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=1269",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=1267",
"results": [
{
"id": "jvasp-97013",
"created_at": "2022-09-04T14:36:31.357282Z",
"updated_at": "2022-09-04T14:36:31.357299Z",
"structure_string": "Li4 Al4 Si4 H8 O20\n1.0\n10.547526 0.000000 0.000000\n0.000000 8.136637 0.000000\n0.000000 0.000000 4.980353\nLi Al Si H O\n4 4 4 8 20\ndirect\n0.811682 0.319878 0.751440 Li\n0.188318 0.680122 0.251440 Li\n0.688319 0.819878 0.251440 Li\n0.311682 0.180122 0.751440 Li\n0.655936 0.417430 0.245452 Al\n0.344065 0.582570 0.745452 Al\n0.844065 0.917431 0.745452 Al\n0.155935 0.082570 0.245452 Al\n0.858019 0.128774 0.244335 Si\n0.141981 0.871227 0.744335 Si\n0.641981 0.628774 0.744335 Si\n0.358019 0.371226 0.244335 Si\n0.482310 0.958693 0.113332 H\n0.982310 0.541308 0.113332 H\n0.017690 0.458693 0.613332 H\n0.517690 0.041308 0.613332 H\n0.469651 0.829197 0.360903 H\n0.969651 0.670804 0.360903 H\n0.030349 0.329196 0.860902 H\n0.530349 0.170804 0.860902 H\n0.019616 0.579720 0.284751 O\n0.980384 0.420281 0.784751 O\n0.170540 0.893330 0.067190 O\n0.829460 0.106671 0.567189 O\n0.329460 0.393330 0.567189 O\n0.670541 0.606671 0.067190 O\n0.184009 0.042761 0.590099 O\n0.815991 0.957240 0.090099 O\n0.315991 0.542761 0.090099 O\n0.272818 0.218817 0.127007 O\n0.727182 0.781184 0.627006 O\n0.227182 0.718817 0.627006 O\n0.772818 0.281184 0.127007 O\n0.006646 0.167826 0.179189 O\n0.993354 0.832174 0.679189 O\n0.493354 0.667826 0.679189 O\n0.506647 0.332174 0.179189 O\n0.519617 0.920281 0.284751 O\n0.684009 0.457239 0.590099 O\n0.480384 0.079719 0.784751 O\n",
"nsites": 40,
"nelements": 5,
"elements": [
"Li",
"Al",
"Si",
"H",
"O"
],
"chemical_system": "Al-H-Li-O-Si",
"density": 2.2380974560215425,
"density_atomic": 0.09358458514524011,
"volume": 427.4208186948882,
"volume_molar": 6.4349708348376415,
"formula_full": "Li4 Al4 Si4 H8 O20",
"formula_reduced": "LiAlSiH2O5",
"formula_anonymous": "ABCD2E5",
"energy_above_hull": 2.48131389,
"spacegroup": 33
},
{
"id": "jvasp-93253",
"created_at": "2022-09-04T14:36:31.364363Z",
"updated_at": "2022-09-04T14:36:31.364392Z",
"structure_string": "La1 Sc1 O3\n1.0\n4.063373 -0.000000 -0.000000\n-0.000000 4.063373 -0.000000\n0.000000 0.000000 4.063373\nLa Sc O\n1 1 3\ndirect\n0.499999 0.499999 0.499999 La\n0.000000 0.000000 0.000000 Sc\n0.499999 0.000000 0.000000 O\n0.000000 0.499999 0.000000 O\n0.000000 0.000000 0.499999 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"La",
"Sc",
"O"
],
"chemical_system": "La-O-Sc",
"density": 5.738707302611396,
"density_atomic": 0.07452636391087063,
"volume": 67.0903521602063,
"volume_molar": 8.080550886934647,
"formula_full": "La1 Sc1 O3",
"formula_reduced": "LaScO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.77157215,
"spacegroup": 221
},
{
"id": "jvasp-96891",
"created_at": "2022-09-04T14:36:31.371375Z",
"updated_at": "2022-09-04T14:36:31.371396Z",
"structure_string": "Zn8 As16\n1.0\n7.768872 0.000000 0.000000\n0.000000 7.931889 -1.739809\n0.000000 -0.018556 9.399148\nZn As\n8 16\ndirect\n0.749460 0.393916 0.079911 Zn\n0.249460 0.106083 0.920089 Zn\n0.250540 0.606083 0.920088 Zn\n0.750540 0.893916 0.079911 Zn\n0.101311 0.223423 0.389329 Zn\n0.601311 0.276577 0.610671 Zn\n0.898689 0.776577 0.610671 Zn\n0.398689 0.723423 0.389329 Zn\n0.755702 0.107231 0.932431 As\n0.255702 0.392769 0.067569 As\n0.006281 0.937651 0.244009 As\n0.506281 0.562349 0.755990 As\n0.993719 0.062349 0.755990 As\n0.493719 0.437651 0.244010 As\n0.489004 0.932040 0.238399 As\n0.074802 0.719624 0.385640 As\n0.510995 0.067959 0.761601 As\n0.010996 0.432040 0.238399 As\n0.744297 0.607231 0.932431 As\n0.574802 0.780375 0.614360 As\n0.925198 0.280375 0.614360 As\n0.425198 0.219624 0.385640 As\n0.989004 0.567960 0.761601 As\n0.244298 0.892769 0.067569 As\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Zn",
"As"
],
"chemical_system": "As-Zn",
"density": 4.939144199444686,
"density_atomic": 0.04145493743609457,
"volume": 578.9418941229264,
"volume_molar": 14.526956576122,
"formula_full": "Zn8 As16",
"formula_reduced": "ZnAs2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8688918888888888,
"spacegroup": 14
},
{
"id": "jvasp-77158",
"created_at": "2022-09-04T14:36:31.371770Z",
"updated_at": "2022-09-04T14:36:31.371800Z",
"structure_string": "Ag1 Sn1 Rh2\n1.0\n-9.375454 0.000000 -5.412922\n-5.955721 -0.996261 -0.510232\n-4.640749 2.723039 -2.787829\nAg Sn Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 -0.000000 -0.000000 Sn\n0.734701 -0.000000 1.000000 Rh\n0.265298 1.000000 0.000001 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"Sn",
"Rh"
],
"chemical_system": "Ag-Rh-Sn",
"density": 9.736175759018526,
"density_atomic": 0.05424059704097289,
"volume": 73.74550093868682,
"volume_molar": 11.102644676737103,
"formula_full": "Ag1 Sn1 Rh2",
"formula_reduced": "AgSnRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.60150624,
"spacegroup": 71
},
{
"id": "jvasp-50914",
"created_at": "2022-09-04T14:36:31.373894Z",
"updated_at": "2022-09-04T14:36:31.373911Z",
"structure_string": "Pr2 As2 O8\n1.0\n-2.595363 2.595363 5.882783\n2.595363 -2.595363 5.882783\n2.595363 2.595363 -5.882783\nPr As O\n2 2 8\ndirect\n0.500000 0.500000 0.000000 Pr\n0.250000 0.749999 0.499999 Pr\n0.000000 0.000000 0.000000 As\n0.749999 0.250000 0.499999 As\n0.675415 0.058437 0.889482 O\n0.581045 0.464066 0.389482 O\n0.808437 0.418954 0.883019 O\n0.214066 0.324584 0.383020 O\n0.941562 0.831045 0.616979 O\n0.535933 0.925416 0.116980 O\n0.074584 0.191562 0.610517 O\n0.168955 0.785933 0.110517 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Pr",
"As",
"O"
],
"chemical_system": "As-O-Pr",
"density": 5.863128854552854,
"density_atomic": 0.07570807576543157,
"volume": 158.50356621372777,
"volume_molar": 7.954423222508741,
"formula_full": "Pr2 As2 O8",
"formula_reduced": "PrAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.111105933333333,
"spacegroup": 88
},
{
"id": "jvasp-100309",
"created_at": "2022-09-04T14:36:31.378292Z",
"updated_at": "2022-09-04T14:36:31.378316Z",
"structure_string": "Ba8 Pt2\n1.0\n8.062161 0.000000 4.654691\n2.687387 7.601079 4.654691\n-0.000000 -0.000000 9.309382\nBa Pt\n8 2\ndirect\n0.379398 0.379398 0.379398 Ba\n0.379398 0.379398 0.861807 Ba\n0.379398 0.861808 0.379397 Ba\n0.870602 0.870602 0.388192 Ba\n0.870602 0.870602 0.870602 Ba\n0.861808 0.379398 0.379397 Ba\n0.870602 0.388192 0.870602 Ba\n0.388193 0.870602 0.870602 Ba\n0.000000 0.000000 0.000000 Pt\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Ba",
"Pt"
],
"chemical_system": "Ba-Pt",
"density": 4.333444370614064,
"density_atomic": 0.017528810078887153,
"volume": 570.4893803398928,
"volume_molar": 34.35567350492011,
"formula_full": "Ba8 Pt2",
"formula_reduced": "Ba4Pt",
"formula_anonymous": "AB4",
"energy_above_hull": 0.314133056,
"spacegroup": 227
},
{
"id": "jvasp-51287",
"created_at": "2022-09-04T14:36:31.381441Z",
"updated_at": "2022-09-04T14:36:31.381464Z",
"structure_string": "Tl1 Co1 Bi1\n1.0\n-0.000001 3.490747 3.490746\n3.490745 -0.000001 3.490746\n3.490745 3.490747 -0.000001\nTl Co Bi\n1 1 1\ndirect\n0.500002 0.500000 0.499999 Tl\n0.000000 0.000000 0.000000 Co\n0.250001 0.250000 0.250000 Bi\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tl",
"Co",
"Bi"
],
"chemical_system": "Bi-Co-Tl",
"density": 9.218903277445152,
"density_atomic": 0.035264385895731366,
"volume": 85.07166433779129,
"volume_molar": 17.077117910988378,
"formula_full": "Tl1 Co1 Bi1",
"formula_reduced": "TlCoBi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3438126000000004,
"spacegroup": 216
},
{
"id": "jvasp-100984",
"created_at": "2022-09-04T14:36:31.381883Z",
"updated_at": "2022-09-04T14:36:31.381913Z",
"structure_string": "Ho2 Mg4\n1.0\n5.163631 -0.000000 2.981224\n1.721210 4.868318 2.981224\n-0.000000 -0.000000 5.962448\nHo Mg\n2 4\ndirect\n0.750000 0.750000 0.749999 Ho\n0.500000 0.500000 0.500000 Ho\n0.125000 0.625000 0.125000 Mg\n0.125000 0.125000 0.125000 Mg\n0.625000 0.125000 0.125000 Mg\n0.125000 0.125000 0.625000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ho",
"Mg"
],
"chemical_system": "Ho-Mg",
"density": 4.731515200916325,
"density_atomic": 0.04003063762081745,
"volume": 149.88519685431572,
"volume_molar": 15.043829221616642,
"formula_full": "Ho2 Mg4",
"formula_reduced": "HoMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3133991133333335,
"spacegroup": 227
},
{
"id": "jvasp-94960",
"created_at": "2022-09-04T14:36:31.384508Z",
"updated_at": "2022-09-04T14:36:31.384522Z",
"structure_string": "Hg1 B6\n1.0\n4.200499 0.000000 0.000000\n-0.000000 4.200499 -0.000000\n0.000000 -0.000000 4.200499\nHg B\n1 6\ndirect\n0.000000 0.000000 0.000000 Hg\n0.199068 0.500000 0.500000 B\n0.500000 0.500000 0.800932 B\n0.500000 0.500000 0.199068 B\n0.500000 0.199068 0.500000 B\n0.500000 0.800932 0.500000 B\n0.800932 0.500000 0.500000 B\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Hg",
"B"
],
"chemical_system": "B-Hg",
"density": 5.947562116052138,
"density_atomic": 0.09444856917101489,
"volume": 74.11441021753683,
"volume_molar": 6.376105866776986,
"formula_full": "Hg1 B6",
"formula_reduced": "HgB6",
"formula_anonymous": "AB6",
"energy_above_hull": 4.1635743,
"spacegroup": 221
},
{
"id": "jvasp-50881",
"created_at": "2022-09-04T14:36:31.385664Z",
"updated_at": "2022-09-04T14:36:31.385693Z",
"structure_string": "Ba1 Y2 F8\n1.0\n5.421802 0.000000 0.000000\n0.000000 5.421657 0.000000\n0.000000 0.000000 6.334952\nBa Y F\n1 2 8\ndirect\n0.000000 0.999692 0.500000 Ba\n0.500000 0.999652 0.000000 Y\n0.000000 0.499659 0.000000 Y\n0.752715 0.246955 0.799276 F\n0.247284 0.246955 0.200724 F\n0.752715 0.246955 0.200724 F\n0.247284 0.246955 0.799276 F\n0.752714 0.752385 0.799273 F\n0.752714 0.752385 0.200727 F\n0.247286 0.752385 0.799273 F\n0.247286 0.752385 0.200727 F\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Ba",
"Y",
"F"
],
"chemical_system": "Ba-F-Y",
"density": 4.165470357676678,
"density_atomic": 0.05907091044493699,
"volume": 186.2168691348284,
"volume_molar": 10.194765434694874,
"formula_full": "Ba1 Y2 F8",
"formula_reduced": "BaY2F8",
"formula_anonymous": "AB2C8",
"energy_above_hull": 0.2901623906818182,
"spacegroup": 123
},
{
"id": "jvasp-100260",
"created_at": "2022-09-04T14:36:31.387687Z",
"updated_at": "2022-09-04T14:36:31.387715Z",
"structure_string": "Yb1 Al1 Ag2\n1.0\n4.160433 -0.000000 2.402027\n1.386811 3.922494 2.402027\n-0.000000 -0.000000 4.804054\nYb Al Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500001 Al\n0.749999 0.749999 0.750001 Ag\n0.250000 0.250000 0.250000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Al",
"Ag"
],
"chemical_system": "Ag-Al-Yb",
"density": 8.806045946338072,
"density_atomic": 0.0510212730270659,
"volume": 78.39867103821713,
"volume_molar": 11.803195809726974,
"formula_full": "Yb1 Al1 Ag2",
"formula_reduced": "YbAlAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.002497005,
"spacegroup": 225
},
{
"id": "jvasp-93607",
"created_at": "2022-09-04T14:36:31.396783Z",
"updated_at": "2022-09-04T14:36:31.396813Z",
"structure_string": "U1 Cu4 Pd1\n1.0\n-3.542016 -3.542016 -0.000000\n-3.542016 -0.000000 -3.542016\n0.000000 -3.542016 -3.542016\nU Cu Pd\n1 4 1\ndirect\n0.000000 0.000000 0.000000 U\n0.871759 0.376081 0.376081 Cu\n0.376081 0.871759 0.376081 Cu\n0.376081 0.376081 0.871759 Cu\n0.376081 0.376081 0.376081 Cu\n0.750001 0.750001 0.750001 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"U",
"Cu",
"Pd"
],
"chemical_system": "Cu-Pd-U",
"density": 11.184797727130162,
"density_atomic": 0.06751024728144284,
"volume": 88.8753965747845,
"volume_molar": 8.920335804569568,
"formula_full": "U1 Cu4 Pd1",
"formula_reduced": "UCu4Pd",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.0834622500000004,
"spacegroup": 216
}
]
}