "jvasp-117386",
"created_at": "2022-09-04T14:38:49.800222Z",
"updated_at": "2022-09-04T14:38:49.800249Z",
"structure_string": "Cd2 Pd2 F8\n1.0\n5.450136 -0.000000 0.000000\n0.000000 5.453220 0.114204\n-0.000000 0.011603 5.482443\nCd Pd F\n2 2 8\ndirect\n0.500000 -0.000000 0.500000 Cd\n-0.000000 0.500000 0.499999 Cd\n0.500000 0.500000 -0.000000 Pd\n0.000000 0.000000 0.000000 Pd\n0.831931 0.672909 0.839522 F\n0.331931 0.827090 0.160477 F\n0.154270 0.149068 0.660792 F\n0.654270 0.350931 0.339207 F\n0.168069 0.327090 0.160477 F\n0.668070 0.172909 0.839522 F\n0.845731 0.850931 0.339207 F\n0.345731 0.649068 0.660792 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Cd",
"Pd",
"F"
],
"chemical_system": "Cd-F-Pd",
"density": 6.0093513385230155,
"density_atomic": 0.07364885714057223,
"volume": 162.9353185629998,
"volume_molar": 8.17682852634855,
"formula_full": "Cd2 Pd2 F8",
"formula_reduced": "CdPdF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-111347",
"created_at": "2022-09-04T14:38:49.930297Z",
"updated_at": "2022-09-04T14:38:49.930334Z",
"structure_string": "Na1 Ho1 F4\n1.0\n3.786252 -0.000000 0.000000\n0.000000 3.786252 0.000000\n-0.000000 -0.000000 5.456736\nNa Ho F\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Ho\n0.500000 0.000000 0.732404 F\n-0.000000 0.500000 0.267597 F\n0.500000 0.000000 0.267597 F\n-0.000000 0.500000 0.732404 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Ho",
"F"
],
"chemical_system": "F-Ho-Na",
"density": 5.602205840308939,
"density_atomic": 0.07670069090599918,
"volume": 78.22615323443856,
"volume_molar": 7.851481764851972,
"formula_full": "Na1 Ho1 F4",
"formula_reduced": "NaHoF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-113725",
"created_at": "2022-09-04T14:38:48.876962Z",
"updated_at": "2022-09-04T14:38:48.876995Z",
"structure_string": "Ta1 Sb1 O4\n1.0\n3.606449 -3.540367 0.000000\n3.606449 3.540367 0.000000\n0.000000 0.000000 3.219025\nTa Sb O\n1 1 4\ndirect\n0.500000 0.500000 0.500000 Ta\n0.000000 0.000000 0.000000 Sb\n0.322345 0.322345 0.000000 O\n0.222635 0.777364 0.500000 O\n0.777364 0.222635 0.500000 O\n0.677655 0.677655 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ta",
"Sb",
"O"
],
"chemical_system": "O-Sb-Ta",
"density": 7.40771172503768,
"density_atomic": 0.07299091805188569,
"volume": 82.20200759408029,
"volume_molar": 8.250534341435673,
"formula_full": "Ta1 Sb1 O4",
"formula_reduced": "TaSbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.9509732166666662,
"spacegroup": 65
}
]
}