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=859",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=857",
"results": [
{
"id": "jvasp-88239",
"created_at": "2022-09-04T14:36:16.718149Z",
"updated_at": "2022-09-04T14:36:16.718175Z",
"structure_string": "Sr2 H32 O20\n1.0\n6.304823 0.003159 0.037436\n0.003159 6.304823 0.037436\n0.065888 0.065888 11.027715\nSr H O\n2 32 20\ndirect\n0.000815 -0.001361 0.251267 Sr\n-0.001361 0.000815 0.751268 Sr\n0.282500 0.390475 0.645515 H\n0.140144 0.313688 0.533060 H\n0.393010 0.724876 0.649167 H\n0.454266 0.970005 0.631834 H\n0.614368 0.277728 0.645910 H\n0.689052 0.137485 0.531670 H\n0.137485 0.689051 0.031670 H\n0.970005 0.454265 0.131834 H\n0.724876 0.393010 0.149166 H\n0.549107 0.973803 0.131837 H\n0.611493 0.729019 0.149520 H\n0.390475 0.282500 0.145515 H\n0.313688 0.140144 0.033060 H\n0.973803 0.549107 0.631838 H\n0.729019 0.611493 0.649521 H\n0.277727 0.614367 0.145910 H\n0.608923 0.717022 0.857001 H\n0.685712 0.859384 0.969455 H\n0.025725 0.450301 0.370679 H\n0.270517 0.387913 0.353010 H\n0.717021 0.608923 0.357000 H\n0.606484 0.274540 0.353363 H\n0.545207 0.029419 0.370723 H\n0.385117 0.721698 0.356650 H\n0.859384 0.685711 0.469455 H\n0.310410 0.861942 0.470882 H\n0.721698 0.385117 0.856650 H\n0.861942 0.310410 0.970882 H\n0.029419 0.545207 0.870723 H\n0.274540 0.606484 0.853363 H\n0.450301 0.025725 0.870679 H\n0.387913 0.270517 0.853011 H\n0.326775 0.125936 0.876724 O\n0.134400 0.676054 0.122557 O\n0.676054 0.134400 0.622557 O\n0.331575 0.869432 0.626389 O\n0.138897 0.329212 0.623561 O\n0.873591 0.672633 0.625795 O\n0.670186 0.860627 0.878955 O\n0.869432 0.331574 0.126388 O\n0.129988 0.667903 0.876168 O\n0.497705 0.495146 0.819110 O\n0.323418 0.865023 0.379994 O\n0.667903 0.129988 0.376168 O\n0.860627 0.670186 0.378955 O\n0.125936 0.326775 0.376724 O\n0.501725 0.504359 0.183425 O\n0.504359 0.501725 0.683425 O\n0.495146 0.497705 0.319110 O\n0.672633 0.873591 0.125794 O\n0.865023 0.323419 0.879995 O\n0.329212 0.138896 0.123560 O\n",
"nsites": 54,
"nelements": 3,
"elements": [
"Sr",
"H",
"O"
],
"chemical_system": "H-O-Sr",
"density": 1.9982801999214794,
"density_atomic": 0.12319507250073118,
"volume": 438.3292196989413,
"volume_molar": 4.8882967782370175,
"formula_full": "Sr2 H32 O20",
"formula_reduced": "Sr(H8O5)2",
"formula_anonymous": "AB10C16",
"energy_above_hull": 3.0282796781481487,
"spacegroup": 15
},
{
"id": "jvasp-62883",
"created_at": "2022-09-04T14:35:45.368806Z",
"updated_at": "2022-09-04T14:35:45.368835Z",
"structure_string": "Pr1 B1 Rh3\n1.0\n4.270538 -0.000000 -0.000000\n-0.000000 4.270538 -0.000000\n0.000000 -0.000000 4.270538\nPr B Rh\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 B\n0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pr",
"B",
"Rh"
],
"chemical_system": "B-Pr-Rh",
"density": 9.816796678155935,
"density_atomic": 0.06419810849430742,
"volume": 77.88391460853337,
"volume_molar": 9.380557934248166,
"formula_full": "Pr1 B1 Rh3",
"formula_reduced": "PrBRh3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.0282322866666678,
"spacegroup": 221
},
{
"id": "jvasp-62697",
"created_at": "2022-09-04T14:36:15.595164Z",
"updated_at": "2022-09-04T14:36:15.595186Z",
"structure_string": "Pr1 B1 Rh3\n1.0\n4.270651 0.000000 0.000000\n-0.000000 4.270651 0.000000\n-0.000000 -0.000000 4.270651\nPr B Rh\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 B\n0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pr",
"B",
"Rh"
],
"chemical_system": "B-Pr-Rh",
"density": 9.816017451284036,
"density_atomic": 0.06419301264757617,
"volume": 77.8900972828667,
"volume_molar": 9.381302592950336,
"formula_full": "Pr1 B1 Rh3",
"formula_reduced": "PrBRh3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.028174286666667,
"spacegroup": 221
},
{
"id": "jvasp-15652",
"created_at": "2022-09-04T14:36:17.156894Z",
"updated_at": "2022-09-04T14:36:17.156921Z",
"structure_string": "Ce2 Mn2 Si4\n1.0\n4.006887 0.000000 -0.000000\n0.000000 3.961656 -0.931300\n-0.000000 -0.017503 8.817441\nCe Mn Si\n2 2 4\ndirect\n0.250000 0.895408 0.790813 Ce\n0.750001 0.104594 0.209187 Ce\n0.750001 0.750780 0.501559 Mn\n0.250000 0.249221 0.498441 Mn\n0.250000 0.679155 0.358307 Si\n0.750001 0.320847 0.641693 Si\n0.750001 0.463706 0.927408 Si\n0.250000 0.536296 0.072592 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Mn",
"Si"
],
"chemical_system": "Ce-Mn-Si",
"density": 5.963734673007312,
"density_atomic": 0.05718291290353455,
"volume": 139.90193212954546,
"volume_molar": 10.531364098501117,
"formula_full": "Ce2 Mn2 Si4",
"formula_reduced": "CeMnSi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0281724853448275,
"spacegroup": 63
},
{
"id": "jvasp-92379",
"created_at": "2022-09-04T14:35:53.728657Z",
"updated_at": "2022-09-04T14:35:53.728675Z",
"structure_string": "Pr1 B1 Rh3\n1.0\n4.270635 -0.000000 -0.000000\n-0.000000 4.270635 -0.000000\n0.000000 0.000000 4.270635\nPr B Rh\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500001 0.500001 0.500001 B\n0.000000 0.500001 0.500001 Rh\n0.500001 0.500001 0.000000 Rh\n0.500001 0.000000 0.500001 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pr",
"B",
"Rh"
],
"chemical_system": "B-Pr-Rh",
"density": 9.816127779280434,
"density_atomic": 0.06419373415061987,
"volume": 77.88922184006832,
"volume_molar": 9.381197152155153,
"formula_full": "Pr1 B1 Rh3",
"formula_reduced": "PrBRh3",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.028138286666667,
"spacegroup": 221
},
{
"id": "jvasp-110413",
"created_at": "2022-09-04T14:38:40.440019Z",
"updated_at": "2022-09-04T14:38:40.440044Z",
"structure_string": "Ce3 Hf1\n1.0\n4.281011 0.046365 -3.889003\n-0.808069 4.204310 -3.889003\n-0.037881 -0.046365 5.783594\nCe Hf\n3 1\ndirect\n0.750000 0.250000 0.500000 Ce\n0.250000 0.750000 0.500000 Ce\n0.500000 0.499999 -0.000000 Ce\n0.000000 0.000000 0.000000 Hf\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ce",
"Hf"
],
"chemical_system": "Ce-Hf",
"density": 9.67462911319127,
"density_atomic": 0.03891668754525657,
"volume": 102.78367076715776,
"volume_molar": 15.474443329733031,
"formula_full": "Ce3 Hf1",
"formula_reduced": "Ce3Hf",
"formula_anonymous": "AB3",
"energy_above_hull": 3.028039875,
"spacegroup": 139
},
{
"id": "jvasp-38800",
"created_at": "2022-09-04T14:37:45.527626Z",
"updated_at": "2022-09-04T14:37:45.527653Z",
"structure_string": "Np1 In1 Rh2\n1.0\n-0.000000 3.317710 3.317710\n3.317710 0.000000 3.317710\n3.317710 3.317710 0.000000\nNp In Rh\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Np\n0.250001 0.250001 0.250001 In\n0.000000 0.000000 0.000000 Rh\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Np",
"In",
"Rh"
],
"chemical_system": "In-Np-Rh",
"density": 12.67795447529848,
"density_atomic": 0.05476646761592655,
"volume": 73.03739266245402,
"volume_molar": 10.996036483917232,
"formula_full": "Np1 In1 Rh2",
"formula_reduced": "NpInRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.027993992500001,
"spacegroup": 225
},
{
"id": "jvasp-102670",
"created_at": "2022-09-04T14:36:53.653048Z",
"updated_at": "2022-09-04T14:36:53.653070Z",
"structure_string": "Tb1 Si2 Ir1 Rh1\n1.0\n3.815231 -0.002402 -4.321527\n-0.547674 3.775718 -4.321527\n0.002080 0.002402 5.764684\nTb Si Ir Rh\n1 2 1 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.621356 0.621356 0.000000 Si\n0.378645 0.378645 0.000000 Si\n0.250001 0.750000 0.500000 Ir\n0.750000 0.250000 0.499999 Rh\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Tb",
"Si",
"Ir",
"Rh"
],
"chemical_system": "Ir-Rh-Si-Tb",
"density": 10.193775515236055,
"density_atomic": 0.06015884267095145,
"volume": 83.11330102123658,
"volume_molar": 10.01039995556277,
"formula_full": "Tb1 Si2 Ir1 Rh1",
"formula_reduced": "TbSi2IrRh",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.02797594,
"spacegroup": 119
},
{
"id": "jvasp-33746",
"created_at": "2022-09-04T14:38:02.021130Z",
"updated_at": "2022-09-04T14:38:02.021141Z",
"structure_string": "Ni1 H12 S1 O9\n1.0\n5.875699 -0.035684 -0.039614\n-0.589498 5.846162 -0.039614\n-0.589498 -0.647963 5.810277\nNi H S O\n1 12 1 9\ndirect\n0.006639 0.006639 0.006639 Ni\n0.802377 0.369334 0.189933 H\n0.548036 0.955653 0.024887 H\n0.641072 0.738736 0.140318 H\n0.409017 0.277946 0.072084 H\n0.369333 0.189933 0.802378 H\n0.738735 0.140318 0.641073 H\n0.189932 0.802378 0.369334 H\n0.140317 0.641072 0.738736 H\n0.072084 0.409017 0.277946 H\n0.024886 0.548037 0.955653 H\n0.955653 0.024887 0.548037 H\n0.277946 0.072084 0.409017 H\n0.507358 0.507359 0.507359 S\n0.891602 0.089871 0.687619 O\n0.089870 0.687619 0.891603 O\n0.141444 0.956684 0.340934 O\n0.254376 0.563526 0.484659 O\n0.340933 0.141445 0.956684 O\n0.484658 0.254377 0.563527 O\n0.563526 0.484659 0.254377 O\n0.687618 0.891603 0.089871 O\n0.956684 0.340934 0.141446 O\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Ni",
"H",
"S",
"O"
],
"chemical_system": "H-Ni-O-S",
"density": 2.0581589714986106,
"density_atomic": 0.11548552408524343,
"volume": 199.15916026863238,
"volume_molar": 5.214628246874364,
"formula_full": "Ni1 H12 S1 O9",
"formula_reduced": "NiH12SO9",
"formula_anonymous": "ABC9D12",
"energy_above_hull": 3.027635386956522,
"spacegroup": 146
},
{
"id": "jvasp-74508",
"created_at": "2022-09-04T14:35:42.933036Z",
"updated_at": "2022-09-04T14:35:42.933058Z",
"structure_string": "Be2 Si1 Tc1\n1.0\n3.093860 0.000000 0.000000\n0.000000 3.093860 0.000000\n0.000000 0.000000 4.770352\nBe Si Tc\n2 1 1\ndirect\n0.000000 0.000000 0.009650 Be\n0.500000 0.500000 0.239165 Be\n0.000000 0.000000 0.502581 Si\n0.500000 0.500000 0.748603 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Si",
"Tc"
],
"chemical_system": "Be-Si-Tc",
"density": 5.240721294335705,
"density_atomic": 0.08760083578824442,
"volume": 45.66166480042625,
"volume_molar": 6.874524319102605,
"formula_full": "Be2 Si1 Tc1",
"formula_reduced": "Be2SiTc",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.027410575,
"spacegroup": 99
},
{
"id": "jvasp-119662",
"created_at": "2022-09-04T14:38:52.788822Z",
"updated_at": "2022-09-04T14:38:52.788849Z",
"structure_string": "Ce4 H11\n1.0\n4.991753 0.016766 -4.431362\n-0.997480 4.891105 -4.431362\n-0.013645 -0.016766 6.674907\nCe H\n4 11\ndirect\n0.499999 0.000000 0.500000 Ce\n0.258361 0.258361 0.000000 Ce\n-0.000000 0.500000 0.500000 Ce\n0.741639 0.741640 0.000001 Ce\n0.643564 0.114513 0.000001 H\n0.356435 0.356436 0.470948 H\n0.114512 0.643565 0.000001 H\n0.885487 0.885489 0.529053 H\n0.885488 0.356437 0.000001 H\n0.643563 0.643565 0.529053 H\n0.356436 0.885489 0.000001 H\n0.114511 0.114512 0.470948 H\n0.749999 0.250000 0.500000 H\n0.500000 0.500001 0.000001 H\n0.250000 0.750001 0.500001 H\n",
"nsites": 15,
"nelements": 2,
"elements": [
"Ce",
"H"
],
"chemical_system": "Ce-H",
"density": 5.846232013423323,
"density_atomic": 0.09239808302947952,
"volume": 162.34103033516683,
"volume_molar": 6.517603572012031,
"formula_full": "Ce4 H11",
"formula_reduced": "Ce4H11",
"formula_anonymous": "A4B11",
"energy_above_hull": 3.0273861333333336,
"spacegroup": 139
},
{
"id": "jvasp-120510",
"created_at": "2022-09-04T14:38:52.473308Z",
"updated_at": "2022-09-04T14:38:52.473335Z",
"structure_string": "Nb4 Cu1 Se8\n1.0\n12.912901 -0.046461 2.994247\n12.446357 3.439969 2.994247\n-0.000999 -0.000134 6.077961\nNb Cu Se\n4 1 8\ndirect\n0.373489 0.373491 0.639303 Nb\n0.873883 0.873884 0.115436 Nb\n0.626509 0.626511 0.360698 Nb\n0.126116 0.126118 0.884564 Nb\n0.000000 0.000000 0.000000 Cu\n0.941132 0.941135 0.717972 Se\n0.438401 0.438402 0.236141 Se\n0.561597 0.561599 0.763859 Se\n0.058866 0.058867 0.282029 Se\n0.690089 0.690091 0.642084 Se\n0.193150 0.193150 0.140142 Se\n0.806849 0.806852 0.859859 Se\n0.309909 0.309910 0.357916 Se\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Nb",
"Cu",
"Se"
],
"chemical_system": "Cu-Nb-Se",
"density": 6.477131195566768,
"density_atomic": 0.04753056407738993,
"volume": 273.5082204964624,
"volume_molar": 12.670038483437027,
"formula_full": "Nb4 Cu1 Se8",
"formula_reduced": "Nb4CuSe8",
"formula_anonymous": "AB4C8",
"energy_above_hull": 3.0272465371794874,
"spacegroup": 12
}
]
}