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=1151",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=1149",
"results": [
{
"id": "jvasp-123616",
"created_at": "2022-09-04T14:38:54.144972Z",
"updated_at": "2022-09-04T14:38:54.144997Z",
"structure_string": "Sc1 P3\n1.0\n3.365482 -0.000000 -1.077670\n-0.042133 3.837018 -0.131579\n-0.142501 -0.204947 5.348888\nSc P\n1 3\ndirect\n0.339401 -0.024704 0.678804 Sc\n0.621458 0.069102 0.242915 P\n0.128541 0.461539 0.257080 P\n0.910600 0.494062 0.821202 P\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sc",
"P"
],
"chemical_system": "P-Sc",
"density": 3.348056290881171,
"density_atomic": 0.05849398321267779,
"volume": 68.38310165092422,
"volume_molar": 10.29531659368135,
"formula_full": "Sc1 P3",
"formula_reduced": "ScP3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.6999204375000003,
"spacegroup": 8
},
{
"id": "jvasp-35163",
"created_at": "2022-09-04T14:37:28.277936Z",
"updated_at": "2022-09-04T14:37:28.277946Z",
"structure_string": "Li14 P2 N6 O3\n1.0\n2.822296 -4.888360 -0.000000\n2.822296 4.888360 0.000000\n-0.000000 0.000000 7.973322\nLi P N O\n14 2 6 3\ndirect\n0.377681 0.082186 0.091063 Li\n0.000000 0.000000 0.750585 Li\n0.353797 0.305690 0.410751 Li\n0.694311 0.048108 0.410751 Li\n0.951894 0.646205 0.410751 Li\n0.646205 0.694312 0.589249 Li\n0.305690 0.951894 0.589249 Li\n0.000000 0.000000 0.249415 Li\n0.082186 0.704505 0.908937 Li\n0.295496 0.377681 0.908937 Li\n0.622320 0.917816 0.908937 Li\n0.917815 0.295496 0.091063 Li\n0.704506 0.622320 0.091063 Li\n0.048107 0.353797 0.589249 Li\n0.666668 0.333334 0.772838 P\n0.333334 0.666668 0.227162 P\n0.068824 0.693599 0.174647 N\n0.306402 0.375225 0.174647 N\n0.624776 0.931178 0.174647 N\n0.375225 0.068824 0.825353 N\n0.693600 0.624776 0.825353 N\n0.931177 0.306402 0.825353 N\n0.333334 0.666668 0.449374 O\n0.666668 0.333334 0.550625 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 25,
"nelements": 4,
"elements": [
"Li",
"P",
"N",
"O"
],
"chemical_system": "Li-N-O-P",
"density": 2.197584857346198,
"density_atomic": 0.1136331295679687,
"volume": 220.00626133460895,
"volume_molar": 5.299634695353443,
"formula_full": "Li14 P2 N6 O3",
"formula_reduced": "Li14P2(N2O)3",
"formula_anonymous": "A2B3C6D14",
"energy_above_hull": 2.69980124,
"spacegroup": 147
},
{
"id": "jvasp-118989",
"created_at": "2022-09-04T14:38:31.795999Z",
"updated_at": "2022-09-04T14:38:31.796027Z",
"structure_string": "Li6 Mn3 Co1 O10\n1.0\n10.427397 -0.040496 1.375294\n10.051823 2.773641 1.375294\n-0.030972 -0.004133 5.816657\nLi Mn Co O\n6 3 1 10\ndirect\n0.401463 0.401462 0.297696 Li\n0.192276 0.192278 0.913096 Li\n0.794976 0.794973 0.109195 Li\n0.599406 0.599406 0.700353 Li\n0.009028 0.009029 0.484887 Li\n0.600500 0.600498 0.198118 Li\n0.004037 0.004037 0.003075 Mn\n0.799861 0.799859 0.598155 Mn\n0.400965 0.400965 0.799914 Mn\n0.189178 0.189178 0.392328 Co\n0.497844 0.497843 0.224622 O\n0.307284 0.307285 0.829455 O\n0.903317 0.903314 0.025966 O\n0.710420 0.710419 0.639166 O\n0.101874 0.101875 0.455563 O\n0.304040 0.304039 0.375525 O\n0.089934 0.089936 0.951613 O\n0.701678 0.701676 0.158338 O\n0.494175 0.494175 0.770571 O\n0.897751 0.897749 0.572362 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.137649724207645,
"density_atomic": 0.11715209789329913,
"volume": 170.71824030172968,
"volume_molar": 5.140446366982606,
"formula_full": "Li6 Mn3 Co1 O10",
"formula_reduced": "Li6Mn3CoO10",
"formula_anonymous": "AB3C6D10",
"energy_above_hull": 2.6997833812068963,
"spacegroup": 8
},
{
"id": "jvasp-21681",
"created_at": "2022-09-04T14:37:27.420360Z",
"updated_at": "2022-09-04T14:37:27.420382Z",
"structure_string": "Sc6 Si6 Ni4\n1.0\n3.984150 0.000000 0.000000\n-1.992074 4.844958 0.000000\n0.000000 0.000000 13.147496\nSc Si Ni\n6 6 4\ndirect\n0.082852 0.165704 0.888309 Sc\n0.917149 0.834297 0.111691 Sc\n0.917149 0.834297 0.388309 Sc\n0.361139 0.722277 0.750000 Sc\n0.082852 0.165704 0.611692 Sc\n0.638862 0.277724 0.250000 Sc\n0.342086 0.684171 0.250000 Si\n0.657915 0.315830 0.750000 Si\n0.383073 0.766144 0.539093 Si\n0.616928 0.233856 0.460907 Si\n0.616928 0.233856 0.039093 Si\n0.383073 0.766144 0.960907 Si\n0.207782 0.415563 0.402731 Ni\n0.792219 0.584437 0.597270 Ni\n0.207782 0.415563 0.097270 Ni\n0.792219 0.584437 0.902731 Ni\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sc",
"Si",
"Ni"
],
"chemical_system": "Ni-Sc-Si",
"density": 4.4036182197701175,
"density_atomic": 0.06304508546797434,
"volume": 253.78663350575812,
"volume_molar": 9.552117687363799,
"formula_full": "Sc6 Si6 Ni4",
"formula_reduced": "Sc3Si3Ni2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 2.69975454375,
"spacegroup": 63
},
{
"id": "jvasp-37176",
"created_at": "2022-09-04T14:38:02.163059Z",
"updated_at": "2022-09-04T14:38:02.163086Z",
"structure_string": "Mo2 Pt2\n1.0\n2.754652 0.000000 0.000000\n0.000000 4.505236 -0.000000\n0.000000 0.000000 4.972686\nMo Pt\n2 2\ndirect\n0.000000 0.750001 0.163115 Mo\n0.000000 0.250000 0.836886 Mo\n0.500000 0.750001 0.665072 Pt\n0.500000 0.250000 0.334928 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mo",
"Pt"
],
"chemical_system": "Mo-Pt",
"density": 15.66147187461184,
"density_atomic": 0.06481636440313308,
"volume": 61.71281028848709,
"volume_molar": 9.291080756311137,
"formula_full": "Mo2 Pt2",
"formula_reduced": "MoPt",
"formula_anonymous": "AB",
"energy_above_hull": 2.69971365,
"spacegroup": 51
},
{
"id": "jvasp-115366",
"created_at": "2022-09-04T14:38:46.004014Z",
"updated_at": "2022-09-04T14:38:46.004051Z",
"structure_string": "Ti1 P1 S1\n1.0\n3.092444 -0.000000 0.000000\n0.000000 3.092444 -0.000000\n-0.000000 0.000000 6.580055\nTi P S\n1 1 1\ndirect\n0.000000 0.000000 0.665856 Ti\n0.000000 0.000000 0.308768 P\n0.000000 0.000000 0.012747 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"P",
"S"
],
"chemical_system": "P-S-Ti",
"density": 2.926644663368448,
"density_atomic": 0.04767470816367048,
"volume": 62.926447073378995,
"volume_molar": 12.631730726752611,
"formula_full": "Ti1 P1 S1",
"formula_reduced": "TiPS",
"formula_anonymous": "ABC",
"energy_above_hull": 2.6996179444444444,
"spacegroup": 99
},
{
"id": "jvasp-55538",
"created_at": "2022-09-04T14:36:35.527037Z",
"updated_at": "2022-09-04T14:36:35.527061Z",
"structure_string": "Sb4 Pt4 O14\n1.0\n6.356101 0.000000 3.669696\n2.118700 5.992588 3.669696\n0.000000 0.000000 7.339393\nSb Pt O\n4 4 14\ndirect\n0.500000 0.500000 0.500000 Sb\n0.500000 0.500000 0.000000 Sb\n-0.000000 0.500000 0.500000 Sb\n0.500000 -0.000000 0.500000 Sb\n0.000000 0.000000 0.000000 Pt\n0.500000 -0.000000 0.000000 Pt\n-0.000000 0.500000 0.000000 Pt\n0.000000 0.000000 0.500000 Pt\n0.334814 0.915186 0.334814 O\n0.915186 0.334814 0.915186 O\n0.915186 0.334814 0.334814 O\n0.625000 0.625000 0.625000 O\n0.665186 0.084814 0.084814 O\n0.084814 0.665186 0.084814 O\n0.084814 0.084814 0.665186 O\n0.665186 0.665186 0.084815 O\n0.665186 0.084814 0.665186 O\n0.334814 0.915186 0.915186 O\n0.084814 0.665186 0.665186 O\n0.375000 0.375000 0.375000 O\n0.915186 0.915186 0.334815 O\n0.334814 0.334814 0.915186 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sb",
"Pt",
"O"
],
"chemical_system": "O-Pt-Sb",
"density": 8.85866845380186,
"density_atomic": 0.0786968460797225,
"volume": 279.5537698894982,
"volume_molar": 7.652327964832764,
"formula_full": "Sb4 Pt4 O14",
"formula_reduced": "Sb2Pt2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.6995199545454542,
"spacegroup": 227
},
{
"id": "jvasp-90425",
"created_at": "2022-09-04T14:36:19.371994Z",
"updated_at": "2022-09-04T14:36:19.372025Z",
"structure_string": "Sc2 Al2 C2 O2\n1.0\n-1.627355 -2.818662 0.000000\n-1.627355 2.818662 0.000000\n0.000000 0.000000 -10.248283\nSc Al C O\n2 2 2 2\ndirect\n0.666671 0.333332 0.804318 Sc\n0.333332 0.666671 0.304318 Sc\n0.000006 0.999997 0.520306 Al\n0.999997 0.000006 0.020306 Al\n0.333332 0.666671 0.941615 C\n0.666671 0.333332 0.441615 C\n0.000005 0.999997 0.697082 O\n0.999997 0.000005 0.197082 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Sc",
"Al",
"C",
"O"
],
"chemical_system": "Al-C-O-Sc",
"density": 3.53057010911865,
"density_atomic": 0.08509099038394492,
"volume": 94.0170041963626,
"volume_molar": 7.077295413800079,
"formula_full": "Sc2 Al2 C2 O2",
"formula_reduced": "ScAlCO",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.6992403875,
"spacegroup": 186
},
{
"id": "jvasp-100027",
"created_at": "2022-09-04T14:36:45.192451Z",
"updated_at": "2022-09-04T14:36:45.192471Z",
"structure_string": "Ca1 Eu1 H6 Ru1\n1.0\n4.398236 0.000000 2.539323\n1.466079 4.146697 2.539323\n0.000000 0.000000 5.078646\nCa Eu H Ru\n1 1 6 1\ndirect\n0.750001 0.750001 0.749999 Ca\n0.250000 0.250000 0.250000 Eu\n0.756484 0.756484 0.243516 H\n0.243517 0.756484 0.243516 H\n0.756484 0.243517 0.243516 H\n0.243517 0.243517 0.756483 H\n0.756484 0.243517 0.756483 H\n0.243517 0.756484 0.756483 H\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Ca",
"Eu",
"H",
"Ru"
],
"chemical_system": "Ca-Eu-H-Ru",
"density": 5.363191766682672,
"density_atomic": 0.09716586828924459,
"volume": 92.62511783673548,
"volume_molar": 6.197794416937864,
"formula_full": "Ca1 Eu1 H6 Ru1",
"formula_reduced": "CaEuH6Ru",
"formula_anonymous": "ABCD6",
"energy_above_hull": 2.6990967688888885,
"spacegroup": 216
},
{
"id": "jvasp-99126",
"created_at": "2022-09-04T14:36:09.304112Z",
"updated_at": "2022-09-04T14:36:09.304143Z",
"structure_string": "Sr2 Zr2 P4 O16\n1.0\n5.147244 0.002174 -0.518507\n-0.063749 7.758582 -0.352341\n-0.006451 -0.018027 7.898412\nSr Zr P O\n2 2 4 16\ndirect\n0.696871 0.523475 0.770924 Sr\n0.303128 0.476524 0.229075 Sr\n0.340198 0.973694 0.277581 Zr\n0.659801 0.026305 0.722418 Zr\n0.199453 0.788913 0.873471 P\n0.212666 0.252248 0.629895 P\n0.787333 0.747751 0.370104 P\n0.800547 0.211085 0.126528 P\n0.260803 0.415170 0.541407 O\n0.563141 0.187945 0.231187 O\n0.926339 0.227669 0.668094 O\n0.739196 0.584829 0.458593 O\n0.407815 0.242461 0.794567 O\n0.592184 0.757538 0.205432 O\n0.073660 0.772330 0.331905 O\n0.049663 0.168100 0.242149 O\n0.769684 0.079500 0.974445 O\n0.230315 0.920499 0.025554 O\n0.189609 0.601298 0.922321 O\n0.950336 0.831898 0.757850 O\n0.307450 0.082865 0.534758 O\n0.692549 0.917134 0.465241 O\n0.810390 0.398700 0.077678 O\n0.436858 0.812054 0.768812 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sr",
"Zr",
"P",
"O"
],
"chemical_system": "O-P-Sr-Zr",
"density": 3.8836272226866986,
"density_atomic": 0.0761017084849382,
"volume": 315.3674270630862,
"volume_molar": 7.913279320387243,
"formula_full": "Sr2 Zr2 P4 O16",
"formula_reduced": "SrZr(PO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 2.6990508175000003,
"spacegroup": 2
},
{
"id": "jvasp-111100",
"created_at": "2022-09-04T14:38:37.413820Z",
"updated_at": "2022-09-04T14:38:37.413846Z",
"structure_string": "Ca1 La1 Ge4 Ir4\n1.0\n4.214009 0.000000 0.000000\n0.000000 4.214009 0.000000\n0.000000 0.000000 10.523908\nCa La Ge Ir\n1 1 4 4\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 La\n0.500000 0.500000 0.121353 Ge\n0.000000 0.000000 0.628104 Ge\n0.000000 0.000000 0.371896 Ge\n0.500000 0.500000 0.878647 Ge\n-0.000000 0.500000 0.247631 Ir\n0.500000 0.000000 0.752369 Ir\n0.500000 0.000000 0.247631 Ir\n-0.000000 0.500000 0.752369 Ir\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ca",
"La",
"Ge",
"Ir"
],
"chemical_system": "Ca-Ge-Ir-La",
"density": 11.00388651409845,
"density_atomic": 0.0535096412809121,
"volume": 186.88220964709006,
"volume_molar": 11.254309720346065,
"formula_full": "Ca1 La1 Ge4 Ir4",
"formula_reduced": "CaLa(GeIr)4",
"formula_anonymous": "ABC4D4",
"energy_above_hull": 2.698915362,
"spacegroup": 123
},
{
"id": "jvasp-34742",
"created_at": "2022-09-04T14:37:11.602578Z",
"updated_at": "2022-09-04T14:37:11.602605Z",
"structure_string": "Dy2 Ta2 O8\n1.0\n4.775832 0.011822 -1.766981\n-1.289744 4.795994 -1.985932\n-0.028354 -0.017119 6.526926\nDy Ta O\n2 2 8\ndirect\n0.381225 0.631223 0.762448 Dy\n0.618776 0.368776 0.237553 Dy\n0.851985 0.101984 0.703970 Ta\n0.148016 0.898015 0.296031 Ta\n0.561369 0.274895 0.562313 O\n0.791622 0.631554 0.078646 O\n0.438632 0.725104 0.437688 O\n0.712977 0.052908 0.921355 O\n0.000945 0.787417 0.562313 O\n0.287024 0.947091 0.078646 O\n0.208378 0.368445 0.921355 O\n-0.000943 0.212582 0.437688 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Dy",
"Ta",
"O"
],
"chemical_system": "Dy-O-Ta",
"density": 9.072048620841347,
"density_atomic": 0.08045221725638069,
"volume": 149.15685868245325,
"volume_molar": 7.4853633192096805,
"formula_full": "Dy2 Ta2 O8",
"formula_reduced": "DyTaO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.698861616666666,
"spacegroup": 15
}
]
}