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=-formula_anonymous&page=419",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=417",
"results": [
{
"id": "jvasp-50798",
"created_at": "2022-09-04T14:37:07.631004Z",
"updated_at": "2022-09-04T14:37:07.631013Z",
"structure_string": "Tb2 Ce2 O8\n1.0\n-0.201037 0.000000 5.454086\n2.626176 -5.440391 2.827675\n2.626176 5.440391 2.827675\nTb Ce O\n2 2 8\ndirect\n0.250000 0.374997 0.125003 Tb\n0.750001 0.625004 0.874998 Tb\n0.750001 0.125002 0.374998 Ce\n0.250000 0.874999 0.625003 Ce\n0.246537 0.000008 0.000021 O\n0.253464 0.499980 0.499993 O\n0.746589 0.753450 0.253431 O\n0.753413 0.246570 0.746551 O\n0.246588 0.753431 0.253450 O\n0.253413 0.246551 0.746570 O\n0.746538 0.500021 0.500008 O\n0.753464 -0.000008 -0.000021 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tb",
"Ce",
"O"
],
"chemical_system": "Ce-O-Tb",
"density": 7.440863671153299,
"density_atomic": 0.07405805093774243,
"volume": 162.03505018094398,
"volume_molar": 8.131649002027567,
"formula_full": "Tb2 Ce2 O8",
"formula_reduced": "TbCeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.896301316666667,
"spacegroup": 141
},
{
"id": "jvasp-13315",
"created_at": "2022-09-04T14:37:11.568973Z",
"updated_at": "2022-09-04T14:37:11.568993Z",
"structure_string": "Ag2 Bi2 I8\n1.0\n8.699396 0.017553 0.058169\n4.364900 7.560229 0.000000\n4.402260 2.498506 7.075363\nAg Bi I\n2 2 8\ndirect\n-0.000000 0.000000 0.500000 Ag\n0.500000 -0.000000 0.000000 Ag\n0.000000 0.000000 0.000000 Bi\n-0.000000 0.500000 -0.000000 Bi\n0.250221 0.240045 0.250221 I\n0.250221 0.759514 0.250221 I\n0.247853 0.263040 0.726067 I\n0.726068 0.263040 0.247853 I\n0.273933 0.736960 0.752147 I\n0.749780 0.240486 0.749779 I\n0.752148 0.736960 0.273933 I\n0.749780 0.759955 0.749779 I\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ag",
"Bi",
"I"
],
"chemical_system": "Ag-Bi-I",
"density": 5.907495886558953,
"density_atomic": 0.025890031415423877,
"volume": 463.4988582072964,
"volume_molar": 23.260461385196837,
"formula_full": "Ag2 Bi2 I8",
"formula_reduced": "AgBiI4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 74
},
{
"id": "jvasp-57785",
"created_at": "2022-09-04T14:37:27.828116Z",
"updated_at": "2022-09-04T14:37:27.828142Z",
"structure_string": "Rb2 Al2 F8\n1.0\n5.137003 0.000000 0.000000\n0.000000 5.137003 -0.000000\n0.000000 -0.000000 6.320860\nRb Al F\n2 2 8\ndirect\n0.500000 0.000000 0.500000 Rb\n0.000000 0.500000 0.500000 Rb\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.282180 F\n0.000000 0.000000 0.717820 F\n0.500000 0.500000 0.717820 F\n0.000000 0.000000 0.282180 F\n0.200058 0.700058 0.000000 F\n0.299942 0.200058 0.000000 F\n0.700058 0.799941 0.000000 F\n0.799941 0.299942 0.000000 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Rb",
"Al",
"F"
],
"chemical_system": "Al-F-Rb",
"density": 3.7520030322000024,
"density_atomic": 0.07194248518757897,
"volume": 166.79990924294378,
"volume_molar": 8.370771101801937,
"formula_full": "Rb2 Al2 F8",
"formula_reduced": "RbAlF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 127
},
{
"id": "jvasp-14323",
"created_at": "2022-09-04T14:37:07.716005Z",
"updated_at": "2022-09-04T14:37:07.716019Z",
"structure_string": "Bi4 P4 O16\n1.0\n0.000000 6.627001 -0.088402\n6.763876 0.000000 0.000000\n0.000000 -5.102907 -7.094867\nBi P O\n4 4 16\ndirect\n0.702105 0.615600 0.263461 Bi\n0.297895 0.115599 0.236539 Bi\n0.297894 0.384401 0.736539 Bi\n0.702105 0.884401 0.763462 Bi\n0.095152 0.637647 0.221916 P\n0.904847 0.137647 0.278084 P\n0.904847 0.362353 0.778084 P\n0.095152 0.862354 0.721916 P\n0.949014 0.179039 0.904879 O\n0.050985 0.679039 0.595121 O\n0.230185 0.469557 0.195072 O\n0.769815 0.969557 0.304928 O\n0.769815 0.530444 0.804928 O\n0.230185 0.030443 0.695072 O\n0.515130 0.812226 0.438695 O\n0.298659 0.775185 0.934260 O\n0.484869 0.187774 0.561305 O\n0.515130 0.687775 0.938695 O\n0.949014 0.320961 0.404879 O\n0.701340 0.275184 0.565741 O\n0.701340 0.224816 0.065740 O\n0.298659 0.724816 0.434260 O\n0.484869 0.312226 0.061305 O\n0.050985 0.820962 0.095121 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Bi",
"P",
"O"
],
"chemical_system": "Bi-O-P",
"density": 6.2879616344288145,
"density_atomic": 0.07474934144799465,
"volume": 321.0730627867473,
"volume_molar": 8.056446576442127,
"formula_full": "Bi4 P4 O16",
"formula_reduced": "BiPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.2871939666666674,
"spacegroup": 14
},
{
"id": "jvasp-19061",
"created_at": "2022-09-04T14:37:07.748694Z",
"updated_at": "2022-09-04T14:37:07.748723Z",
"structure_string": "Nb4 Sb4 O16\n1.0\n5.033763 0.000000 0.000000\n0.000000 5.660241 0.000000\n0.000000 0.000000 11.926618\nNb Sb O\n4 4 16\ndirect\n0.750000 0.136774 0.250000 Nb\n0.750000 0.363226 0.750000 Nb\n0.250000 0.863226 0.750000 Nb\n0.250000 0.636774 0.250000 Nb\n0.802009 0.750000 0.000000 Sb\n0.697990 0.750000 0.500000 Sb\n0.197990 0.250000 0.000000 Sb\n0.302009 0.250000 0.500000 Sb\n0.919630 0.077835 0.095138 O\n0.919630 0.422165 0.904862 O\n0.419630 0.922165 0.595139 O\n0.419630 0.577835 0.404862 O\n0.080370 0.922165 0.904862 O\n0.080370 0.577835 0.095138 O\n0.009310 0.347683 0.304320 O\n0.990689 0.652316 0.695680 O\n0.490690 0.347683 0.195680 O\n0.490690 0.152317 0.804320 O\n0.580369 0.422165 0.595139 O\n0.990689 0.847683 0.304320 O\n0.509310 0.652316 0.804320 O\n0.509310 0.847683 0.195680 O\n0.009310 0.152317 0.695680 O\n0.580369 0.077835 0.404862 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Nb",
"Sb",
"O"
],
"chemical_system": "Nb-O-Sb",
"density": 5.44684388595526,
"density_atomic": 0.07062626592135127,
"volume": 339.8169177841877,
"volume_molar": 8.52677213135719,
"formula_full": "Nb4 Sb4 O16",
"formula_reduced": "NbSbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.724229916666667,
"spacegroup": 52
},
{
"id": "jvasp-10773",
"created_at": "2022-09-04T14:37:26.992213Z",
"updated_at": "2022-09-04T14:37:26.992225Z",
"structure_string": "K2 Pr2 Te8\n1.0\n6.970719 0.000000 0.000000\n0.000000 6.970719 0.000000\n0.000000 -0.000000 8.750876\nK Pr Te\n2 2 8\ndirect\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.500000 Pr\n0.356059 0.856059 0.278712 Te\n0.143941 0.356059 0.278712 Te\n0.856059 0.643941 0.278712 Te\n0.356059 0.143941 0.721289 Te\n0.643941 0.856059 0.721289 Te\n0.643941 0.143941 0.278712 Te\n0.856059 0.356059 0.721289 Te\n0.143941 0.643941 0.721289 Te\n",
"nsites": 12,
"nelements": 3,
"elements": [
"K",
"Pr",
"Te"
],
"chemical_system": "K-Pr-Te",
"density": 5.392335889597991,
"density_atomic": 0.028221140704463257,
"volume": 425.21314519728696,
"volume_molar": 21.339111778169833,
"formula_full": "K2 Pr2 Te8",
"formula_reduced": "KPrTe4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.6485998194444447,
"spacegroup": 125
},
{
"id": "jvasp-64600",
"created_at": "2022-09-04T14:38:11.679243Z",
"updated_at": "2022-09-04T14:38:11.679260Z",
"structure_string": "Ba4 Na1 Si1\n1.0\n0.000000 5.076017 5.076017\n5.076017 -0.000000 5.076017\n5.076017 5.076017 0.000000\nBa Na Si\n4 1 1\ndirect\n0.118769 0.627077 0.627077 Ba\n0.627077 0.627077 0.627077 Ba\n0.627077 0.118769 0.627077 Ba\n0.627077 0.627077 0.118769 Ba\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Si"
],
"chemical_system": "Ba-Na-Si",
"density": 3.8113469033366343,
"density_atomic": 0.022937815278437638,
"volume": 261.5767860699538,
"volume_molar": 26.25420375436115,
"formula_full": "Ba4 Na1 Si1",
"formula_reduced": "Ba4NaSi",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3463702466666665,
"spacegroup": 216
},
{
"id": "jvasp-30343",
"created_at": "2022-09-04T14:37:12.201066Z",
"updated_at": "2022-09-04T14:37:12.201089Z",
"structure_string": "Fe1 Co1 O4\n1.0\n1.408827 0.813387 4.354238\n-2.829089 1.629215 8.709901\n-1.416347 -0.817728 8.709901\nFe Co O\n1 1 4\ndirect\n0.500000 0.000000 0.500000 Fe\n0.499999 0.500000 0.500001 Co\n0.241698 0.499999 0.235373 O\n0.758301 0.500000 0.764629 O\n0.233214 0.000000 0.239617 O\n0.766786 0.000000 0.760382 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Fe",
"Co",
"O"
],
"chemical_system": "Co-Fe-O",
"density": 4.934974253342167,
"density_atomic": 0.09974205829443315,
"volume": 60.15516525925628,
"volume_molar": 6.03771454387172,
"formula_full": "Fe1 Co1 O4",
"formula_reduced": "FeCoO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.843906733333333,
"spacegroup": 10
},
{
"id": "jvasp-34315",
"created_at": "2022-09-04T14:37:12.211884Z",
"updated_at": "2022-09-04T14:37:12.211919Z",
"structure_string": "Cu2 Se2 O8\n1.0\n4.892506 0.196590 0.000000\n-1.909757 4.508668 0.000000\n0.000000 0.000000 6.517556\nCu Se O\n2 2 8\ndirect\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.647697 0.352303 0.250000 Se\n0.352303 0.647697 0.750001 Se\n0.757039 0.242962 0.467392 O\n0.242961 0.757039 0.532609 O\n0.228257 0.275053 0.750001 O\n0.771743 0.724947 0.250000 O\n0.757039 0.242962 0.032608 O\n0.242961 0.757039 0.967392 O\n0.724947 0.771743 0.750001 O\n0.275053 0.228257 0.250000 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Cu",
"Se",
"O"
],
"chemical_system": "Cu-O-Se",
"density": 4.690431801157389,
"density_atomic": 0.08207055143303504,
"volume": 146.2156618965979,
"volume_molar": 7.337760810482343,
"formula_full": "Cu2 Se2 O8",
"formula_reduced": "CuSeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.863501302777778,
"spacegroup": 63
},
{
"id": "jvasp-37423",
"created_at": "2022-09-04T14:37:57.078315Z",
"updated_at": "2022-09-04T14:37:57.078337Z",
"structure_string": "W2 S2 Cl8\n1.0\n5.965910 0.167321 -1.065265\n1.417494 7.046093 -0.079845\n0.356041 1.623137 7.470708\nW S Cl\n2 2 8\ndirect\n0.850875 0.757848 0.781865 W\n0.149124 0.242152 0.218137 W\n0.613999 0.035328 0.706454 S\n0.386001 -0.035328 0.293547 S\n0.179900 0.832737 0.896129 Cl\n-0.000805 0.738216 0.522054 Cl\n0.804348 0.654258 0.085509 Cl\n0.625197 0.555784 0.710794 Cl\n0.374802 0.444215 0.289208 Cl\n0.195652 0.345741 0.914492 Cl\n0.000804 0.261784 0.477946 Cl\n0.820099 0.167263 0.103872 Cl\n",
"nsites": 12,
"nelements": 3,
"elements": [
"W",
"S",
"Cl"
],
"chemical_system": "Cl-S-W",
"density": 3.792404039623708,
"density_atomic": 0.038306914605622404,
"volume": 313.25937167068867,
"volume_molar": 15.720766921583696,
"formula_full": "W2 S2 Cl8",
"formula_reduced": "WSCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.7450827116666667,
"spacegroup": 2
},
{
"id": "jvasp-21597",
"created_at": "2022-09-04T14:37:47.208477Z",
"updated_at": "2022-09-04T14:37:47.208499Z",
"structure_string": "Ho2 Ni8 B2\n1.0\n2.478652 -4.293151 -0.000000\n2.478652 4.293151 -0.000000\n0.000000 -0.000000 6.964530\nHo Ni B\n2 8 2\ndirect\n0.000000 0.000000 0.500000 Ho\n0.000000 0.000000 0.000000 Ho\n-0.000000 0.500000 0.791404 Ni\n0.500000 0.500000 0.208596 Ni\n0.500000 -0.000000 0.208596 Ni\n-0.000000 0.500000 0.208596 Ni\n0.333333 0.666666 0.500000 Ni\n0.666666 0.333333 0.500000 Ni\n0.500000 0.500000 0.791404 Ni\n0.500000 -0.000000 0.791404 Ni\n0.333333 0.666666 0.000000 B\n0.666666 0.333333 0.000000 B\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ho",
"Ni",
"B"
],
"chemical_system": "B-Ho-Ni",
"density": 9.198023388053697,
"density_atomic": 0.08095948119367796,
"volume": 148.22229370878264,
"volume_molar": 7.4384626373695975,
"formula_full": "Ho2 Ni8 B2",
"formula_reduced": "HoNi4B",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.766556291666667,
"spacegroup": 191
},
{
"id": "jvasp-14064",
"created_at": "2022-09-04T14:37:39.561395Z",
"updated_at": "2022-09-04T14:37:39.561430Z",
"structure_string": "Y2 Ni8 B2\n1.0\n2.486240 -4.306294 0.000000\n2.486240 4.306294 -0.000000\n0.000000 0.000000 6.963903\nY Ni B\n2 8 2\ndirect\n0.000000 0.000000 0.500000 Y\n0.000000 0.000000 0.000000 Y\n0.333333 0.666667 0.000000 Ni\n0.666667 0.333333 0.000000 Ni\n0.500000 0.500000 0.708538 Ni\n0.500000 0.000000 0.708538 Ni\n0.000000 0.500000 0.708538 Ni\n0.500000 0.500000 0.291462 Ni\n0.500000 0.000000 0.291462 Ni\n0.000000 0.500000 0.291462 Ni\n0.666667 0.333333 0.500000 B\n0.333333 0.666667 0.500000 B\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Y",
"Ni",
"B"
],
"chemical_system": "B-Ni-Y",
"density": 7.449607318906661,
"density_atomic": 0.08047330002399593,
"volume": 149.11778187823515,
"volume_molar": 7.483402269080911,
"formula_full": "Y2 Ni8 B2",
"formula_reduced": "YNi4B",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.047124605555556,
"spacegroup": 191
}
]
}