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=-created_at&page=4024",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=4022",
"results": [
{
"id": "jvasp-68586",
"created_at": "2022-09-04T14:36:01.387230Z",
"updated_at": "2022-09-04T14:36:01.387257Z",
"structure_string": "Ti1 Be1 Hg1\n1.0\n1.622518 -2.810284 0.000000\n1.622518 2.810284 -0.000000\n-0.000000 -0.000000 5.481254\nTi Be Hg\n1 1 1\ndirect\n0.666667 0.333334 0.298287 Ti\n0.000000 0.000000 -0.002131 Be\n0.333334 0.666667 0.703843 Hg\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Hg"
],
"chemical_system": "Be-Hg-Ti",
"density": 8.553122518488102,
"density_atomic": 0.060016628819282714,
"volume": 49.98614649005629,
"volume_molar": 10.034120340436633,
"formula_full": "Ti1 Be1 Hg1",
"formula_reduced": "TiBeHg",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3243963444444444,
"spacegroup": 156
},
{
"id": "jvasp-64149",
"created_at": "2022-09-04T14:36:01.381930Z",
"updated_at": "2022-09-04T14:36:01.381957Z",
"structure_string": "Ba2 Na1 Bi1\n1.0\n-0.000000 4.316877 4.316877\n4.316877 0.000000 4.316877\n4.316877 4.316877 0.000000\nBa Na Bi\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Bi"
],
"chemical_system": "Ba-Bi-Na",
"density": 5.228727186959534,
"density_atomic": 0.02486113615237964,
"volume": 160.89369268898562,
"volume_molar": 24.22311161923136,
"formula_full": "Ba2 Na1 Bi1",
"formula_reduced": "Ba2NaBi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107771",
"created_at": "2022-09-04T14:36:01.379399Z",
"updated_at": "2022-09-04T14:36:01.379409Z",
"structure_string": "Ce2 Al6 Cu1 Au1\n1.0\n4.286544 0.000000 0.000000\n0.000000 4.286544 0.000000\n0.000000 -0.000000 10.722721\nCe Al Cu Au\n2 6 1 1\ndirect\n0.000000 0.000000 0.999897 Ce\n0.499999 0.499999 0.490837 Ce\n0.499999 0.000000 0.245929 Al\n-0.000000 0.499999 0.759401 Al\n-0.000000 0.499999 0.245929 Al\n0.499999 0.000000 0.759401 Al\n0.000000 0.000000 0.397381 Al\n0.499999 0.499999 0.912175 Al\n0.499999 0.499999 0.133677 Cu\n0.000000 0.000000 0.629374 Au\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ce",
"Al",
"Cu",
"Au"
],
"chemical_system": "Al-Au-Ce-Cu",
"density": 5.921865747702929,
"density_atomic": 0.050755185811386674,
"volume": 197.02420235759533,
"volume_molar": 11.865074797241629,
"formula_full": "Ce2 Al6 Cu1 Au1",
"formula_reduced": "Ce2Al6CuAu",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.680953582,
"spacegroup": 99
},
{
"id": "jvasp-68186",
"created_at": "2022-09-04T14:36:01.377893Z",
"updated_at": "2022-09-04T14:36:01.377920Z",
"structure_string": "Be1 Pd1 Rh2\n1.0\n-1.877194 1.877194 3.746246\n1.877194 -1.877194 3.746246\n1.877194 1.877194 -3.746246\nBe Pd Rh\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Be\n0.749999 0.250000 0.499999 Pd\n0.000000 0.000000 0.000000 Rh\n0.250000 0.749999 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Pd",
"Rh"
],
"chemical_system": "Be-Pd-Rh",
"density": 10.102024515155916,
"density_atomic": 0.07575048065893364,
"volume": 52.80494546311845,
"volume_molar": 7.949970360075567,
"formula_full": "Be1 Pd1 Rh2",
"formula_reduced": "BePdRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.29278445,
"spacegroup": 119
},
{
"id": "jvasp-72942",
"created_at": "2022-09-04T14:36:01.376761Z",
"updated_at": "2022-09-04T14:36:01.376780Z",
"structure_string": "Mg1 Be2 Pd1\n1.0\n-2.047529 2.047529 2.895552\n2.047529 -2.047529 2.895552\n2.047529 2.047529 -2.895552\nMg Be Pd\n1 2 1\ndirect\n0.250000 0.750000 0.500000 Mg\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.750000 0.250000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Pd"
],
"chemical_system": "Be-Mg-Pd",
"density": 5.086894514271921,
"density_atomic": 0.0823774811078958,
"volume": 48.55695933165167,
"volume_molar": 7.310421099320047,
"formula_full": "Mg1 Be2 Pd1",
"formula_reduced": "MgBe2Pd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0685792374999998,
"spacegroup": 225
},
{
"id": "jvasp-91969",
"created_at": "2022-09-04T14:36:01.372960Z",
"updated_at": "2022-09-04T14:36:01.372990Z",
"structure_string": "Na2 Ce2 S4\n1.0\n8.037761 0.000339 0.000231\n8.037535 7.127975 0.118005\n4.018640 4.807386 3.398717\nNa Ce S\n2 2 4\ndirect\n-0.000002 0.000012 -0.000022 Na\n0.750003 0.499987 0.000023 Na\n0.249978 0.500042 -0.000040 Ce\n0.500022 -0.000043 0.000040 Ce\n0.260067 0.000006 0.479865 S\n0.010074 0.499994 0.479876 S\n0.739926 0.000005 0.520125 S\n0.489933 0.499993 0.520136 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Ce",
"S"
],
"chemical_system": "Ce-Na-S",
"density": 3.968677464173741,
"density_atomic": 0.042070725756390794,
"volume": 190.15597796728647,
"volume_molar": 14.314325820930724,
"formula_full": "Na2 Ce2 S4",
"formula_reduced": "NaCeS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8460311250000001,
"spacegroup": 141
},
{
"id": "jvasp-93292",
"created_at": "2022-09-04T14:36:01.366635Z",
"updated_at": "2022-09-04T14:36:01.366650Z",
"structure_string": "Mg5 Hg1\n1.0\n-4.699214 2.713091 0.000000\n0.000000 -5.426184 0.000000\n-1.566406 2.713091 5.135169\nMg Hg\n5 1\ndirect\n0.996443 -0.000000 -0.000000 Mg\n0.670221 0.336889 -0.000000 Mg\n0.333332 0.663113 -0.000000 Mg\n0.500662 0.832669 0.498015 Mg\n0.166004 0.167327 0.501984 Mg\n0.833333 0.499998 0.499998 Hg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Hg"
],
"chemical_system": "Hg-Mg",
"density": 4.084938911388898,
"density_atomic": 0.045822287932359006,
"volume": 130.94064636966525,
"volume_molar": 13.14238339405845,
"formula_full": "Mg5 Hg1",
"formula_reduced": "Mg5Hg",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 155
},
{
"id": "jvasp-93392",
"created_at": "2022-09-04T14:36:01.361490Z",
"updated_at": "2022-09-04T14:36:01.361515Z",
"structure_string": "Ce4 Mg2\n1.0\n5.667000 -0.000000 -0.000000\n-2.833499 4.907766 0.000000\n-0.000000 -0.000000 5.647326\nCe Mg\n4 2\ndirect\n0.000000 0.662715 0.000000 Ce\n0.662714 0.000000 0.000000 Ce\n0.337286 0.337286 0.000000 Ce\n0.000000 0.000000 0.500000 Ce\n0.666667 0.333333 0.500000 Mg\n0.333333 0.666668 0.500000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Mg"
],
"chemical_system": "Ce-Mg",
"density": 6.439308606661507,
"density_atomic": 0.03820070090642128,
"volume": 157.06518094256853,
"volume_molar": 15.764477135516954,
"formula_full": "Ce4 Mg2",
"formula_reduced": "Ce2Mg",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2832053095238098,
"spacegroup": 189
},
{
"id": "jvasp-71183",
"created_at": "2022-09-04T14:36:01.355480Z",
"updated_at": "2022-09-04T14:36:01.355510Z",
"structure_string": "K1 Be1 Co4\n1.0\n-0.000000 3.480858 3.480858\n3.480858 0.000000 3.480858\n3.480858 3.480858 -0.000000\nK Be Co\n1 1 4\ndirect\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Be\n0.120448 0.626518 0.626518 Co\n0.626518 0.626518 0.626518 Co\n0.626518 0.120448 0.626518 Co\n0.626518 0.626518 0.120448 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"K",
"Be",
"Co"
],
"chemical_system": "Be-Co-K",
"density": 5.587773202733982,
"density_atomic": 0.07113156014980317,
"volume": 84.35074371156757,
"volume_molar": 8.46620086402908,
"formula_full": "K1 Be1 Co4",
"formula_reduced": "KBeCo4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.723361283333333,
"spacegroup": 216
},
{
"id": "jvasp-98268",
"created_at": "2022-09-04T14:36:01.353049Z",
"updated_at": "2022-09-04T14:36:01.353075Z",
"structure_string": "Sc6 Rh2 C8\n1.0\n5.105895 -0.011405 2.333267\n1.404256 5.397149 0.641710\n-0.003706 -0.005703 6.761367\nSc Rh C\n6 2 8\ndirect\n0.759561 0.759865 -0.000000 Sc\n0.188251 0.000000 0.623497 Sc\n0.689477 0.500000 0.621047 Sc\n0.240441 0.240134 -0.000000 Sc\n0.310524 0.500000 0.378954 Sc\n0.811749 -0.000001 0.376504 Sc\n0.269705 0.730148 -0.000000 Rh\n0.730297 0.269851 -0.000000 Rh\n0.949001 0.582067 0.258183 C\n0.711252 0.078054 0.740796 C\n0.792818 0.417932 0.258183 C\n0.051000 0.417933 0.741818 C\n0.288749 0.921946 0.259204 C\n0.547954 0.921946 0.740796 C\n0.452047 0.078054 0.259205 C\n0.207183 0.582068 0.741818 C\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sc",
"Rh",
"C"
],
"chemical_system": "C-Rh-Sc",
"density": 5.090187673096082,
"density_atomic": 0.0858001590163955,
"volume": 186.4798408700218,
"volume_molar": 7.018799066385451,
"formula_full": "Sc6 Rh2 C8",
"formula_reduced": "Sc3RhC4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 4.99569484375,
"spacegroup": 12
},
{
"id": "jvasp-98508",
"created_at": "2022-09-04T14:36:01.352156Z",
"updated_at": "2022-09-04T14:36:01.352192Z",
"structure_string": "Cu10 Si4 S14\n1.0\n6.345419 0.000000 0.000000\n-3.172709 8.175629 -0.321464\n0.000000 0.018318 9.611769\nCu Si S\n10 4 14\ndirect\n0.543466 0.758256 0.299826 Cu\n0.632207 0.607697 0.934669 Cu\n0.975490 0.607697 0.434669 Cu\n0.684139 0.039059 0.002424 Cu\n0.057751 0.464848 0.079914 Cu\n0.407098 0.464848 0.579914 Cu\n0.772000 0.898424 0.663986 Cu\n0.354920 0.039059 0.502424 Cu\n0.921984 0.187320 0.375315 Cu\n0.265337 0.187320 0.875315 Cu\n0.214790 0.758256 0.799826 Si\n0.809174 0.328704 0.726992 Si\n0.519530 0.328703 0.226992 Si\n0.126424 0.898424 0.163986 Si\n0.623585 0.544368 0.386057 S\n0.920784 0.544368 0.886057 S\n0.886703 0.112396 0.820536 S\n0.225694 0.112396 0.320536 S\n0.742896 0.823568 0.089893 S\n0.328037 0.967330 0.962140 S\n0.639293 0.967330 0.462140 S\n0.165579 0.670466 0.248218 S\n0.504887 0.670466 0.748218 S\n0.796210 0.230912 0.160918 S\n0.029936 0.407054 0.529615 S\n0.377118 0.407054 0.029615 S\n0.080672 0.823568 0.589894 S\n0.434702 0.230912 0.660918 S\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Cu",
"Si",
"S"
],
"chemical_system": "Cu-S-Si",
"density": 3.984936411674361,
"density_atomic": 0.0561488264489094,
"volume": 498.6747145192356,
"volume_molar": 10.725319015313042,
"formula_full": "Cu10 Si4 S14",
"formula_reduced": "Cu5Si2S7",
"formula_anonymous": "A2B5C7",
"energy_above_hull": 1.5009749607142857,
"spacegroup": 1
},
{
"id": "jvasp-68212",
"created_at": "2022-09-04T14:36:01.351075Z",
"updated_at": "2022-09-04T14:36:01.351100Z",
"structure_string": "Be1 Ga2 Fe1\n1.0\n-1.766728 1.766728 3.852524\n1.766728 -1.766728 3.852524\n1.766728 1.766728 -3.852524\nBe Ga Fe\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Ga\n0.250000 0.750000 0.500001 Ga\n0.750000 0.250000 0.500001 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ga",
"Fe"
],
"chemical_system": "Be-Fe-Ga",
"density": 7.053091207222063,
"density_atomic": 0.08316014981634098,
"volume": 48.09996144588474,
"volume_molar": 7.241618459442276,
"formula_full": "Be1 Ga2 Fe1",
"formula_reduced": "BeGa2Fe",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0992215625,
"spacegroup": 119
}
]
}