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=updated_at&page=30",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=28",
"results": [
{
"id": "jvasp-107772",
"created_at": "2022-09-04T14:35:41.645658Z",
"updated_at": "2022-09-04T14:35:41.645679Z",
"structure_string": "Bi3 Sb1\n1.0\n4.376835 0.008656 7.148252\n2.021149 3.882231 7.148252\n0.014234 0.008656 8.381766\nBi Sb\n3 1\ndirect\n0.116871 0.116871 0.116871 Bi\n0.885057 0.885059 0.885056 Bi\n0.380676 0.380677 0.380676 Bi\n0.617395 0.617396 0.617395 Sb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Bi",
"Sb"
],
"chemical_system": "Bi-Sb",
"density": 8.771605099318453,
"density_atomic": 0.028221587259368252,
"volume": 141.73547232614234,
"volume_molar": 21.338774125827843,
"formula_full": "Bi3 Sb1",
"formula_reduced": "Bi3Sb",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0765222500000002,
"spacegroup": 160
},
{
"id": "jvasp-86314",
"created_at": "2022-09-04T14:35:41.649814Z",
"updated_at": "2022-09-04T14:35:41.649841Z",
"structure_string": "Ce2 Fe17\n1.0\n6.294712 0.062487 0.855164\n0.755163 6.249562 0.855164\n0.069792 0.062487 6.352152\nCe Fe\n2 17\ndirect\n0.341352 0.341352 0.341351 Ce\n0.658647 0.658648 0.658647 Ce\n0.841650 0.341138 0.341137 Fe\n0.158349 0.658862 0.658861 Fe\n0.658861 0.658862 0.158349 Fe\n0.658861 0.158350 0.658861 Fe\n0.295954 0.000000 0.704046 Fe\n-0.000000 0.704046 0.295953 Fe\n0.704046 0.295954 -0.000001 Fe\n0.341137 0.341138 0.841650 Fe\n0.295954 0.704046 -0.000001 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.500000 0.000000 -0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n0.905329 0.905330 0.905328 Fe\n0.094670 0.094670 0.094670 Fe\n0.341137 0.841650 0.341137 Fe\n-0.000000 0.295954 0.704046 Fe\n0.704046 0.000000 0.295953 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Ce",
"Fe"
],
"chemical_system": "Ce-Fe",
"density": 8.202495144820848,
"density_atomic": 0.07632866922134364,
"volume": 248.92350664338673,
"volume_molar": 7.889749449890895,
"formula_full": "Ce2 Fe17",
"formula_reduced": "Ce2Fe17",
"formula_anonymous": "A2B17",
"energy_above_hull": 4.163699710526315,
"spacegroup": 166
},
{
"id": "jvasp-70274",
"created_at": "2022-09-04T14:35:41.652260Z",
"updated_at": "2022-09-04T14:35:41.652290Z",
"structure_string": "Ca1 Be2 In1\n1.0\n3.108371 0.000000 0.000000\n0.000000 3.108371 0.000000\n0.000000 -0.000000 7.284504\nCa Be In\n1 2 1\ndirect\n0.000000 0.000000 0.461599 Ca\n0.000000 0.000000 0.063044 Be\n0.500000 0.500000 0.172035 Be\n0.500000 0.500000 0.803322 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Be",
"In"
],
"chemical_system": "Be-Ca-In",
"density": 4.079712464968459,
"density_atomic": 0.056832179078357734,
"volume": 70.38266110621896,
"volume_molar": 10.596357306125697,
"formula_full": "Ca1 Be2 In1",
"formula_reduced": "CaBe2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7435431474999998,
"spacegroup": 99
},
{
"id": "jvasp-93830",
"created_at": "2022-09-04T14:35:41.652664Z",
"updated_at": "2022-09-04T14:35:41.652693Z",
"structure_string": "Pr1 In1 Pt4\n1.0\n-3.865806 -3.865806 -0.000000\n-3.865806 0.000000 -3.865806\n-0.000000 -3.865806 -3.865806\nPr In Pt\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Pr\n0.750001 0.750001 0.750001 In\n0.873289 0.375571 0.375571 Pt\n0.375571 0.873289 0.375571 Pt\n0.375571 0.375571 0.873289 Pt\n0.375571 0.375571 0.375571 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"In",
"Pt"
],
"chemical_system": "In-Pr-Pt",
"density": 14.88965149914539,
"density_atomic": 0.05192793916820631,
"volume": 115.54473557220606,
"volume_molar": 11.597111028213403,
"formula_full": "Pr1 In1 Pt4",
"formula_reduced": "PrInPt4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0285392366666666,
"spacegroup": 216
},
{
"id": "jvasp-66198",
"created_at": "2022-09-04T14:35:41.655530Z",
"updated_at": "2022-09-04T14:35:41.655567Z",
"structure_string": "Ba1 Sb1 Cl1\n1.0\n0.000000 3.969662 3.969662\n3.969662 0.000000 3.969662\n3.969662 3.969662 0.000000\nBa Sb Cl\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"Cl"
],
"chemical_system": "Ba-Cl-Sb",
"density": 3.9093341590746706,
"density_atomic": 0.023978977991403243,
"volume": 125.10958561601485,
"volume_molar": 25.114251166830424,
"formula_full": "Ba1 Sb1 Cl1",
"formula_reduced": "BaSbCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1407787125,
"spacegroup": 216
},
{
"id": "jvasp-86832",
"created_at": "2022-09-04T14:35:41.656669Z",
"updated_at": "2022-09-04T14:35:41.656695Z",
"structure_string": "Nd1 B2 Rh2 C1\n1.0\n3.646350 -0.000000 -1.284244\n-0.452310 3.618188 -1.284244\n0.004212 0.004771 5.830617\nNd B Rh C\n1 2 2 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.644999 0.644999 0.289999 B\n0.355001 0.355001 0.710003 B\n0.750000 0.250000 0.500001 Rh\n0.250000 0.750000 0.500001 Rh\n0.500000 0.500000 0.000001 C\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Nd",
"B",
"Rh",
"C"
],
"chemical_system": "B-C-Nd-Rh",
"density": 8.277677654436186,
"density_atomic": 0.07795339782245972,
"volume": 76.96906315315606,
"volume_molar": 7.725308874560587,
"formula_full": "Nd1 B2 Rh2 C1",
"formula_reduced": "NdB2Rh2C",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 4.040545444444445,
"spacegroup": 139
},
{
"id": "jvasp-43767",
"created_at": "2022-09-04T14:35:41.661930Z",
"updated_at": "2022-09-04T14:35:41.661966Z",
"structure_string": "Li4 Ti5 Cr3 O16\n1.0\n5.840694 -0.022527 0.016862\n-2.939856 5.091965 -0.000018\n0.027066 0.015599 9.505269\nLi Ti Cr O\n4 5 3 16\ndirect\n0.331493 0.665758 0.894888 Li\n0.993021 0.996513 0.993170 Li\n0.996840 0.998427 0.496861 Li\n0.669160 0.334593 0.399356 Li\n0.347510 0.173767 0.721665 Ti\n0.177383 0.834467 0.217349 Ti\n0.336143 0.668082 0.496709 Ti\n0.177381 0.342938 0.217347 Ti\n0.681256 0.340637 0.990840 Ti\n0.828417 0.168813 0.712836 Cr\n0.657060 0.828540 0.212249 Cr\n0.828416 0.659626 0.712836 Cr\n0.332071 0.166044 0.095774 O\n0.834579 0.667874 0.095943 O\n0.662995 0.331510 0.602720 O\n0.514558 0.034923 0.841598 O\n0.514559 0.479658 0.841600 O\n0.665224 0.832622 0.597073 O\n0.482514 0.518937 0.340569 O\n0.037313 0.518667 0.339750 O\n0.167359 0.333524 0.596236 O\n-0.003016 -0.001495 0.808115 O\n0.996324 0.998173 0.310755 O\n0.329058 0.664540 0.100988 O\n0.957909 0.478967 0.837864 O\n0.167359 0.833856 0.596237 O\n0.482516 0.963600 0.340570 O\n0.834580 0.166722 0.095940 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O-Ti",
"density": 3.9978566608791017,
"density_atomic": 0.0992696941213431,
"volume": 282.0599000312621,
"volume_molar": 6.066444359784961,
"formula_full": "Li4 Ti5 Cr3 O16",
"formula_reduced": "Li4Ti5Cr3O16",
"formula_anonymous": "A3B4C5D16",
"energy_above_hull": 3.3321378523809524,
"spacegroup": 8
},
{
"id": "jvasp-64719",
"created_at": "2022-09-04T14:35:41.662543Z",
"updated_at": "2022-09-04T14:35:41.662569Z",
"structure_string": "Ba4 Y1 Nb1\n1.0\n-0.000000 5.037542 5.037542\n5.037542 -0.000000 5.037542\n5.037542 5.037542 -0.000000\nBa Y Nb\n4 1 1\ndirect\n0.126484 0.624505 0.624505 Ba\n0.624505 0.624505 0.624505 Ba\n0.624505 0.126484 0.624505 Ba\n0.624505 0.624505 0.126484 Ba\n0.000000 0.000000 0.000000 Y\n0.250000 0.250000 0.250000 Nb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Y",
"Nb"
],
"chemical_system": "Ba-Nb-Y",
"density": 4.748449926076421,
"density_atomic": 0.023467412895845523,
"volume": 255.67368787644207,
"volume_molar": 25.661715617003996,
"formula_full": "Ba4 Y1 Nb1",
"formula_reduced": "Ba4YNb",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.5343747883333332,
"spacegroup": 216
},
{
"id": "jvasp-69580",
"created_at": "2022-09-04T14:35:41.664957Z",
"updated_at": "2022-09-04T14:35:41.664984Z",
"structure_string": "Mg1 Be2 Tl1\n1.0\n-1.990658 1.990658 4.044488\n1.990658 -1.990658 4.044488\n1.990658 1.990658 -4.044488\nMg Be Tl\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.750001 0.250000 0.500001 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Tl"
],
"chemical_system": "Be-Mg-Tl",
"density": 6.390335954790921,
"density_atomic": 0.06239404497977292,
"volume": 64.10868218748651,
"volume_molar": 9.651787701778712,
"formula_full": "Mg1 Be2 Tl1",
"formula_reduced": "MgBe2Tl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.81840128125,
"spacegroup": 119
},
{
"id": "jvasp-3915",
"created_at": "2022-09-04T14:35:41.667613Z",
"updated_at": "2022-09-04T14:35:41.667637Z",
"structure_string": "Nd2 Br6\n1.0\n4.126670 -0.000000 0.000000\n-2.063335 6.342270 0.000000\n0.000000 0.000000 9.192225\nNd Br\n2 6\ndirect\n0.743326 0.486652 0.250000 Nd\n0.256675 0.513348 0.750000 Nd\n0.355531 0.711059 0.435219 Br\n0.644470 0.288941 0.564780 Br\n0.919976 0.839949 0.750000 Br\n0.080025 0.160051 0.250000 Br\n0.355531 0.711059 0.064780 Br\n0.644470 0.288941 0.935219 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nd",
"Br"
],
"chemical_system": "Br-Nd",
"density": 5.300211205966704,
"density_atomic": 0.03325254374335597,
"volume": 240.58309829600452,
"volume_molar": 18.110316030193193,
"formula_full": "Nd2 Br6",
"formula_reduced": "NdBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-48714",
"created_at": "2022-09-04T14:35:41.668316Z",
"updated_at": "2022-09-04T14:35:41.668350Z",
"structure_string": "V4 O2 F10\n1.0\n0.000000 4.765357 0.030170\n4.767174 0.000000 0.000000\n0.000000 -4.750723 -8.673323\nV O F\n4 2 10\ndirect\n0.348219 0.772994 0.827224 V\n0.675672 0.243698 0.686341 V\n0.348218 0.227006 0.327225 V\n0.675672 0.756301 0.186342 V\n0.591835 0.036148 0.810134 O\n0.591835 0.963851 0.310134 O\n0.036684 0.470874 0.818532 F\n0.389066 0.541111 0.676336 F\n0.962327 0.965347 0.676793 F\n0.679390 0.427023 0.502020 F\n0.317553 0.067581 0.500670 F\n0.036683 0.529125 0.318532 F\n0.962327 0.034652 0.176793 F\n0.389066 0.458889 0.176337 F\n0.679389 0.572976 0.002021 F\n0.317553 0.932418 0.000670 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.6005534381377036,
"density_atomic": 0.08148669072890526,
"volume": 196.35108331039908,
"volume_molar": 7.390336637960687,
"formula_full": "V4 O2 F10",
"formula_reduced": "V2OF5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.1482129140625,
"spacegroup": 7
},
{
"id": "jvasp-65210",
"created_at": "2022-09-04T14:35:41.669785Z",
"updated_at": "2022-09-04T14:35:41.669811Z",
"structure_string": "Be1 Pt1 Rh1\n1.0\n-1.382856 1.382856 4.879570\n1.382856 -1.382856 4.879570\n1.382856 1.382856 -4.879570\nBe Pt Rh\n1 1 1\ndirect\n0.001995 0.001995 0.000000 Be\n0.354558 0.354558 0.000000 Pt\n0.643447 0.643447 0.000000 Rh\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Pt",
"Rh"
],
"chemical_system": "Be-Pt-Rh",
"density": 13.658229053503671,
"density_atomic": 0.08037588985028278,
"volume": 37.324625650653935,
"volume_molar": 7.492471649418153,
"formula_full": "Be1 Pt1 Rh1",
"formula_reduced": "BePtRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.0285335,
"spacegroup": 107
}
]
}