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=4067",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4065",
"results": [
{
"id": "jvasp-43629",
"created_at": "2022-09-04T14:35:55.264016Z",
"updated_at": "2022-09-04T14:35:55.264056Z",
"structure_string": "Mg4 O4\n1.0\n1.633938 -2.830064 0.000000\n1.633938 2.830064 -0.000000\n0.000000 0.000000 10.470380\nMg O\n4 4\ndirect\n0.333334 0.666667 0.030475 Mg\n0.000000 0.000000 0.779184 Mg\n0.000000 0.000000 0.279184 Mg\n0.666667 0.333334 0.530475 Mg\n0.333334 0.666667 0.219985 O\n0.000000 0.000000 0.470357 O\n0.000000 0.000000 0.970357 O\n0.666667 0.333334 0.719985 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"O"
],
"chemical_system": "Mg-O",
"density": 2.7646316757362404,
"density_atomic": 0.08261629552402147,
"volume": 96.83319675927522,
"volume_molar": 7.289289264064141,
"formula_full": "Mg4 O4",
"formula_reduced": "MgO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0719199999999997,
"spacegroup": 186
},
{
"id": "jvasp-66296",
"created_at": "2022-09-04T14:35:51.675194Z",
"updated_at": "2022-09-04T14:35:51.675214Z",
"structure_string": "Ba1 Pb1 Cl1\n1.0\n-0.000000 4.033176 4.033176\n4.033176 -0.000000 4.033176\n4.033176 4.033176 0.000000\nBa Pb Cl\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 Pb\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Pb",
"Cl"
],
"chemical_system": "Ba-Cl-Pb",
"density": 4.808817745916781,
"density_atomic": 0.02286386970243527,
"volume": 131.21138455755215,
"volume_molar": 26.339114237335643,
"formula_full": "Ba1 Pb1 Cl1",
"formula_reduced": "BaPbCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0719167577777775,
"spacegroup": 216
},
{
"id": "jvasp-68725",
"created_at": "2022-09-04T14:36:04.026344Z",
"updated_at": "2022-09-04T14:36:04.026357Z",
"structure_string": "Be1 Cd1 Cl2\n1.0\n-1.912568 1.912568 6.308289\n1.912568 -1.912568 6.308289\n1.912568 1.912568 -6.308289\nBe Cd Cl\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Be\n0.750001 0.250000 0.500000 Cd\n0.000000 0.000000 0.000000 Cl\n0.250000 0.750001 0.500000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Cl"
],
"chemical_system": "Be-Cd-Cl",
"density": 3.4601022990288466,
"density_atomic": 0.04333658133262839,
"volume": 92.30077401117873,
"volume_molar": 13.896206333806704,
"formula_full": "Be1 Cd1 Cl2",
"formula_reduced": "BeCdCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0717474999999999,
"spacegroup": 119
},
{
"id": "jvasp-120352",
"created_at": "2022-09-04T14:38:51.667672Z",
"updated_at": "2022-09-04T14:38:51.667682Z",
"structure_string": "Na1 Zn1 Se1\n1.0\n5.771364 0.996334 0.000000\n-2.083461 3.554010 0.000000\n0.000000 0.000000 4.156579\nNa Zn Se\n1 1 1\ndirect\n0.325960 -0.003689 0.000000 Na\n0.718670 0.692718 0.000000 Zn\n0.955368 0.310970 0.000000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 2.9600363898211532,
"density_atomic": 0.03195366913321762,
"volume": 93.88593176867231,
"volume_molar": 18.846476549823343,
"formula_full": "Na1 Zn1 Se1",
"formula_reduced": "NaZnSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.07173,
"spacegroup": 38
},
{
"id": "jvasp-109935",
"created_at": "2022-09-04T14:38:46.386795Z",
"updated_at": "2022-09-04T14:38:46.386822Z",
"structure_string": "Ca1 Ce1 In2\n1.0\n4.711256 -0.000000 2.720045\n1.570419 4.441814 2.720045\n-0.000000 -0.000000 5.440089\nCa Ce In\n1 1 2\ndirect\n0.500001 0.500000 0.499999 Ca\n0.000000 0.000000 0.000000 Ce\n0.750001 0.749999 0.749999 In\n0.250000 0.250000 0.250000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Ce",
"In"
],
"chemical_system": "Ca-Ce-In",
"density": 5.977915427048518,
"density_atomic": 0.03513637182783345,
"volume": 113.84214681014335,
"volume_molar": 17.13933581278171,
"formula_full": "Ca1 Ce1 In2",
"formula_reduced": "CaCeIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.071601465,
"spacegroup": 225
},
{
"id": "jvasp-42124",
"created_at": "2022-09-04T14:37:36.435434Z",
"updated_at": "2022-09-04T14:37:36.435453Z",
"structure_string": "Pm1 Ga1 Ag2\n1.0\n-0.000000 3.468669 3.468669\n3.468669 0.000000 3.468669\n3.468669 3.468669 -0.000000\nPm Ga Ag\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Pm\n0.250001 0.250001 0.250001 Ga\n0.000000 0.000000 0.000000 Ag\n0.499999 0.499999 0.499999 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Ga",
"Ag"
],
"chemical_system": "Ag-Ga-Pm",
"density": 8.5637251607458,
"density_atomic": 0.04792271546704475,
"volume": 83.4677242517841,
"volume_molar": 12.566359609027739,
"formula_full": "Pm1 Ga1 Ag2",
"formula_reduced": "PmGaAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.071487005,
"spacegroup": 225
},
{
"id": "jvasp-19806",
"created_at": "2022-09-04T14:38:15.949699Z",
"updated_at": "2022-09-04T14:38:15.949723Z",
"structure_string": "Pr1 Se1\n1.0\n3.691265 0.000000 2.131152\n1.230422 3.480158 2.131152\n0.000000 0.000000 4.262306\nPr Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.499999 0.500000 0.500000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Se"
],
"chemical_system": "Pr-Se",
"density": 6.66793903429037,
"density_atomic": 0.03652676276612033,
"volume": 54.75437319222442,
"volume_molar": 16.4869271294573,
"formula_full": "Pr1 Se1",
"formula_reduced": "PrSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0714766083333333,
"spacegroup": 225
},
{
"id": "jvasp-12733",
"created_at": "2022-09-04T14:37:07.112992Z",
"updated_at": "2022-09-04T14:37:07.113009Z",
"structure_string": "Tl4 Cl8\n1.0\n6.497559 -0.000000 -2.659033\n-1.088171 6.405792 -2.659033\n-0.054374 -0.064389 9.135305\nTl Cl\n4 8\ndirect\n0.625000 0.875000 0.250000 Tl\n0.375000 0.125000 0.750000 Tl\n0.125000 0.375000 0.250000 Tl\n0.875001 0.625000 0.750000 Tl\n0.280814 0.455590 0.072876 Cl\n0.617288 0.780814 0.572876 Cl\n0.955590 0.292062 0.572876 Cl\n0.792062 0.117288 0.072877 Cl\n0.207939 0.882712 0.927124 Cl\n0.044411 0.707938 0.427124 Cl\n0.382713 0.219186 0.427124 Cl\n0.719186 0.544410 0.927124 Cl\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Tl",
"Cl"
],
"chemical_system": "Cl-Tl",
"density": 4.8372782171273965,
"density_atomic": 0.03174562577865176,
"volume": 378.00483391540945,
"volume_molar": 18.96998598165848,
"formula_full": "Tl4 Cl8",
"formula_reduced": "TlCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0714346891666666,
"spacegroup": 88
},
{
"id": "jvasp-92367",
"created_at": "2022-09-04T14:36:08.294179Z",
"updated_at": "2022-09-04T14:36:08.294201Z",
"structure_string": "Na1 P1 F3\n1.0\n5.752952 0.813662 0.555796\n3.583761 5.958652 0.202202\n3.879150 1.855857 2.608198\nNa P F\n1 1 3\ndirect\n0.089755 -0.013460 -0.064369 Na\n0.590929 0.488415 0.450266 P\n0.591881 0.749614 -0.083103 F\n0.587997 0.301910 -0.032856 F\n0.589437 0.773520 0.355063 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"P",
"F"
],
"chemical_system": "F-Na-P",
"density": 2.5902670470779765,
"density_atomic": 0.0702916806966735,
"volume": 71.13217311699051,
"volume_molar": 8.567359181504097,
"formula_full": "Na1 P1 F3",
"formula_reduced": "NaPF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.07138445,
"spacegroup": 6
},
{
"id": "jvasp-7703",
"created_at": "2022-09-04T14:37:06.426087Z",
"updated_at": "2022-09-04T14:37:06.426105Z",
"structure_string": "Ba2 Hg4\n1.0\n4.816780 -0.000000 2.071797\n2.186144 6.066920 1.552604\n0.001267 0.100427 6.632287\nBa Hg\n2 4\ndirect\n0.499017 0.250984 0.750984 Ba\n0.500983 0.749017 0.249017 Ba\n0.833313 0.165348 0.168025 Hg\n0.166686 0.834653 0.831975 Hg\n0.166687 0.331975 0.334652 Hg\n0.833313 0.668025 0.665348 Hg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Hg"
],
"chemical_system": "Ba-Hg",
"density": 9.24234117026796,
"density_atomic": 0.031007217825505275,
"volume": 193.50333311957593,
"volume_molar": 19.421738492920934,
"formula_full": "Ba2 Hg4",
"formula_reduced": "BaHg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0713646666666666,
"spacegroup": 191
},
{
"id": "jvasp-111378",
"created_at": "2022-09-04T14:38:26.177806Z",
"updated_at": "2022-09-04T14:38:26.177832Z",
"structure_string": "Ca2 Al2 Ga2\n1.0\n4.536534 0.034814 3.542957\n2.278964 3.922713 3.542957\n-0.022437 -0.013028 7.335389\nCa Al Ga\n2 2 2\ndirect\n0.550019 0.550019 0.195245 Ca\n0.449979 0.449979 0.804758 Ca\n0.162295 0.162295 0.403878 Al\n0.837704 0.837703 0.596125 Al\n0.838377 0.838377 0.215050 Ga\n0.161621 0.161621 0.784952 Ga\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Al",
"Ga"
],
"chemical_system": "Al-Ca-Ga",
"density": 3.4844769683248904,
"density_atomic": 0.04602344202759703,
"volume": 130.36834568788274,
"volume_molar": 13.084942139679484,
"formula_full": "Ca2 Al2 Ga2",
"formula_reduced": "CaAlGa",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0713485149999999,
"spacegroup": 12
},
{
"id": "jvasp-64826",
"created_at": "2022-09-04T14:36:08.088071Z",
"updated_at": "2022-09-04T14:36:08.088095Z",
"structure_string": "Ba4 Te1 Cl1\n1.0\n-0.000000 5.003536 5.003536\n5.003536 0.000000 5.003536\n5.003536 5.003536 0.000000\nBa Te Cl\n4 1 1\ndirect\n0.122501 0.625833 0.625833 Ba\n0.625833 0.625833 0.625833 Ba\n0.625833 0.122501 0.625833 Ba\n0.625833 0.625833 0.122501 Ba\n0.000000 0.000000 0.000000 Te\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Te",
"Cl"
],
"chemical_system": "Ba-Cl-Te",
"density": 4.721588671642728,
"density_atomic": 0.023949153534188538,
"volume": 250.53077518730336,
"volume_molar": 25.145526548164273,
"formula_full": "Ba4 Te1 Cl1",
"formula_reduced": "Ba4TeCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0712946516666666,
"spacegroup": 216
}
]
}