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=nsites&page=3431",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=3429",
"results": [
{
"id": "jvasp-12666",
"created_at": "2022-09-04T14:37:06.208962Z",
"updated_at": "2022-09-04T14:37:06.208980Z",
"structure_string": "V2 Bi2 O8\n1.0\n4.788157 -0.000000 -1.931901\n-0.779473 4.724286 -1.931901\n-0.002725 -0.003212 6.892847\nV Bi O\n2 2 8\ndirect\n0.875000 0.625000 0.750001 V\n0.124999 0.375001 0.250000 V\n0.375001 0.125000 0.750001 Bi\n0.625001 0.875001 0.250001 Bi\n0.936081 0.295976 0.591554 O\n0.295577 0.436082 0.091554 O\n0.795977 0.155473 0.091555 O\n0.655473 0.795578 0.591555 O\n0.344528 0.204423 0.408447 O\n0.204024 0.844528 0.908447 O\n0.063919 0.704023 0.408446 O\n0.704423 0.563919 0.908448 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"V",
"Bi",
"O"
],
"chemical_system": "Bi-O-V",
"density": 6.902056660633553,
"density_atomic": 0.07699164161131672,
"volume": 155.86107464210977,
"volume_molar": 7.821811087497098,
"formula_full": "V2 Bi2 O8",
"formula_reduced": "VBiO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.39882375,
"spacegroup": 88
},
{
"id": "jvasp-10539",
"created_at": "2022-09-04T14:37:06.338636Z",
"updated_at": "2022-09-04T14:37:06.338659Z",
"structure_string": "K4 Na2 Ga2 P4\n1.0\n5.950265 0.000000 -2.391282\n-1.015191 5.965198 -2.526114\n-0.007192 0.028552 8.580813\nK Na Ga P\n4 2 2 4\ndirect\n0.825469 0.066095 0.650936 K\n0.174533 0.933905 0.349065 K\n0.674532 0.415151 0.349062 K\n0.325470 0.584849 0.650939 K\n0.750002 -0.000000 0.000000 Na\n0.249998 -0.000000 0.000000 Na\n0.250004 0.500000 0.000000 Ga\n0.749997 0.500000 0.000001 Ga\n0.594056 0.795699 0.188111 P\n0.405945 0.204301 0.811889 P\n0.905945 0.607592 0.811888 P\n0.094056 0.392408 0.188113 P\n",
"nsites": 12,
"nelements": 4,
"elements": [
"K",
"Na",
"Ga",
"P"
],
"chemical_system": "Ga-K-Na-P",
"density": 2.535796765280256,
"density_atomic": 0.03934843804564141,
"volume": 304.9676326689473,
"volume_molar": 15.304650093136459,
"formula_full": "K4 Na2 Ga2 P4",
"formula_reduced": "K2NaGaP2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 0.4534480541666666,
"spacegroup": 72
},
{
"id": "jvasp-60701",
"created_at": "2022-09-04T14:37:06.765289Z",
"updated_at": "2022-09-04T14:37:06.765316Z",
"structure_string": "Zn2 W2 O8\n1.0\n4.815444 0.045730 -0.001182\n-0.498488 4.840177 -0.000336\n-2.157203 -2.442298 6.381916\nZn W O\n2 2 8\ndirect\n0.369833 0.619817 0.239643 Zn\n0.630167 0.380184 0.760358 Zn\n0.838901 0.088893 0.177781 W\n0.161098 0.911107 0.822219 W\n0.871087 0.593776 0.651362 O\n0.507400 0.266795 0.089169 O\n0.719753 0.942405 0.348630 O\n0.918221 0.177629 0.910833 O\n0.128912 0.406224 0.348638 O\n0.280247 0.057596 0.651370 O\n0.492600 0.733206 0.910831 O\n0.081778 0.822371 0.089167 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zn",
"W",
"O"
],
"chemical_system": "O-W-Zn",
"density": 6.987854791808179,
"density_atomic": 0.08060456876068618,
"volume": 148.87493580702392,
"volume_molar": 7.471215158882185,
"formula_full": "Zn2 W2 O8",
"formula_reduced": "ZnWO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.610584066666667,
"spacegroup": 15
},
{
"id": "jvasp-12608",
"created_at": "2022-09-04T14:37:06.353791Z",
"updated_at": "2022-09-04T14:37:06.353810Z",
"structure_string": "Sr3 Co2 Cl2 O5\n1.0\n3.814800 -0.000000 -0.613805\n-0.098761 3.813521 -0.613805\n0.031826 0.032661 12.359198\nSr Co Cl O\n3 2 2 5\ndirect\n0.000000 0.000000 0.000000 Sr\n0.154866 0.154867 0.309734 Sr\n0.845134 0.845132 0.690267 Sr\n0.423332 0.423332 0.846664 Co\n0.576668 0.576669 0.153338 Co\n0.295204 0.295202 0.590405 Cl\n0.704799 0.704796 0.409596 Cl\n0.500000 0.500001 0.000000 O\n0.413431 0.913430 0.826860 O\n0.913431 0.413429 0.826860 O\n0.086570 0.586569 0.173141 O\n0.586570 0.086571 0.173141 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Sr",
"Co",
"Cl",
"O"
],
"chemical_system": "Cl-Co-O-Sr",
"density": 4.9056954038516665,
"density_atomic": 0.06668432290672825,
"volume": 179.95234077407474,
"volume_molar": 9.030819385274713,
"formula_full": "Sr3 Co2 Cl2 O5",
"formula_reduced": "Sr3Co2Cl2O5",
"formula_anonymous": "A2B2C3D5",
"energy_above_hull": 1.5592205304166666,
"spacegroup": 139
},
{
"id": "jvasp-11315",
"created_at": "2022-09-04T14:37:06.564057Z",
"updated_at": "2022-09-04T14:37:06.564075Z",
"structure_string": "Mg2 Ni2 F8\n1.0\n-4.918183 -0.000452 -0.004582\n0.000492 -4.918151 -0.008727\n2.454080 2.449554 5.425644\nMg Ni F\n2 2 8\ndirect\n0.787527 0.787999 0.575663 Mg\n0.210832 0.211298 0.422329 Mg\n0.954943 0.455464 0.910586 Ni\n0.543363 0.043882 0.087402 Ni\n0.580523 0.515273 0.650031 F\n0.892751 0.828257 0.155606 F\n0.262159 0.327661 0.155603 F\n0.483616 0.930017 0.347959 F\n0.068833 0.135138 0.650053 F\n0.170541 0.736672 0.842410 F\n0.671126 0.106100 0.842383 F\n0.863702 0.418250 0.347952 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mg",
"Ni",
"F"
],
"chemical_system": "F-Mg-Ni",
"density": 4.028355614702702,
"density_atomic": 0.09154921982895799,
"volume": 131.0770318132659,
"volume_molar": 6.578036133187378,
"formula_full": "Mg2 Ni2 F8",
"formula_reduced": "MgNiF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 82
},
{
"id": "jvasp-53618",
"created_at": "2022-09-04T14:37:06.485476Z",
"updated_at": "2022-09-04T14:37:06.485500Z",
"structure_string": "Na2 Ho2 F8\n1.0\n6.248085 0.000017 4.417979\n3.160295 3.825673 8.784700\n0.036198 -0.000108 6.575776\nNa Ho F\n2 2 8\ndirect\n1.000002 0.000003 0.999999 Na\n0.750002 0.499998 0.000000 Na\n0.499999 0.999999 0.000000 Ho\n0.250004 0.500001 0.999999 Ho\n0.375007 0.482395 0.267602 F\n0.142592 0.482419 0.767585 F\n0.142601 0.982409 0.267586 F\n0.875012 0.517591 0.232393 F\n0.607398 0.517591 0.732411 F\n0.607409 0.017578 0.232419 F\n0.374997 0.017604 0.732396 F\n0.874992 0.982407 0.767609 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"Ho",
"F"
],
"chemical_system": "F-Ho-Na",
"density": 5.59785551899329,
"density_atomic": 0.07664112996516896,
"volume": 156.5738919227004,
"volume_molar": 7.857583470829408,
"formula_full": "Na2 Ho2 F8",
"formula_reduced": "NaHoF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0021099999999995,
"spacegroup": 141
},
{
"id": "jvasp-12675",
"created_at": "2022-09-04T14:37:06.492977Z",
"updated_at": "2022-09-04T14:37:06.493001Z",
"structure_string": "Pb2 W2 O8\n1.0\n5.091381 0.000000 -2.107150\n-0.872078 5.016138 -2.107150\n-0.006095 -0.007246 7.189851\nPb W O\n2 2 8\ndirect\n0.375000 0.124999 0.750000 Pb\n0.625000 0.875000 0.250000 Pb\n0.875000 0.625000 0.750000 W\n0.125000 0.375000 0.250000 W\n0.190576 0.564089 0.915707 O\n0.351619 0.690576 0.415707 O\n0.064089 0.225131 0.415707 O\n0.725131 0.851618 0.915707 O\n0.274869 0.148381 0.084293 O\n0.935911 0.774869 0.584293 O\n0.648381 0.309424 0.584293 O\n0.809424 0.435911 0.084293 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Pb",
"W",
"O"
],
"chemical_system": "O-Pb-W",
"density": 8.237004285400014,
"density_atomic": 0.06540698957344754,
"volume": 183.46663068057623,
"volume_molar": 9.207182289344706,
"formula_full": "Pb2 W2 O8",
"formula_reduced": "PbWO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.9562708033333336,
"spacegroup": 88
},
{
"id": "jvasp-9441",
"created_at": "2022-09-04T14:37:06.530165Z",
"updated_at": "2022-09-04T14:37:06.530199Z",
"structure_string": "Ni4 As4 S4\n1.0\n5.728522 -0.000000 0.000000\n-0.000000 5.728522 0.000000\n0.000000 -0.000000 5.728522\nNi As S\n4 4 4\ndirect\n0.494155 0.505845 0.005845 Ni\n0.505845 0.005845 0.494155 Ni\n0.994155 0.994155 0.994155 Ni\n0.005845 0.494155 0.505845 Ni\n0.380000 0.120000 0.880000 As\n0.880000 0.380000 0.120000 As\n0.620000 0.620000 0.620000 As\n0.120000 0.880000 0.380000 As\n0.615602 0.884397 0.115603 S\n0.115603 0.615602 0.884397 S\n0.884397 0.115603 0.615602 S\n0.384397 0.384397 0.384397 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ni",
"As",
"S"
],
"chemical_system": "As-Ni-S",
"density": 5.8539824856320894,
"density_atomic": 0.06383421031005669,
"volume": 187.98697346945127,
"volume_molar": 9.434033460661842,
"formula_full": "Ni4 As4 S4",
"formula_reduced": "NiAsS",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4278313833333334,
"spacegroup": 198
},
{
"id": "jvasp-56183",
"created_at": "2022-09-04T14:37:06.574331Z",
"updated_at": "2022-09-04T14:37:06.574355Z",
"structure_string": "Nd4 Mn8\n1.0\n2.753914 -4.769918 0.000000\n2.753914 4.769918 -0.000000\n-0.000000 0.000000 8.139763\nNd Mn\n4 8\ndirect\n0.333332 0.666666 0.943291 Nd\n0.666666 0.333332 0.056709 Nd\n0.333332 0.666666 0.556709 Nd\n0.666666 0.333332 0.443291 Nd\n0.158870 0.317740 0.250000 Mn\n0.158869 0.841129 0.250000 Mn\n0.682258 0.841129 0.250000 Mn\n0.317740 0.158870 0.750000 Mn\n0.000000 0.000000 0.000000 Mn\n0.841129 0.158869 0.750000 Mn\n0.841129 0.682258 0.750000 Mn\n0.000000 0.000000 0.500000 Mn\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Nd",
"Mn"
],
"chemical_system": "Mn-Nd",
"density": 7.892991381133506,
"density_atomic": 0.056114901301689,
"volume": 213.84694121592997,
"volume_molar": 10.7318031758148,
"formula_full": "Nd4 Mn8",
"formula_reduced": "NdMn2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.0627286609195403,
"spacegroup": 194
},
{
"id": "jvasp-9694",
"created_at": "2022-09-04T14:37:06.612570Z",
"updated_at": "2022-09-04T14:37:06.612593Z",
"structure_string": "Cu4 Ag4 S4\n1.0\n4.044976 0.000000 0.000000\n0.000000 6.594166 0.000000\n0.000000 0.000000 8.151316\nCu Ag S\n4 4 4\ndirect\n0.000000 0.554974 0.724676 Cu\n0.000000 0.445027 0.224675 Cu\n0.500001 0.055014 0.742638 Cu\n0.500001 0.944987 0.242638 Cu\n0.500001 0.572888 0.475249 Ag\n0.500001 0.427113 0.975249 Ag\n0.000000 0.072883 0.991900 Ag\n0.000000 0.927118 0.491899 Ag\n0.500001 0.299406 0.262831 S\n0.500001 0.700595 0.762831 S\n0.000000 0.799421 0.204308 S\n0.000000 0.200579 0.704308 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Cu",
"Ag",
"S"
],
"chemical_system": "Ag-Cu-S",
"density": 6.216208254364527,
"density_atomic": 0.05519219819155042,
"volume": 217.4220341496948,
"volume_molar": 10.911217449791575,
"formula_full": "Cu4 Ag4 S4",
"formula_reduced": "CuAgS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3109592366666667,
"spacegroup": 62
},
{
"id": "jvasp-29045",
"created_at": "2022-09-04T14:37:06.624482Z",
"updated_at": "2022-09-04T14:37:06.624514Z",
"structure_string": "Te2 Mo1 W3 Se2 S4\n1.0\n3.310733 0.000000 0.000000\n-1.655367 2.867179 -0.000137\n0.000000 -0.001809 38.324232\nTe Mo W Se S\n2 1 3 2 4\ndirect\n0.666601 0.333203 0.042909 Te\n0.666671 0.333342 0.142689 Te\n0.333302 0.666605 0.092711 Mo\n0.333280 0.666562 0.469796 W\n0.666722 0.333447 0.282748 W\n0.666690 0.333384 0.657626 W\n0.333425 0.666853 0.326822 Se\n0.333353 0.666710 0.238698 Se\n0.333382 0.666766 0.697607 S\n0.666586 0.333172 0.429708 S\n0.666644 0.333289 0.509875 S\n0.333333 0.666668 0.617557 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.4265034333350215,
"density_atomic": 0.03298593673307762,
"volume": 363.7913968338709,
"volume_molar": 18.256691658421577,
"formula_full": "Te2 Mo1 W3 Se2 S4",
"formula_reduced": "Te2MoW3(SeS2)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 4.219468180555555,
"spacegroup": 156
},
{
"id": "jvasp-9119",
"created_at": "2022-09-04T14:37:06.693583Z",
"updated_at": "2022-09-04T14:37:06.693605Z",
"structure_string": "Na6 O6\n1.0\n3.102420 -5.373549 -0.000000\n3.102420 5.373549 -0.000000\n0.000000 -0.000000 4.473417\nNa O\n6 6\ndirect\n0.298915 0.298915 0.500000 Na\n-0.000000 0.701085 0.500000 Na\n0.701085 -0.000000 0.500000 Na\n0.632855 0.632855 0.000000 Na\n-0.000000 0.367145 0.000000 Na\n0.367145 -0.000000 0.000000 Na\n0.333333 0.666667 0.674422 O\n0.333333 0.666667 0.325579 O\n0.666667 0.333333 0.325579 O\n0.666667 0.333333 0.674422 O\n0.000000 0.000000 0.172103 O\n0.000000 0.000000 0.827898 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Na",
"O"
],
"chemical_system": "Na-O",
"density": 2.604432735768763,
"density_atomic": 0.08045444840096641,
"volume": 149.15272229814775,
"volume_molar": 7.485155736805304,
"formula_full": "Na6 O6",
"formula_reduced": "NaO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0681358749999998,
"spacegroup": 189
}
]
}