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=-id&page=478",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=476",
"results": [
{
"id": "jvasp-88037",
"created_at": "2022-09-04T14:36:06.746306Z",
"updated_at": "2022-09-04T14:36:06.746329Z",
"structure_string": "W4 O4 F16\n1.0\n5.043740 -0.024561 -0.280735\n-0.638604 7.735229 -3.194133\n-0.031304 0.004805 8.393036\nW O F\n4 4 16\ndirect\n0.238407 0.754961 0.754962 W\n0.761594 0.245038 0.245038 W\n0.000001 0.807445 0.192556 W\n1.000001 0.192555 0.807444 W\n0.879017 0.025761 0.219127 O\n0.120985 0.780872 0.974240 O\n0.120985 0.974239 0.780873 O\n0.879017 0.219127 0.025761 O\n0.330627 0.915688 0.306388 F\n0.090041 0.357354 0.357355 F\n0.575343 0.862555 0.862556 F\n0.122809 0.171413 0.594528 F\n0.639230 0.458181 0.269274 F\n0.360771 0.541819 0.730726 F\n0.424658 0.137445 0.137444 F\n0.877192 0.405471 0.828587 F\n0.877192 0.828587 0.405472 F\n0.122809 0.594528 0.171413 F\n0.330627 0.306387 0.915688 F\n0.669375 0.084312 0.693612 F\n0.909960 0.642645 0.642646 F\n0.639230 0.269274 0.458181 F\n0.360771 0.730726 0.541819 F\n0.669375 0.693613 0.084312 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"W",
"O",
"F"
],
"chemical_system": "F-O-W",
"density": 5.597248802372581,
"density_atomic": 0.07332136170238214,
"volume": 327.3261631094375,
"volume_molar": 8.213350952815633,
"formula_full": "W4 O4 F16",
"formula_reduced": "WOF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3587841050000002,
"spacegroup": 12
},
{
"id": "jvasp-88036",
"created_at": "2022-09-04T14:36:03.285545Z",
"updated_at": "2022-09-04T14:36:03.285579Z",
"structure_string": "Rb2 Nb2 Ge6 O18\n1.0\n7.124373 -0.000000 0.000000\n-3.562186 6.169889 -0.000000\n-0.000000 -0.000000 10.350850\nRb Nb Ge O\n2 2 6 18\ndirect\n0.666667 0.333333 0.000000 Rb\n0.666667 0.333333 0.500000 Rb\n0.333333 0.666667 0.000000 Nb\n0.333333 0.666667 0.500000 Nb\n0.073846 0.784597 0.750000 Ge\n0.710750 0.926154 0.750000 Ge\n0.215403 0.289249 0.750000 Ge\n0.215403 0.926154 0.250000 Ge\n0.073846 0.289249 0.250000 Ge\n0.710750 0.784597 0.250000 Ge\n0.560945 0.659002 0.110170 O\n0.098057 0.659002 0.610170 O\n0.340998 0.439055 0.610170 O\n0.098057 0.659002 0.889830 O\n0.340998 0.439055 0.889830 O\n0.560945 0.901943 0.889830 O\n0.340998 0.901943 0.110170 O\n0.560945 0.659002 0.389830 O\n0.801034 0.733271 0.750000 O\n0.098057 0.439055 0.110170 O\n0.266730 0.067764 0.750000 O\n0.932235 0.198966 0.750000 O\n0.098057 0.439055 0.389830 O\n0.801034 0.067764 0.250000 O\n0.932235 0.733271 0.250000 O\n0.266729 0.198966 0.250000 O\n0.340998 0.901943 0.389830 O\n0.560945 0.901943 0.610170 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Rb",
"Nb",
"Ge",
"O"
],
"chemical_system": "Ge-Nb-O-Rb",
"density": 3.94371050160231,
"density_atomic": 0.06154007431315775,
"volume": 454.98807585959287,
"volume_molar": 9.78572227481438,
"formula_full": "Rb2 Nb2 Ge6 O18",
"formula_reduced": "RbNb(GeO3)3",
"formula_anonymous": "ABC3D9",
"energy_above_hull": 2.3835734821428574,
"spacegroup": 188
},
{
"id": "jvasp-88031",
"created_at": "2022-09-04T14:35:59.421087Z",
"updated_at": "2022-09-04T14:35:59.421106Z",
"structure_string": "Cr2 O6\n1.0\n4.774903 0.000000 0.000000\n-2.387451 4.205092 0.000000\n0.000000 0.000000 5.760675\nCr O\n2 6\ndirect\n0.563683 0.795857 0.250000 Cr\n0.767825 0.204142 0.749999 Cr\n0.878945 0.763864 0.250000 O\n0.115081 0.236135 0.749999 O\n0.553068 0.000000 0.000000 O\n0.553068 0.000000 0.500000 O\n0.810260 0.552194 0.749999 O\n0.258066 0.447806 0.250000 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 2.8710510052577956,
"density_atomic": 0.06916343547092967,
"volume": 115.66805416082185,
"volume_molar": 8.707116294897162,
"formula_full": "Cr2 O6",
"formula_reduced": "CrO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.5733944750000006,
"spacegroup": 40
},
{
"id": "jvasp-8803",
"created_at": "2022-09-04T14:37:02.272340Z",
"updated_at": "2022-09-04T14:37:02.272363Z",
"structure_string": "Ag1 P1 F6\n1.0\n5.787864 -0.000000 -0.000000\n2.893932 5.012438 -0.000000\n2.893932 1.670813 4.725770\nAg P F\n1 1 6\ndirect\n0.499999 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 P\n0.199931 0.199931 0.800069 F\n0.199930 0.800069 0.199931 F\n0.199930 0.800069 0.800069 F\n0.800068 0.199931 0.199931 F\n0.800068 0.199931 0.800069 F\n0.800068 0.800069 0.199931 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ag",
"P",
"F"
],
"chemical_system": "Ag-F-P",
"density": 3.0622587189373367,
"density_atomic": 0.058351237979325274,
"volume": 137.10077587101958,
"volume_molar": 10.320502132506144,
"formula_full": "Ag1 P1 F6",
"formula_reduced": "AgPF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-88027",
"created_at": "2022-09-04T14:35:56.713722Z",
"updated_at": "2022-09-04T14:35:56.713743Z",
"structure_string": "Sr6 Cu2 Ir2 O12\n1.0\n6.742267 0.043354 -0.133473\n-0.140490 6.759185 -0.251228\n0.041571 0.046502 6.765024\nSr Cu Ir O\n6 2 2 12\ndirect\n0.750000 0.603280 0.396719 Sr\n0.250000 0.396719 0.603280 Sr\n0.618970 0.743139 0.890333 Sr\n0.881031 0.109665 0.256860 Sr\n0.381030 0.256860 0.109666 Sr\n0.118970 0.890333 0.743139 Sr\n0.250000 0.803682 0.196317 Cu\n0.750000 0.196316 0.803682 Cu\n0.000000 0.500000 -0.000000 Ir\n0.500000 -0.000000 0.500000 Ir\n0.073344 0.432617 0.280191 O\n0.426656 0.719807 0.567382 O\n0.717227 0.399860 0.035311 O\n0.782773 0.964688 0.600139 O\n0.282773 0.600138 0.964689 O\n0.539266 0.902319 0.216233 O\n0.039266 0.216232 0.902319 O\n0.460734 0.097680 0.783767 O\n0.960734 0.783766 0.097680 O\n0.573345 0.280191 0.432618 O\n0.217227 0.035310 0.399861 O\n0.926656 0.567381 0.719808 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Cu",
"Ir",
"O"
],
"chemical_system": "Cu-Ir-O-Sr",
"density": 6.617491128918842,
"density_atomic": 0.07132317882772594,
"volume": 308.4551244293081,
"volume_molar": 8.44345535207549,
"formula_full": "Sr6 Cu2 Ir2 O12",
"formula_reduced": "Sr3CuIrO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.6746746799999996,
"spacegroup": 15
},
{
"id": "jvasp-88026",
"created_at": "2022-09-04T14:35:53.007063Z",
"updated_at": "2022-09-04T14:35:53.007081Z",
"structure_string": "Y1 Cu1 W2 O8\n1.0\n4.644339 0.038238 -1.954388\n-1.124653 5.551552 -2.126274\n-0.053565 0.079973 6.063651\nY Cu W O\n1 1 2 8\ndirect\n0.624637 0.723179 0.099650 Y\n0.124936 0.223457 0.099848 Cu\n0.869107 0.396109 0.581673 W\n0.380209 0.050264 0.617657 W\n0.134944 0.656139 0.836229 O\n0.630477 0.511635 0.353885 O\n0.165650 0.199351 0.803178 O\n0.593193 0.053765 0.405640 O\n0.618723 0.934664 0.845387 O\n0.114296 0.790269 0.363087 O\n0.656131 0.392582 0.793693 O\n0.083694 0.247082 0.396171 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Y",
"Cu",
"W",
"O"
],
"chemical_system": "Cu-O-W-Y",
"density": 6.855455493928338,
"density_atomic": 0.07643782429254048,
"volume": 156.9903396788738,
"volume_molar": 7.878482695886594,
"formula_full": "Y1 Cu1 W2 O8",
"formula_reduced": "YCu(WO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 3.615197825,
"spacegroup": 2
},
{
"id": "jvasp-88025",
"created_at": "2022-09-04T14:35:46.486822Z",
"updated_at": "2022-09-04T14:35:46.486857Z",
"structure_string": "Ti4 Cd1 Cu3 O12\n1.0\n6.080239 0.000000 -2.149688\n-3.040120 5.265640 -2.149688\n-0.000000 -0.000000 6.449066\nTi Cd Cu O\n4 1 3 12\ndirect\n0.500000 0.500000 0.500000 Ti\n-0.000000 0.500000 -0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.500000 -0.000000 -0.000000 Ti\n0.000000 0.000000 0.000000 Cd\n-0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.500000 -0.000000 0.500000 Cu\n0.872957 0.177877 0.695080 O\n0.177877 0.304920 0.482798 O\n0.304920 0.482798 0.177877 O\n0.695080 0.517202 0.822123 O\n0.822123 0.304920 0.127043 O\n0.177877 0.695080 0.872957 O\n0.822123 0.695080 0.517202 O\n0.304920 0.127043 0.822123 O\n0.127043 0.822123 0.304920 O\n0.482798 0.177877 0.304920 O\n0.695080 0.872957 0.177877 O\n0.517202 0.822123 0.695080 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ti",
"Cd",
"Cu",
"O"
],
"chemical_system": "Cd-Cu-O-Ti",
"density": 5.521120201713475,
"density_atomic": 0.09686376806008674,
"volume": 206.47555221673346,
"volume_molar": 6.217124194739496,
"formula_full": "Ti4 Cd1 Cu3 O12",
"formula_reduced": "Ti4Cd(CuO4)3",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.484011321666667,
"spacegroup": 204
},
{
"id": "jvasp-88024",
"created_at": "2022-09-04T14:35:42.585906Z",
"updated_at": "2022-09-04T14:35:42.585918Z",
"structure_string": "Y8 Co2 B26\n1.0\n7.312410 0.000000 -0.000000\n-0.000000 7.312410 0.000000\n-0.000000 -0.000000 6.945812\nY Co B\n8 2 26\ndirect\n0.184059 0.681079 0.000000 Y\n0.318921 0.184059 0.000000 Y\n0.681079 0.815941 0.000000 Y\n0.684059 0.818921 0.500000 Y\n0.315941 0.181079 0.500000 Y\n0.815941 0.318921 0.000000 Y\n0.181079 0.684059 0.500000 Y\n0.818921 0.315941 0.500000 Y\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.460758 0.669768 0.245402 B\n0.960758 0.830232 0.254597 B\n0.669768 0.539242 0.245402 B\n0.330232 0.460758 0.245402 B\n0.960758 0.830232 0.745402 B\n0.039242 0.169768 0.745402 B\n0.830232 0.039242 0.745402 B\n0.460758 0.669768 0.754597 B\n0.539242 0.330232 0.754597 B\n0.539242 0.330232 0.245402 B\n0.169768 0.960758 0.745402 B\n0.169768 0.960758 0.254597 B\n0.908953 0.591047 0.750000 B\n0.039242 0.169768 0.254597 B\n0.408953 0.908953 0.750000 B\n0.091047 0.408953 0.750000 B\n0.330232 0.460758 0.754597 B\n0.591047 0.091047 0.750000 B\n0.591047 0.091047 0.250000 B\n0.908953 0.591047 0.250000 B\n0.091047 0.408953 0.250000 B\n0.408953 0.908953 0.250000 B\n0.500000 0.500000 0.000000 B\n0.000000 0.000000 0.500000 B\n0.830232 0.039242 0.254597 B\n0.669768 0.539242 0.754597 B\n",
"nsites": 36,
"nelements": 3,
"elements": [
"Y",
"Co",
"B"
],
"chemical_system": "B-Co-Y",
"density": 4.96370441394253,
"density_atomic": 0.09693004374796119,
"volume": 371.4018750843411,
"volume_molar": 6.212873250793997,
"formula_full": "Y8 Co2 B26",
"formula_reduced": "Y4CoB13",
"formula_anonymous": "AB4C13",
"energy_above_hull": 5.078959793518519,
"spacegroup": 128
},
{
"id": "jvasp-88021",
"created_at": "2022-09-04T14:36:13.168672Z",
"updated_at": "2022-09-04T14:36:13.168698Z",
"structure_string": "K8 Rb4 Co4 O10\n1.0\n6.720924 0.000000 0.000000\n0.000000 6.720924 0.000000\n0.000000 0.000000 11.644665\nK Rb Co O\n8 4 4 10\ndirect\n0.000000 0.000000 0.777671 K\n0.183898 0.816101 0.500000 K\n0.316101 0.316101 0.000000 K\n0.000000 0.500000 0.750000 K\n0.000000 0.500000 0.250000 K\n0.000000 0.000000 0.222329 K\n0.500000 0.500000 0.722329 K\n0.500000 0.500000 0.277671 K\n0.816101 0.183898 0.500000 Rb\n0.500000 0.000000 0.750000 Rb\n0.683898 0.683898 0.000000 Rb\n0.500000 0.000000 0.250000 Rb\n0.198041 0.801958 0.000000 Co\n0.698041 0.698041 0.500000 Co\n0.301958 0.301958 0.500000 Co\n0.801958 0.198041 0.000000 Co\n0.285542 0.714458 0.139788 O\n0.214458 0.214458 0.639788 O\n0.714458 0.285542 0.139788 O\n0.714458 0.285542 0.860212 O\n0.285542 0.714458 0.860212 O\n0.785541 0.785541 0.639788 O\n0.214458 0.214458 0.360212 O\n0.785541 0.785541 0.360212 O\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.500000 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"K",
"Rb",
"Co",
"O"
],
"chemical_system": "Co-K-O-Rb",
"density": 3.315983679585673,
"density_atomic": 0.04942974614340176,
"volume": 525.9990598489179,
"volume_molar": 12.183232223222491,
"formula_full": "K8 Rb4 Co4 O10",
"formula_reduced": "K4Rb2Co2O5",
"formula_anonymous": "A2B2C4D5",
"energy_above_hull": 1.1326054846153848,
"spacegroup": 6
},
{
"id": "jvasp-8802",
"created_at": "2022-09-04T14:37:02.790005Z",
"updated_at": "2022-09-04T14:37:02.790032Z",
"structure_string": "H4 I1 N1\n1.0\n4.951759 0.000000 0.000000\n2.475879 4.457464 -0.075326\n2.475879 1.414804 4.227648\nH I N\n4 1 1\ndirect\n0.132015 0.838877 0.161122 H\n0.132014 0.161122 0.838878 H\n0.772016 0.119208 0.119208 H\n0.010433 0.880791 0.880792 H\n0.494233 0.499999 0.500000 I\n0.008292 -0.000000 -0.000000 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"H",
"I",
"N"
],
"chemical_system": "H-I-N",
"density": 2.564784197601439,
"density_atomic": 0.0639375433999457,
"volume": 93.84157853029267,
"volume_molar": 9.41878658416694,
"formula_full": "H4 I1 N1",
"formula_reduced": "H4IN",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.730569920833334,
"spacegroup": 44
},
{
"id": "jvasp-88019",
"created_at": "2022-09-04T14:36:07.484604Z",
"updated_at": "2022-09-04T14:36:07.484631Z",
"structure_string": "Eu1 F2\n1.0\n3.449059 -0.000000 1.991314\n1.149687 3.251804 1.991314\n0.000000 0.000000 3.982631\nEu F\n1 2\ndirect\n0.000000 0.000000 0.000000 Eu\n0.250000 0.250000 0.249999 F\n0.750001 0.749999 0.749998 F\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Eu",
"F"
],
"chemical_system": "Eu-F",
"density": 7.061842831171446,
"density_atomic": 0.06716239898370098,
"volume": 44.66785054429104,
"volume_molar": 8.966536114145443,
"formula_full": "Eu1 F2",
"formula_reduced": "EuF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-88017",
"created_at": "2022-09-04T14:35:59.670975Z",
"updated_at": "2022-09-04T14:35:59.671004Z",
"structure_string": "Li2 Mn2 P2\n1.0\n3.809382 -0.000000 0.000000\n-0.000000 3.809382 0.000000\n0.000000 -0.000000 5.752220\nLi Mn P\n2 2 2\ndirect\n0.250000 0.750000 0.500000 Li\n0.750000 0.250000 0.500000 Li\n0.250000 0.750000 0.000000 Mn\n0.750000 0.250000 0.000000 Mn\n0.250000 0.250000 0.781522 P\n0.750000 0.750000 0.218478 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Mn",
"P"
],
"chemical_system": "Li-Mn-P",
"density": 3.6942781556697777,
"density_atomic": 0.07187977548505832,
"volume": 83.47271481457567,
"volume_molar": 8.3780739705452,
"formula_full": "Li2 Mn2 P2",
"formula_reduced": "LiMnP",
"formula_anonymous": "ABC",
"energy_above_hull": 2.1650509137931038,
"spacegroup": 129
}
]
}