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=-energy_above_hull&page=861",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=859",
"results": [
{
"id": "jvasp-34377",
"created_at": "2022-09-04T14:37:13.204007Z",
"updated_at": "2022-09-04T14:37:13.204031Z",
"structure_string": "Sr1 Ta2 Bi2 O9\n1.0\n3.888016 0.000000 -0.600006\n-0.092594 3.886914 -0.600006\n-0.026612 -0.027253 12.724671\nSr Ta Bi O\n1 2 2 9\ndirect\n0.000000 0.000000 0.000000 Sr\n0.586065 0.586063 0.172127 Ta\n0.413938 0.413937 0.827873 Ta\n0.199970 0.199969 0.399937 Bi\n0.800033 0.800031 0.600063 Bi\n0.077260 0.577258 0.154518 O\n0.250001 0.750000 0.500000 O\n0.422743 0.922741 0.845481 O\n0.500001 0.500000 -0.000000 O\n0.922743 0.422742 0.845481 O\n0.337550 0.337549 0.675098 O\n0.577260 0.077259 0.154518 O\n0.750001 0.250000 0.500000 O\n0.662452 0.662450 0.324901 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Sr",
"Ta",
"Bi",
"O"
],
"chemical_system": "Bi-O-Sr-Ta",
"density": 8.739977761046003,
"density_atomic": 0.07285104092168944,
"volume": 192.17295762526126,
"volume_molar": 8.266375722034562,
"formula_full": "Sr1 Ta2 Bi2 O9",
"formula_reduced": "SrTa2Bi2O9",
"formula_anonymous": "AB2C2D9",
"energy_above_hull": 3.0254189149999995,
"spacegroup": 139
},
{
"id": "jvasp-19897",
"created_at": "2022-09-04T14:36:51.078924Z",
"updated_at": "2022-09-04T14:36:51.078933Z",
"structure_string": "Pu1 P1\n1.0\n3.468203 -0.000000 2.002368\n1.156068 3.269853 2.002368\n-0.000000 -0.000000 4.004735\nPu P\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.500000 0.500001 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pu",
"P"
],
"chemical_system": "P-Pu",
"density": 10.053883095869692,
"density_atomic": 0.044037582908608736,
"volume": 45.41575327035099,
"volume_molar": 13.6750029457742,
"formula_full": "Pu1 P1",
"formula_reduced": "PuP",
"formula_anonymous": "AB",
"energy_above_hull": 3.02541775,
"spacegroup": 225
},
{
"id": "jvasp-113727",
"created_at": "2022-09-04T14:38:46.880227Z",
"updated_at": "2022-09-04T14:38:46.880250Z",
"structure_string": "Ta1 Sb1 O1\n1.0\n2.961717 -0.000000 -0.000000\n0.000000 2.961717 0.000000\n0.000000 -0.000000 7.210271\nTa Sb O\n1 1 1\ndirect\n0.000000 0.000000 0.737946 Ta\n0.000000 0.000000 0.303954 Sb\n0.000000 0.000000 -0.015310 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ta",
"Sb",
"O"
],
"chemical_system": "O-Sb-Ta",
"density": 8.367628238705123,
"density_atomic": 0.04743321372977159,
"volume": 63.24682145913806,
"volume_molar": 12.696042048317267,
"formula_full": "Ta1 Sb1 O1",
"formula_reduced": "TaSbO",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0251129333333333,
"spacegroup": 99
},
{
"id": "jvasp-41190",
"created_at": "2022-09-04T14:37:44.935845Z",
"updated_at": "2022-09-04T14:37:44.935872Z",
"structure_string": "Mn1 Be2 Ir1\n1.0\n0.000000 2.769032 2.769032\n2.769032 0.000000 2.769032\n2.769032 2.769032 -0.000000\nMn Be Ir\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Mn\n0.499999 0.499999 0.499999 Be\n0.000000 0.000000 0.000000 Be\n0.250001 0.250001 0.250001 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Be",
"Ir"
],
"chemical_system": "Be-Ir-Mn",
"density": 10.369909738396192,
"density_atomic": 0.09419895212859111,
"volume": 42.46331736832481,
"volume_molar": 6.393001858215119,
"formula_full": "Mn1 Be2 Ir1",
"formula_reduced": "MnBe2Ir",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.025102635344827,
"spacegroup": 225
},
{
"id": "jvasp-102708",
"created_at": "2022-09-04T14:36:46.439900Z",
"updated_at": "2022-09-04T14:36:46.439928Z",
"structure_string": "Mo1 Pd2 Rh1\n1.0\n2.738827 0.002104 8.792522\n1.339468 2.388934 8.792522\n0.003588 0.002104 9.209214\nMo Pd Rh\n1 2 1\ndirect\n0.998171 0.998162 0.998165 Mo\n0.500739 0.500735 0.500736 Pd\n0.747987 0.747980 0.747983 Pd\n0.253113 0.253111 0.253112 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mo",
"Pd",
"Rh"
],
"chemical_system": "Mo-Pd-Rh",
"density": 11.369482501360606,
"density_atomic": 0.0665251742072157,
"volume": 60.12761405991384,
"volume_molar": 9.052423885793905,
"formula_full": "Mo1 Pd2 Rh1",
"formula_reduced": "MoPd2Rh",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.024957575,
"spacegroup": 160
},
{
"id": "jvasp-119377",
"created_at": "2022-09-04T14:38:50.946916Z",
"updated_at": "2022-09-04T14:38:50.946932Z",
"structure_string": "Dy2 W2 O8\n1.0\n4.806289 -0.008091 -4.564568\n-0.891693 4.722856 -4.564568\n0.006718 0.008091 6.628398\nDy W O\n2 2 8\ndirect\n0.250001 0.750001 0.500001 Dy\n0.500001 0.500001 0.000000 Dy\n0.000000 0.000000 0.000000 W\n0.750001 0.250000 0.500000 W\n0.090217 0.512614 0.933194 O\n0.907024 0.340217 0.077603 O\n0.262615 0.829421 0.922399 O\n0.170579 0.092977 0.433193 O\n0.579421 0.157023 0.066807 O\n0.487387 0.420579 0.577603 O\n0.842978 0.909785 0.422399 O\n0.659785 0.737387 0.566808 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Dy",
"W",
"O"
],
"chemical_system": "Dy-O-W",
"density": 9.038784415347855,
"density_atomic": 0.07959226558910991,
"volume": 150.7684184032309,
"volume_molar": 7.566238648223591,
"formula_full": "Dy2 W2 O8",
"formula_reduced": "DyWO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.0249467500000007,
"spacegroup": 88
},
{
"id": "jvasp-94280",
"created_at": "2022-09-04T14:36:16.577917Z",
"updated_at": "2022-09-04T14:36:16.577946Z",
"structure_string": "Mn4 Sb2\n1.0\n3.926128 -0.000000 0.000000\n-0.000000 3.926128 -0.000000\n0.000000 0.000000 6.409623\nMn Sb\n4 2\ndirect\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 0.271397 Mn\n0.000000 0.500000 0.728603 Mn\n0.500000 0.000000 0.703972 Sb\n0.000000 0.500000 0.296028 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mn",
"Sb"
],
"chemical_system": "Mn-Sb",
"density": 7.786170754310363,
"density_atomic": 0.06072812265142668,
"volume": 98.80101241461715,
"volume_molar": 9.9165600665222,
"formula_full": "Mn4 Sb2",
"formula_reduced": "Mn2Sb",
"formula_anonymous": "AB2",
"energy_above_hull": 3.024903527586207,
"spacegroup": 129
},
{
"id": "jvasp-17790",
"created_at": "2022-09-04T14:38:16.200700Z",
"updated_at": "2022-09-04T14:38:16.200732Z",
"structure_string": "Mn4 Sb2\n1.0\n3.926038 0.000000 -0.000000\n-0.000000 3.926038 0.000000\n-0.000000 0.000000 6.409852\nMn Sb\n4 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.271441 Mn\n0.500000 0.000000 0.728559 Mn\n0.000000 0.500000 0.704008 Sb\n0.500000 0.000000 0.295991 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mn",
"Sb"
],
"chemical_system": "Mn-Sb",
"density": 7.7862495533280365,
"density_atomic": 0.06072873724318957,
"volume": 98.80001252080818,
"volume_molar": 9.916459708167823,
"formula_full": "Mn4 Sb2",
"formula_reduced": "Mn2Sb",
"formula_anonymous": "AB2",
"energy_above_hull": 3.024880194252874,
"spacegroup": 129
},
{
"id": "jvasp-16213",
"created_at": "2022-09-04T14:36:47.700635Z",
"updated_at": "2022-09-04T14:36:47.700659Z",
"structure_string": "Mn3 Nb3 Ge3\n1.0\n3.236641 -5.606026 0.000000\n3.236641 5.606026 0.000000\n-0.000000 0.000000 3.666132\nMn Nb Ge\n3 3 3\ndirect\n0.242851 0.242851 0.000000 Mn\n-0.000000 0.757149 0.000000 Mn\n0.757149 -0.000000 0.000000 Mn\n0.416265 -0.000000 0.500000 Nb\n0.583735 0.583735 0.500000 Nb\n-0.000000 0.416265 0.500000 Nb\n0.666667 0.333333 0.000000 Ge\n0.000000 0.000000 0.500000 Ge\n0.333333 0.666667 0.000000 Ge\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Mn",
"Nb",
"Ge"
],
"chemical_system": "Ge-Mn-Nb",
"density": 8.255826096109862,
"density_atomic": 0.0676479713132158,
"volume": 133.04168366452916,
"volume_molar": 8.902174955279857,
"formula_full": "Mn3 Nb3 Ge3",
"formula_reduced": "MnNbGe",
"formula_anonymous": "ABC",
"energy_above_hull": 3.024674197126436,
"spacegroup": 189
},
{
"id": "jvasp-43824",
"created_at": "2022-09-04T14:35:53.711749Z",
"updated_at": "2022-09-04T14:35:53.711783Z",
"structure_string": "Mn6 O10 F2\n1.0\n0.000000 5.380850 0.029294\n4.499607 0.000000 0.000000\n0.000000 -0.507159 -7.384409\nMn O F\n6 10 2\ndirect\n0.074664 0.477215 0.835276 Mn\n0.408575 0.512863 0.163363 Mn\n0.748483 0.514416 0.511482 Mn\n0.591425 0.012863 0.836638 Mn\n0.251517 0.014416 0.488519 Mn\n0.925336 0.977215 0.164724 Mn\n0.622390 0.805943 0.066275 O\n0.955173 0.802752 0.397662 O\n0.120372 0.694377 0.059740 O\n0.453747 0.695665 0.398757 O\n0.786207 0.695553 0.735770 O\n0.213793 0.195553 0.264231 O\n0.377610 0.305943 0.933726 O\n0.879628 0.194377 0.940261 O\n0.546253 0.195665 0.601244 O\n0.044827 0.302751 0.602339 O\n0.718939 0.301219 0.269286 F\n0.281061 0.801219 0.730715 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.902197317017942,
"density_atomic": 0.10071489544770605,
"volume": 178.7223222541704,
"volume_molar": 5.979394342048304,
"formula_full": "Mn6 O10 F2",
"formula_reduced": "Mn3O5F",
"formula_anonymous": "AB3C5",
"energy_above_hull": 3.024615500737548,
"spacegroup": 4
},
{
"id": "jvasp-26877",
"created_at": "2022-09-04T14:38:31.005527Z",
"updated_at": "2022-09-04T14:38:31.005552Z",
"structure_string": "Pa8 H24\n1.0\n6.646952 0.000000 -0.000000\n0.000000 6.646952 0.000000\n-0.000000 0.000000 6.646952\nPa H\n8 24\ndirect\n0.000000 0.000000 0.000000 Pa\n0.500000 0.500000 0.500000 Pa\n0.250000 0.000000 0.500000 Pa\n0.750000 0.000000 0.500000 Pa\n0.000000 0.500000 0.250000 Pa\n0.000000 0.500000 0.750000 Pa\n0.500000 0.750000 0.000000 Pa\n0.500000 0.250000 0.000000 Pa\n0.695600 0.000000 0.844428 H\n0.155572 0.695600 0.000000 H\n0.000000 0.844428 0.695600 H\n0.000000 0.155572 0.695600 H\n0.804399 0.344428 0.500000 H\n0.655571 0.500000 0.195601 H\n0.344428 0.500000 0.195601 H\n0.695600 0.000000 0.155572 H\n0.195601 0.344428 0.500000 H\n0.000000 0.844428 0.304399 H\n0.844428 0.304399 0.000000 H\n0.304399 0.000000 0.155572 H\n0.844428 0.695600 0.000000 H\n0.155572 0.304399 0.000000 H\n0.500000 0.804399 0.655571 H\n0.655571 0.500000 0.804399 H\n0.344428 0.500000 0.804399 H\n0.195601 0.655571 0.500000 H\n0.804399 0.655571 0.500000 H\n0.500000 0.804399 0.344428 H\n0.500000 0.195601 0.655571 H\n0.000000 0.155572 0.304399 H\n0.304399 0.000000 0.844428 H\n0.500000 0.195601 0.344428 H\n",
"nsites": 32,
"nelements": 2,
"elements": [
"Pa",
"H"
],
"chemical_system": "H-Pa",
"density": 10.58761402905933,
"density_atomic": 0.10896382763471055,
"volume": 293.6754397732479,
"volume_molar": 5.5267338627168785,
"formula_full": "Pa8 H24",
"formula_reduced": "PaH3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.024515775,
"spacegroup": 223
},
{
"id": "jvasp-71902",
"created_at": "2022-09-04T14:35:58.649925Z",
"updated_at": "2022-09-04T14:35:58.649942Z",
"structure_string": "Ca1 Be1 W1\n1.0\n1.453260 -2.517121 -0.000000\n1.453260 2.517121 0.000000\n0.000000 0.000000 7.117758\nCa Be W\n1 1 1\ndirect\n0.666667 0.333333 0.326549 Ca\n0.000000 0.000000 0.973063 Be\n0.333333 0.666667 0.700389 W\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Be",
"W"
],
"chemical_system": "Be-Ca-W",
"density": 7.427697984479673,
"density_atomic": 0.05761036515323228,
"volume": 52.07396259372056,
"volume_molar": 10.45322442234533,
"formula_full": "Ca1 Be1 W1",
"formula_reduced": "CaBeW",
"formula_anonymous": "ABC",
"energy_above_hull": 3.024482173333334,
"spacegroup": 156
}
]
}