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=created_at&page=541",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=created_at&page=539",
"results": [
{
"id": "jvasp-69216",
"created_at": "2022-09-04T14:35:58.582747Z",
"updated_at": "2022-09-04T14:35:58.582774Z",
"structure_string": "Ba2 Y1 Se1\n1.0\n-0.000000 4.217993 4.217993\n4.217993 0.000000 4.217993\n4.217993 4.217993 0.000000\nBa Y Se\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Y",
"Se"
],
"chemical_system": "Ba-Se-Y",
"density": 4.895919791907891,
"density_atomic": 0.02665093387040445,
"volume": 150.08854922123209,
"volume_molar": 22.5963592468612,
"formula_full": "Ba2 Y1 Se1",
"formula_reduced": "Ba2YSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8971851891666667,
"spacegroup": 225
},
{
"id": "jvasp-68633",
"created_at": "2022-09-04T14:35:58.584170Z",
"updated_at": "2022-09-04T14:35:58.584196Z",
"structure_string": "Be2 Zn1 Ga1\n1.0\n3.233164 -0.000000 -0.000000\n-0.000000 3.233164 -0.000000\n0.000000 0.000000 4.817104\nBe Zn Ga\n2 1 1\ndirect\n-0.000000 -0.000000 0.750339 Be\n-0.000000 -0.000000 0.249660 Be\n0.499999 0.499999 0.500000 Zn\n0.499999 0.499999 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Ga"
],
"chemical_system": "Be-Ga-Zn",
"density": 5.050596265670693,
"density_atomic": 0.07943620715443515,
"volume": 50.35487145330892,
"volume_molar": 7.581103096088301,
"formula_full": "Be2 Zn1 Ga1",
"formula_reduced": "Be2ZnGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.689595078125,
"spacegroup": 123
},
{
"id": "jvasp-66975",
"created_at": "2022-09-04T14:35:58.585675Z",
"updated_at": "2022-09-04T14:35:58.585693Z",
"structure_string": "Be1 Ge1 Bi1\n1.0\n-1.645888 1.645888 5.914403\n1.645888 -1.645888 5.914403\n1.645888 1.645888 -5.914403\nBe Ge Bi\n1 1 1\ndirect\n0.040285 0.040285 0.000000 Be\n0.606465 0.606465 0.000000 Ge\n0.353250 0.353250 0.000000 Bi\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Ge",
"Bi"
],
"chemical_system": "Be-Bi-Ge",
"density": 7.530467441875876,
"density_atomic": 0.046811201924268915,
"volume": 64.08722435397824,
"volume_molar": 12.8647428659119,
"formula_full": "Be1 Ge1 Bi1",
"formula_reduced": "BeGeBi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2062887833333331,
"spacegroup": 107
},
{
"id": "jvasp-93092",
"created_at": "2022-09-04T14:35:58.587433Z",
"updated_at": "2022-09-04T14:35:58.587460Z",
"structure_string": "Mg6 Si1 W1\n1.0\n6.029818 0.216007 0.000000\n-2.827841 4.897963 0.000000\n0.000000 0.000000 5.015868\nMg Si W\n6 1 1\ndirect\n0.653465 0.327324 0.250000 Mg\n0.653465 0.826141 0.250000 Mg\n0.338086 0.160492 0.750000 Mg\n0.338086 0.677594 0.750000 Mg\n0.854935 0.177468 0.750000 Mg\n0.855306 0.677653 0.750000 Mg\n0.156834 0.328416 0.250000 Si\n0.149825 0.824912 0.250000 W\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Si",
"W"
],
"chemical_system": "Mg-Si-W",
"density": 3.928972088585048,
"density_atomic": 0.05290948252143607,
"volume": 151.2016300057146,
"volume_molar": 11.381968737948162,
"formula_full": "Mg6 Si1 W1",
"formula_reduced": "Mg6SiW",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.8949341124999999,
"spacegroup": 38
},
{
"id": "jvasp-65603",
"created_at": "2022-09-04T14:35:58.589981Z",
"updated_at": "2022-09-04T14:35:58.590009Z",
"structure_string": "K2 Ba1 Bi1\n1.0\n4.959370 -0.000000 -0.000000\n0.000000 4.959370 -0.000000\n0.000000 -0.000000 7.519060\nK Ba Bi\n2 1 1\ndirect\n-0.000000 0.000000 0.703111 K\n-0.000000 0.000000 0.296889 K\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Bi"
],
"chemical_system": "Ba-Bi-K",
"density": 3.811661387850801,
"density_atomic": 0.02162934758214482,
"volume": 184.9339183629389,
"volume_molar": 27.842452191999172,
"formula_full": "K2 Ba1 Bi1",
"formula_reduced": "K2BaBi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-71935",
"created_at": "2022-09-04T14:35:58.594530Z",
"updated_at": "2022-09-04T14:35:58.594556Z",
"structure_string": "Be1 Cu2 Os1\n1.0\n-1.696756 1.696756 4.088859\n1.696756 -1.696756 4.088859\n1.696756 1.696756 -4.088859\nBe Cu Os\n1 2 1\ndirect\n0.750001 0.250000 0.500001 Be\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.000000 Cu\n0.250000 0.750001 0.500001 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Os"
],
"chemical_system": "Be-Cu-Os",
"density": 11.50828877002398,
"density_atomic": 0.08494915792028411,
"volume": 47.08698824011394,
"volume_molar": 7.0891117786607705,
"formula_full": "Be1 Cu2 Os1",
"formula_reduced": "BeCu2Os",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7921105000000002,
"spacegroup": 139
},
{
"id": "jvasp-64879",
"created_at": "2022-09-04T14:35:58.597503Z",
"updated_at": "2022-09-04T14:35:58.597534Z",
"structure_string": "Be2 Nb1 Cu1\n1.0\n-2.048542 2.048542 2.899473\n2.048542 -2.048542 2.899473\n2.048542 2.048542 -2.899473\nBe Nb Cu\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.749999 0.250000 0.499999 Nb\n0.499999 0.499999 0.000000 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Nb",
"Cu"
],
"chemical_system": "Be-Cu-Nb",
"density": 5.95275269541711,
"density_atomic": 0.08218474011335207,
"volume": 48.67083590558369,
"volume_molar": 7.327565618257176,
"formula_full": "Be2 Nb1 Cu1",
"formula_reduced": "Be2NbCu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.2258330125,
"spacegroup": 216
},
{
"id": "jvasp-66380",
"created_at": "2022-09-04T14:35:58.600050Z",
"updated_at": "2022-09-04T14:35:58.600071Z",
"structure_string": "Ba4 Fe1 Re1\n1.0\n-0.000000 4.731018 4.731018\n4.731018 -0.000000 4.731018\n4.731018 4.731018 -0.000000\nBa Fe Re\n4 1 1\ndirect\n0.124567 0.625145 0.625145 Ba\n0.625145 0.625145 0.625145 Ba\n0.625145 0.124567 0.625145 Ba\n0.625145 0.625145 0.124567 Ba\n0.250000 0.250000 0.250000 Fe\n0.000000 0.000000 0.000000 Re\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Fe",
"Re"
],
"chemical_system": "Ba-Fe-Re",
"density": 6.204822971900289,
"density_atomic": 0.028330709669868125,
"volume": 211.78431708618504,
"volume_molar": 21.256582804224657,
"formula_full": "Ba4 Fe1 Re1",
"formula_reduced": "Ba4FeRe",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0429262299999995,
"spacegroup": 216
},
{
"id": "jvasp-99257",
"created_at": "2022-09-04T14:35:58.600925Z",
"updated_at": "2022-09-04T14:35:58.600952Z",
"structure_string": "Co2 Sb4\n1.0\n3.446999 0.000000 0.000000\n0.000000 5.593307 -0.000000\n0.000000 0.000000 6.435574\nCo Sb\n2 4\ndirect\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.202571 0.356784 Sb\n0.000000 0.797429 0.643216 Sb\n0.500000 0.702572 0.143216 Sb\n0.500000 0.297429 0.856783 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Co",
"Sb"
],
"chemical_system": "Co-Sb",
"density": 8.095434564734948,
"density_atomic": 0.048356420714005796,
"volume": 124.07866238665136,
"volume_molar": 12.453652836748867,
"formula_full": "Co2 Sb4",
"formula_reduced": "CoSb2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8762610333333336,
"spacegroup": 58
},
{
"id": "jvasp-86377",
"created_at": "2022-09-04T14:35:58.603615Z",
"updated_at": "2022-09-04T14:35:58.603635Z",
"structure_string": "Ce7 O12\n1.0\n6.679356 -0.017567 -1.117982\n-1.317814 6.548089 -1.117983\n-0.014423 -0.017567 6.772257\nCe O\n7 12\ndirect\n0.000000 0.000000 0.000000 Ce\n0.138827 0.600910 0.299492 Ce\n0.299492 0.138826 0.600910 Ce\n0.399091 0.700508 0.861175 Ce\n0.861175 0.399089 0.700509 Ce\n0.700509 0.861173 0.399091 Ce\n0.600910 0.299492 0.138827 Ce\n0.566231 0.417885 0.822316 O\n0.417886 0.822315 0.566231 O\n0.932094 0.072310 0.678398 O\n0.582115 0.177684 0.433770 O\n0.822316 0.566230 0.417886 O\n0.321603 0.067906 0.927690 O\n0.927690 0.321602 0.067907 O\n0.067908 0.927689 0.321603 O\n0.678399 0.932093 0.072311 O\n0.072311 0.678397 0.932094 O\n0.433770 0.582115 0.177685 O\n0.177685 0.433769 0.582115 O\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Ce",
"O"
],
"chemical_system": "Ce-O",
"density": 6.584276511871063,
"density_atomic": 0.06423723363411274,
"volume": 295.7786150664835,
"volume_molar": 9.374844493306425,
"formula_full": "Ce7 O12",
"formula_reduced": "Ce7O12",
"formula_anonymous": "A7B12",
"energy_above_hull": 2.754658289473684,
"spacegroup": 148
},
{
"id": "jvasp-92698",
"created_at": "2022-09-04T14:35:58.609378Z",
"updated_at": "2022-09-04T14:35:58.609401Z",
"structure_string": "Ga2 Te3\n1.0\n-2.091215 -3.622090 -0.000000\n2.091215 -3.622090 -0.000000\n-0.000000 -2.414727 9.090192\nGa Te\n2 3\ndirect\n0.194314 0.194314 0.417058 Ga\n0.805686 0.805686 0.582942 Ga\n0.000000 0.000000 0.000000 Te\n0.412532 0.412532 0.762406 Te\n0.587469 0.587469 0.237594 Te\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ga",
"Te"
],
"chemical_system": "Ga-Te",
"density": 6.297428497615737,
"density_atomic": 0.036308560383213104,
"volume": 137.70857195185573,
"volume_molar": 16.586008083053265,
"formula_full": "Ga2 Te3",
"formula_reduced": "Ga2Te3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.4468536244444445,
"spacegroup": 166
},
{
"id": "jvasp-68274",
"created_at": "2022-09-04T14:35:58.611643Z",
"updated_at": "2022-09-04T14:35:58.611688Z",
"structure_string": "Sc2 Be1 Ru1\n1.0\n3.124645 -0.000000 0.000000\n-0.000000 3.124645 -0.000000\n-0.000000 0.000000 6.953154\nSc Be Ru\n2 1 1\ndirect\n0.000000 0.000000 0.941528 Sc\n0.499999 0.499999 0.317330 Sc\n0.000000 0.000000 0.559369 Be\n0.499999 0.499999 0.681772 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Ru"
],
"chemical_system": "Be-Ru-Sc",
"density": 4.891959610771105,
"density_atomic": 0.05892190464644061,
"volume": 67.88646809708374,
"volume_molar": 10.22054666449719,
"formula_full": "Sc2 Be1 Ru1",
"formula_reduced": "Sc2BeRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8081142750000003,
"spacegroup": 99
}
]
}