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=density&page=1281",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=1279",
"results": [
{
"id": "jvasp-13958",
"created_at": "2022-09-04T14:37:58.650478Z",
"updated_at": "2022-09-04T14:37:58.650505Z",
"structure_string": "Ca8 Si8 O24\n1.0\n7.170172 0.000000 0.000000\n0.000000 7.170172 -0.000000\n0.000000 -0.000000 7.261999\nCa Si O\n8 8 24\ndirect\n0.500000 0.000000 -0.000044 Ca\n0.000000 0.500000 0.500044 Ca\n0.000000 0.000000 0.500000 Ca\n0.500000 0.000000 0.499956 Ca\n0.000000 0.000000 0.000000 Ca\n0.000000 0.500000 0.000044 Ca\n0.500000 0.500000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.750000 0.250000 0.750000 Si\n0.250000 0.250000 0.250000 Si\n0.750000 0.250000 0.250000 Si\n0.750000 0.750000 0.250000 Si\n0.250000 0.750000 0.750000 Si\n0.250000 0.750000 0.250000 Si\n0.250000 0.250000 0.750000 Si\n0.750000 0.750000 0.750000 Si\n0.750047 0.750047 0.000000 O\n0.500000 0.723775 0.750042 O\n0.723771 0.000000 0.749956 O\n0.000000 0.223775 0.749958 O\n0.500000 0.223771 0.249956 O\n0.776228 0.500000 0.750044 O\n0.500000 0.776228 0.249956 O\n0.750047 0.249952 0.000000 O\n0.250048 0.749952 0.500000 O\n0.723775 0.500000 0.249958 O\n0.500000 0.276225 0.750042 O\n0.000000 0.723771 0.250044 O\n0.749952 0.250048 0.500000 O\n0.000000 0.776225 0.749958 O\n0.276229 0.000000 0.749956 O\n0.249952 0.750047 0.000000 O\n0.749952 0.749952 0.500000 O\n0.000000 0.276229 0.250044 O\n0.249952 0.249952 0.000000 O\n0.223771 0.500000 0.750044 O\n0.776225 0.000000 0.250042 O\n0.250048 0.250048 0.500000 O\n0.276225 0.500000 0.249958 O\n0.223775 0.000000 0.250042 O\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Ca",
"Si",
"O"
],
"chemical_system": "Ca-O-Si",
"density": 4.133202766036805,
"density_atomic": 0.1071382773121291,
"volume": 373.3492921812325,
"volume_molar": 5.620904975404374,
"formula_full": "Ca8 Si8 O24",
"formula_reduced": "CaSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.506371904,
"spacegroup": 140
},
{
"id": "jvasp-4429",
"created_at": "2022-09-04T14:37:09.355717Z",
"updated_at": "2022-09-04T14:37:09.355748Z",
"structure_string": "Ca8 Si8 O24\n1.0\n7.170113 0.000000 0.000000\n0.000000 7.170113 -0.000000\n0.000000 -0.000000 7.261941\nCa Si O\n8 8 24\ndirect\n0.500000 0.000000 0.999967 Ca\n0.000000 0.500000 0.500032 Ca\n0.000000 0.000000 0.500000 Ca\n0.500000 0.000000 0.499967 Ca\n0.000000 0.000000 0.000000 Ca\n0.000000 0.500000 0.000032 Ca\n0.500000 0.500000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.750000 0.250000 0.750000 Si\n0.250000 0.250000 0.250000 Si\n0.750000 0.250000 0.250000 Si\n0.750000 0.750000 0.250000 Si\n0.250000 0.750000 0.750000 Si\n0.250000 0.750000 0.250000 Si\n0.250000 0.250000 0.750000 Si\n0.750000 0.750000 0.750000 Si\n0.750047 0.750047 0.000000 O\n0.500000 0.723792 0.750044 O\n0.723791 0.000000 0.749957 O\n0.000000 0.223792 0.749956 O\n0.500000 0.223792 0.249957 O\n0.776208 0.500000 0.750042 O\n0.500000 0.776208 0.249957 O\n0.750047 0.249953 0.000000 O\n0.250047 0.749952 0.500000 O\n0.723792 0.500000 0.249956 O\n0.500000 0.276208 0.750044 O\n0.000000 0.723791 0.250043 O\n0.749952 0.250047 0.500000 O\n0.000000 0.776208 0.749956 O\n0.276208 0.000000 0.749957 O\n0.249953 0.750047 0.000000 O\n0.749952 0.749952 0.500000 O\n0.000000 0.276208 0.250043 O\n0.249953 0.249953 0.000000 O\n0.223792 0.500000 0.750042 O\n0.776208 0.000000 0.250044 O\n0.250047 0.250047 0.500000 O\n0.276208 0.500000 0.249956 O\n0.223792 0.000000 0.250044 O\n",
"nsites": 40,
"nelements": 3,
"elements": [
"Ca",
"Si",
"O"
],
"chemical_system": "Ca-O-Si",
"density": 4.133303799065376,
"density_atomic": 0.10714089622662361,
"volume": 373.3401661620629,
"volume_molar": 5.62076757997433,
"formula_full": "Ca8 Si8 O24",
"formula_reduced": "CaSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.506373904,
"spacegroup": 140
},
{
"id": "jvasp-52901",
"created_at": "2022-09-04T14:36:12.644952Z",
"updated_at": "2022-09-04T14:36:12.644979Z",
"structure_string": "Ca4 H12 Rh3\n1.0\n-3.642178 3.642178 3.642178\n3.642178 -3.642178 3.642178\n3.642178 3.642178 -3.642178\nCa H Rh\n4 12 3\ndirect\n0.000000 0.000000 0.500000 Ca\n0.000000 0.500000 0.000000 Ca\n0.500000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Ca\n0.500000 0.750000 0.250000 H\n0.250000 0.750000 0.500000 H\n0.250000 0.500000 0.750000 H\n0.500000 0.250000 0.750000 H\n0.750000 0.500000 0.250000 H\n0.750000 0.250000 0.500000 H\n0.000000 0.735619 0.735619 H\n0.735619 0.000000 0.735619 H\n0.264382 0.264382 0.000000 H\n0.000000 0.264382 0.264382 H\n0.264382 0.000000 0.264382 H\n0.735619 0.735619 0.000000 H\n0.000000 0.500000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n0.500000 0.000000 0.500000 Rh\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Ca",
"H",
"Rh"
],
"chemical_system": "Ca-H-Rh",
"density": 4.133923434884367,
"density_atomic": 0.09831280999377158,
"volume": 193.2606747910441,
"volume_molar": 6.125489405075006,
"formula_full": "Ca4 H12 Rh3",
"formula_reduced": "Ca4(H4Rh)3",
"formula_anonymous": "A3B4C12",
"energy_above_hull": 2.476396351578947,
"spacegroup": 229
},
{
"id": "jvasp-70747",
"created_at": "2022-09-04T14:35:57.119000Z",
"updated_at": "2022-09-04T14:35:57.119028Z",
"structure_string": "Be1 Co1 P2\n1.0\n2.793433 0.000000 -0.000000\n0.000000 2.793433 0.000000\n-0.000000 0.000000 6.686170\nBe Co P\n1 1 2\ndirect\n0.000000 0.000000 0.537241 Be\n0.499999 0.499999 0.713900 Co\n0.000000 0.000000 0.903090 P\n0.499999 0.499999 0.345769 P\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Co",
"P"
],
"chemical_system": "Be-Co-P",
"density": 4.134096220225366,
"density_atomic": 0.0766665742947251,
"volume": 52.17397590536678,
"volume_molar": 7.85497567277418,
"formula_full": "Be1 Co1 P2",
"formula_reduced": "BeCoP2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.7618545,
"spacegroup": 99
},
{
"id": "jvasp-12216",
"created_at": "2022-09-04T14:38:10.940221Z",
"updated_at": "2022-09-04T14:38:10.940241Z",
"structure_string": "Li4 Ni2 O4\n1.0\n3.123546 -0.000000 0.000000\n-1.561773 2.705070 -0.000000\n-0.000000 -0.000000 9.942119\nLi Ni O\n4 2 4\ndirect\n0.666666 0.333332 0.176901 Li\n0.333335 0.666667 0.823099 Li\n0.333335 0.666667 0.323100 Li\n0.666666 0.333332 0.676901 Li\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.333335 0.666667 0.617603 O\n0.666666 0.333332 0.882397 O\n0.333335 0.666667 0.117603 O\n0.666666 0.333332 0.382397 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Li",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O",
"density": 4.13426463925559,
"density_atomic": 0.11904046889812063,
"volume": 84.00504544852205,
"volume_molar": 5.058902082411972,
"formula_full": "Li4 Ni2 O4",
"formula_reduced": "Li2NiO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.2402318799999996,
"spacegroup": 164
},
{
"id": "jvasp-36103",
"created_at": "2022-09-04T14:37:31.836355Z",
"updated_at": "2022-09-04T14:37:31.836375Z",
"structure_string": "Ag2 S2 O8\n1.0\n4.783927 -0.254018 0.155410\n2.008014 4.175194 -0.084230\n2.282175 0.174723 8.061240\nAg S O\n2 2 8\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500001 0.499999 0.500000 Ag\n0.847740 0.582871 0.758076 S\n0.152262 0.417126 0.241924 S\n0.756572 0.758900 0.913514 O\n0.072824 0.257263 0.769003 O\n0.546327 0.587007 0.739388 O\n0.000578 0.731176 0.608034 O\n-0.000577 0.268823 0.391966 O\n0.453674 0.412991 0.260612 O\n0.927178 0.742735 0.230997 O\n0.243429 0.241098 0.086486 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ag",
"S",
"O"
],
"chemical_system": "Ag-O-S",
"density": 4.134270656578211,
"density_atomic": 0.07325178886893652,
"volume": 163.81852491644437,
"volume_molar": 8.221151801186627,
"formula_full": "Ag2 S2 O8",
"formula_reduced": "AgSO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.9253702100000003,
"spacegroup": 2
},
{
"id": "jvasp-8104",
"created_at": "2022-09-04T14:37:04.552635Z",
"updated_at": "2022-09-04T14:37:04.552663Z",
"structure_string": "Ca1 Si1 O3\n1.0\n3.599962 -0.000000 -0.000000\n0.000000 3.599962 0.000000\n0.000000 0.000000 3.599962\nCa Si O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Si\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Si",
"O"
],
"chemical_system": "Ca-O-Si",
"density": 4.134455359180333,
"density_atomic": 0.10717074624219787,
"volume": 46.65452257559515,
"volume_molar": 5.619202040816636,
"formula_full": "Ca1 Si1 O3",
"formula_reduced": "CaSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.507143904,
"spacegroup": 221
},
{
"id": "jvasp-104823",
"created_at": "2022-09-04T14:36:57.332226Z",
"updated_at": "2022-09-04T14:36:57.332253Z",
"structure_string": "Rb2 Li1 As1 F6\n1.0\n5.133938 -0.000000 2.964081\n1.711313 4.840323 2.964081\n-0.000000 -0.000000 5.928161\nRb Li As F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.749999 0.750000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 As\n0.248529 0.248529 0.751470 F\n0.248529 0.751470 0.751471 F\n0.751471 0.751470 0.248529 F\n0.248529 0.751470 0.248530 F\n0.751471 0.248529 0.751470 F\n0.751471 0.248529 0.248529 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"As",
"F"
],
"chemical_system": "As-F-Li-Rb",
"density": 4.134471439366808,
"density_atomic": 0.06788206525866784,
"volume": 147.31431581956917,
"volume_molar": 8.871475458285403,
"formula_full": "Rb2 Li1 As1 F6",
"formula_reduced": "Rb2LiAsF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-52789",
"created_at": "2022-09-04T14:36:15.419809Z",
"updated_at": "2022-09-04T14:36:15.419832Z",
"structure_string": "Li8 Ni4 O12\n1.0\n4.744639 0.000397 1.171953\n2.372097 4.235563 0.585449\n-0.648801 0.001136 9.478982\nLi Ni O\n8 4 12\ndirect\n0.672888 0.164033 0.500221 Li\n0.836961 0.835946 0.000230 Li\n0.999982 0.499993 0.500006 Li\n0.915952 0.168106 0.749999 Li\n0.084048 0.831896 0.250000 Li\n0.163079 0.164035 0.999776 Li\n0.500025 0.499994 0.999993 Li\n0.327094 0.835944 0.499771 Li\n0.417148 0.165695 0.250001 Ni\n0.750330 0.499331 0.250001 Ni\n0.249667 0.500677 0.750001 Ni\n0.582849 0.834314 0.750001 Ni\n0.878596 0.523732 0.862065 O\n0.046111 0.187787 0.363489 O\n0.121403 0.476278 0.137934 O\n0.309493 0.167945 0.638064 O\n0.402310 0.476278 0.362065 O\n0.522571 0.167946 0.861935 O\n0.233908 0.812219 0.863489 O\n0.766093 0.187787 0.136511 O\n0.477431 0.832062 0.138063 O\n0.597685 0.523731 0.637934 O\n0.690499 0.832063 0.361936 O\n0.953884 0.812219 0.636509 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O",
"density": 4.134514968315078,
"density_atomic": 0.12390090926434033,
"volume": 193.703178955664,
"volume_molar": 4.8604492055436594,
"formula_full": "Li8 Ni4 O12",
"formula_reduced": "Li2NiO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.5088604833333337,
"spacegroup": 15
},
{
"id": "jvasp-74607",
"created_at": "2022-09-04T14:35:44.124848Z",
"updated_at": "2022-09-04T14:35:44.124873Z",
"structure_string": "Be2 Sb1 Cl1\n1.0\n3.736442 -0.000000 -0.000000\n-0.000000 3.736442 -0.000000\n0.000000 -0.000000 5.041017\nBe Sb Cl\n2 1 1\ndirect\n0.000000 0.000000 -0.063399 Be\n0.500000 0.500000 0.360260 Be\n0.500000 0.500000 0.855581 Sb\n-0.000000 0.000000 0.347558 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Sb",
"Cl"
],
"chemical_system": "Be-Cl-Sb",
"density": 4.1346728923264555,
"density_atomic": 0.056836239930545866,
"volume": 70.37763238539385,
"volume_molar": 10.595600214509409,
"formula_full": "Be2 Sb1 Cl1",
"formula_reduced": "Be2SbCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.361248091875,
"spacegroup": 99
},
{
"id": "jvasp-57390",
"created_at": "2022-09-04T14:37:50.922335Z",
"updated_at": "2022-09-04T14:37:50.922364Z",
"structure_string": "Li4 Ni2 O6\n1.0\n4.820336 0.000527 -0.805924\n-2.607189 4.054406 -0.805924\n-0.006297 -0.011538 4.959707\nLi Ni O\n4 2 6\ndirect\n0.336745 0.663256 0.500001 Li\n-0.000000 -0.000000 0.500000 Li\n0.663256 0.336745 0.500001 Li\n0.500001 0.500001 0.000001 Li\n0.166835 0.833166 0.000001 Ni\n0.833166 0.166836 0.000001 Ni\n0.574878 0.930952 0.223930 O\n0.425123 0.069049 0.776072 O\n0.779576 0.779576 0.772749 O\n0.930952 0.574878 0.223930 O\n0.069049 0.425123 0.776072 O\n0.220425 0.220425 0.227254 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O",
"density": 4.134680988432184,
"density_atomic": 0.12390588446545175,
"volume": 96.8477005896029,
"volume_molar": 4.860254043607697,
"formula_full": "Li4 Ni2 O6",
"formula_reduced": "Li2NiO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.5088488166666667,
"spacegroup": 12
},
{
"id": "jvasp-50514",
"created_at": "2022-09-04T14:37:06.207946Z",
"updated_at": "2022-09-04T14:37:06.207963Z",
"structure_string": "Rb8 Sn2 O6\n1.0\n3.327176 9.650835 -0.147444\n-3.327176 9.650835 0.147444\n-2.598005 0.000000 6.475796\nRb Sn O\n8 2 6\ndirect\n0.597698 0.721870 0.808945 Rb\n0.457609 0.486858 0.721543 Rb\n0.037016 0.062904 0.741994 Rb\n0.347855 0.233119 0.880270 Rb\n0.278131 0.402302 0.308944 Rb\n0.513142 0.542391 0.221543 Rb\n0.937096 0.962985 0.241994 Rb\n0.766882 0.652145 0.380270 Rb\n0.875244 0.846894 0.722052 Sn\n0.153106 0.124756 0.222052 Sn\n0.165463 0.684899 0.947042 O\n0.033681 0.647635 0.542416 O\n0.315101 0.834537 0.447042 O\n0.352366 0.966319 0.042415 O\n0.708776 0.150796 0.528426 O\n0.849205 0.291224 0.028426 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Rb",
"Sn",
"O"
],
"chemical_system": "O-Rb-Sn",
"density": 4.134896629707812,
"density_atomic": 0.0391693875776412,
"volume": 408.4822610076542,
"volume_molar": 15.374610460944707,
"formula_full": "Rb8 Sn2 O6",
"formula_reduced": "Rb4SnO3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.385944025,
"spacegroup": 9
}
]
}