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_atomic&page=3526",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=3524",
"results": [
{
"id": "jvasp-105537",
"created_at": "2022-09-04T14:36:56.590664Z",
"updated_at": "2022-09-04T14:36:56.590688Z",
"structure_string": "Ce2 Zr1 O6\n1.0\n3.797248 0.000000 0.000000\n-1.898624 3.288513 0.000000\n-0.000000 -0.000000 9.184015\nCe Zr O\n2 1 6\ndirect\n0.333334 0.666666 0.675198 Ce\n0.666667 0.333333 0.324802 Ce\n0.000000 0.000000 0.000000 Zr\n0.666667 0.333333 0.069884 O\n0.000000 0.000000 0.765364 O\n0.333334 0.666666 0.412539 O\n0.333334 0.666666 0.930117 O\n0.666667 0.333333 0.587462 O\n0.000000 0.000000 0.234637 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ce",
"Zr",
"O"
],
"chemical_system": "Ce-O-Zr",
"density": 6.768390105330509,
"density_atomic": 0.07847682063944834,
"volume": 114.68354511135641,
"volume_molar": 7.673782794626646,
"formula_full": "Ce2 Zr1 O6",
"formula_reduced": "Ce2ZrO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.6329162777777784,
"spacegroup": 164
},
{
"id": "jvasp-74360",
"created_at": "2022-09-04T14:35:48.631290Z",
"updated_at": "2022-09-04T14:35:48.631306Z",
"structure_string": "Be2 Nb1 Ru1\n1.0\n-1.884174 1.884174 3.589330\n1.884174 -1.884174 3.589330\n1.884174 1.884174 -3.589330\nBe Nb Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.500000 0.500000 0.000000 Nb\n0.749999 0.250000 0.499999 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Nb",
"Ru"
],
"chemical_system": "Be-Nb-Ru",
"density": 6.906707900373135,
"density_atomic": 0.07847739851068597,
"volume": 50.97008917102846,
"volume_molar": 7.673726288442127,
"formula_full": "Be2 Nb1 Ru1",
"formula_reduced": "Be2NbRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.397060525,
"spacegroup": 119
},
{
"id": "jvasp-21492",
"created_at": "2022-09-04T14:38:16.495504Z",
"updated_at": "2022-09-04T14:38:16.495524Z",
"structure_string": "Sr2 Pd6 O8\n1.0\n5.885451 0.000000 -0.000000\n-0.000000 5.885451 0.000000\n-0.000000 -0.000000 5.885451\nSr Pd O\n2 6 8\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.750000 0.000000 0.500000 Pd\n0.000000 0.500000 0.250000 Pd\n0.000000 0.500000 0.750000 Pd\n0.250000 0.000000 0.500000 Pd\n0.500000 0.750000 0.000000 Pd\n0.500000 0.250000 0.000000 Pd\n0.750000 0.250000 0.250000 O\n0.250000 0.250000 0.750000 O\n0.250000 0.750000 0.250000 O\n0.750000 0.750000 0.750000 O\n0.250000 0.250000 0.250000 O\n0.750000 0.750000 0.250000 O\n0.750000 0.250000 0.750000 O\n0.250000 0.750000 0.750000 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sr",
"Pd",
"O"
],
"chemical_system": "O-Pd-Sr",
"density": 7.670927524067942,
"density_atomic": 0.07848392928550363,
"volume": 203.86339146956138,
"volume_molar": 7.6730877452542625,
"formula_full": "Sr2 Pd6 O8",
"formula_reduced": "SrPd3O4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.88178217625,
"spacegroup": 223
},
{
"id": "jvasp-26410",
"created_at": "2022-09-04T14:37:45.752217Z",
"updated_at": "2022-09-04T14:37:45.752237Z",
"structure_string": "Li1 Sc1 As2 O7\n1.0\n4.861528 -0.008855 -0.734439\n-1.021163 5.253772 -1.238841\n-0.013562 -0.008467 5.493592\nLi Sc As O\n1 1 2 7\ndirect\n0.500002 0.248292 0.751703 Li\n0.500005 0.628760 0.371236 Sc\n0.908718 0.181094 0.253632 As\n0.091289 0.746365 0.818907 As\n0.220514 0.335649 0.448526 O\n0.752107 0.963157 0.386133 O\n-0.000002 0.039780 0.960218 O\n0.317228 0.861628 0.645728 O\n0.682773 0.354268 0.138365 O\n0.779483 0.551475 0.664351 O\n0.247891 0.613870 0.036848 O\n",
"nsites": 11,
"nelements": 4,
"elements": [
"Li",
"Sc",
"As",
"O"
],
"chemical_system": "As-Li-O-Sc",
"density": 3.7171224618543715,
"density_atomic": 0.07848492067015458,
"volume": 140.15431124953616,
"volume_molar": 7.6729908224141665,
"formula_full": "Li1 Sc1 As2 O7",
"formula_reduced": "LiScAs2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.54298575,
"spacegroup": 5
},
{
"id": "jvasp-97545",
"created_at": "2022-09-04T14:36:02.277788Z",
"updated_at": "2022-09-04T14:36:02.277807Z",
"structure_string": "La4 Ge6 O18\n1.0\n7.322635 0.004677 -2.612938\n0.074015 2.883433 8.389132\n-0.049899 -2.900796 8.447959\nLa Ge O\n4 6 18\ndirect\n0.799773 0.915181 0.868210 La\n0.200227 0.084818 0.131790 La\n0.816920 0.225345 0.190341 La\n0.183080 0.774654 0.809659 La\n0.485536 0.323079 0.337040 Ge\n0.072977 0.425958 0.426801 Ge\n0.514464 0.676920 0.662961 Ge\n0.513489 0.764190 0.238014 Ge\n0.486511 0.235809 0.761987 Ge\n0.927023 0.574041 0.573200 Ge\n0.681773 0.217778 0.400521 O\n0.970867 0.883556 0.422397 O\n0.029133 0.116443 0.577604 O\n0.463586 0.117005 0.649284 O\n0.536414 0.882994 0.350717 O\n0.011017 0.577541 0.120018 O\n0.988983 0.422458 0.879983 O\n0.318226 0.782221 0.599480 O\n0.322829 0.964005 0.989163 O\n0.481895 0.351584 0.870550 O\n0.327647 0.487356 0.466969 O\n0.672353 0.512643 0.533032 O\n0.715651 0.675480 0.822554 O\n0.677171 0.035994 0.010837 O\n0.992080 0.709297 0.290215 O\n0.007920 0.290702 0.709786 O\n0.518105 0.648415 0.129451 O\n0.284349 0.324519 0.177446 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"La",
"Ge",
"O"
],
"chemical_system": "Ge-La-O",
"density": 5.955359999461598,
"density_atomic": 0.07848619376346166,
"volume": 356.75064183116336,
"volume_molar": 7.672866361884322,
"formula_full": "La4 Ge6 O18",
"formula_reduced": "La2(GeO3)3",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 2.275890667857143,
"spacegroup": 2
},
{
"id": "jvasp-31338",
"created_at": "2022-09-04T14:38:08.625565Z",
"updated_at": "2022-09-04T14:38:08.625591Z",
"structure_string": "In6 Te3 O18\n1.0\n4.515111 -7.820402 -0.000000\n4.515111 7.820402 0.000000\n-0.000000 -0.000000 4.871264\nIn Te O\n6 3 18\ndirect\n0.000000 0.630145 0.000000 In\n0.369855 0.369855 0.000000 In\n0.630145 0.000000 0.000000 In\n0.000000 0.293530 0.500000 In\n0.706470 0.706470 0.500000 In\n0.293530 0.000000 0.500000 In\n0.333333 0.666667 0.509039 Te\n0.666667 0.333333 0.490960 Te\n0.000000 0.000000 0.000000 Te\n0.589484 0.461416 0.265637 O\n0.761393 0.220827 0.716260 O\n0.220827 0.761393 0.283739 O\n0.540566 0.779173 0.283739 O\n0.238607 0.459434 0.283739 O\n0.538583 0.128068 0.265637 O\n0.871931 0.410516 0.265637 O\n0.461416 0.589484 0.734362 O\n0.206231 0.120471 0.221149 O\n0.410516 0.871931 0.734362 O\n0.914239 0.793769 0.221149 O\n0.459434 0.238607 0.716260 O\n0.879529 0.085761 0.221149 O\n0.085761 0.879529 0.778850 O\n0.793769 0.914239 0.778850 O\n0.120471 0.206231 0.778850 O\n0.128068 0.538583 0.734362 O\n0.779173 0.540566 0.716260 O\n",
"nsites": 27,
"nelements": 3,
"elements": [
"In",
"Te",
"O"
],
"chemical_system": "In-O-Te",
"density": 6.563298075624697,
"density_atomic": 0.07848643298099887,
"volume": 344.00849897888145,
"volume_molar": 7.672842975878297,
"formula_full": "In6 Te3 O18",
"formula_reduced": "In2TeO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.7275987451851853,
"spacegroup": 150
},
{
"id": "jvasp-22577",
"created_at": "2022-09-04T14:36:59.845228Z",
"updated_at": "2022-09-04T14:36:59.845257Z",
"structure_string": "K1 Mn1 F3\n1.0\n3.993808 -0.000000 -0.000000\n-0.000000 3.993808 -0.000000\n0.000000 0.000000 3.993808\nK Mn F\n1 1 3\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 0.000000 F\n0.000000 0.000000 0.500000 F\n0.000000 0.500000 0.000000 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"K",
"Mn",
"F"
],
"chemical_system": "F-K-Mn",
"density": 3.93690778575591,
"density_atomic": 0.078488938672274,
"volume": 63.70324385296137,
"volume_molar": 7.6725980270227625,
"formula_full": "K1 Mn1 F3",
"formula_reduced": "KMnF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.2689037241379309,
"spacegroup": 221
},
{
"id": "jvasp-35230",
"created_at": "2022-09-04T14:37:55.126510Z",
"updated_at": "2022-09-04T14:37:55.126537Z",
"structure_string": "Lu4 O12\n1.0\n-3.707514 -3.707514 3.707514\n-3.707514 3.707514 -3.707514\n3.707514 -3.707514 -3.707514\nLu O\n4 12\ndirect\n0.499999 0.499999 0.499999 Lu\n0.499999 0.000000 0.000000 Lu\n0.000000 0.499999 0.000000 Lu\n0.000000 0.000000 0.499999 Lu\n0.900145 0.681226 0.581372 O\n0.099854 0.318773 0.418627 O\n0.099854 0.681226 0.781080 O\n0.900145 0.318773 0.218919 O\n0.681226 0.581372 0.900145 O\n0.318773 0.418627 0.099854 O\n0.681226 0.781080 0.099854 O\n0.318773 0.218919 0.900145 O\n0.581372 0.900145 0.681226 O\n0.418627 0.099854 0.318773 O\n0.781080 0.099854 0.681226 O\n0.218919 0.900145 0.318773 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Lu",
"O"
],
"chemical_system": "Lu-O",
"density": 7.2650362056502145,
"density_atomic": 0.07848950539732898,
"volume": 203.8489084496701,
"volume_molar": 7.672542627851667,
"formula_full": "Lu4 O12",
"formula_reduced": "LuO3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.6394865625,
"spacegroup": 204
},
{
"id": "jvasp-43957",
"created_at": "2022-09-04T14:37:31.960287Z",
"updated_at": "2022-09-04T14:37:31.960313Z",
"structure_string": "Li4 Mn2 F12\n1.0\n6.158337 -0.000000 0.000000\n-0.000000 6.158337 0.000000\n0.000000 0.000000 6.046564\nLi Mn F\n4 2 12\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.500000 0.749987 Mn\n0.500000 0.000000 0.250012 Mn\n0.500000 0.000000 0.544691 F\n0.500000 0.000000 0.955341 F\n0.500447 0.699779 0.250009 F\n0.699779 0.500447 0.749990 F\n0.300222 0.499553 0.749990 F\n0.000000 0.500000 0.455309 F\n0.000000 0.500000 0.044659 F\n0.800222 0.000447 0.250009 F\n0.000447 0.800222 0.749990 F\n0.199779 0.999553 0.250009 F\n0.499553 0.300222 0.250009 F\n0.999553 0.199779 0.749990 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 2.647552548221384,
"density_atomic": 0.07849408824134571,
"volume": 229.31663266990776,
"volume_molar": 7.672094669707773,
"formula_full": "Li4 Mn2 F12",
"formula_reduced": "Li2MnF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.3193532151532566,
"spacegroup": 139
},
{
"id": "jvasp-56996",
"created_at": "2022-09-04T14:37:00.021440Z",
"updated_at": "2022-09-04T14:37:00.021477Z",
"structure_string": "Ta4 Fe8\n1.0\n2.373697 -4.111364 0.000000\n2.373697 4.111364 -0.000000\n0.000000 0.000000 7.832514\nTa Fe\n4 8\ndirect\n0.666667 0.333334 0.566265 Ta\n0.333334 0.666667 0.066265 Ta\n0.333334 0.666667 0.433735 Ta\n0.666667 0.333334 0.933734 Ta\n0.341416 0.170708 0.250000 Fe\n0.170708 0.341416 0.750000 Fe\n0.170709 0.829292 0.750000 Fe\n0.829292 0.170709 0.250000 Fe\n0.000000 0.000000 0.000000 Fe\n0.658585 0.829293 0.750000 Fe\n0.829293 0.658585 0.250000 Fe\n0.000000 0.000000 0.500000 Fe\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ta",
"Fe"
],
"chemical_system": "Fe-Ta",
"density": 12.714440258902481,
"density_atomic": 0.07849443375223525,
"volume": 152.8770821874778,
"volume_molar": 7.672060899259,
"formula_full": "Ta4 Fe8",
"formula_reduced": "TaFe2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.9383267333333336,
"spacegroup": 194
},
{
"id": "jvasp-67998",
"created_at": "2022-09-04T14:35:44.163385Z",
"updated_at": "2022-09-04T14:35:44.163411Z",
"structure_string": "Be1 Cr1 Ir2\n1.0\n-1.790041 1.790041 3.975865\n1.790041 -1.790041 3.975865\n1.790041 1.790041 -3.975865\nBe Cr Ir\n1 1 2\ndirect\n0.500001 0.500001 0.000000 Be\n0.750000 0.250000 0.500000 Cr\n0.000000 0.000000 0.000000 Ir\n0.250000 0.750000 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cr",
"Ir"
],
"chemical_system": "Be-Cr-Ir",
"density": 14.515197796622008,
"density_atomic": 0.07849507588568568,
"volume": 50.958610522592515,
"volume_molar": 7.6719981375267325,
"formula_full": "Be1 Cr1 Ir2",
"formula_reduced": "BeCrIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.923516425,
"spacegroup": 119
},
{
"id": "jvasp-50449",
"created_at": "2022-09-04T14:37:14.478333Z",
"updated_at": "2022-09-04T14:37:14.478351Z",
"structure_string": "Sr2 Sc4 O8\n1.0\n1.597241 5.244009 -0.000000\n-1.597241 5.244009 -0.000000\n0.000000 0.000000 10.646230\nSr Sc O\n2 4 8\ndirect\n0.111852 0.111852 0.250000 Sr\n0.888148 0.888148 0.750000 Sr\n0.365122 0.365122 0.429509 Sc\n0.634878 0.634878 0.570491 Sc\n0.365122 0.365122 0.070491 Sc\n0.634878 0.634878 0.929509 Sc\n0.000000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.262980 0.262980 0.604865 O\n0.435441 0.435441 0.250000 O\n0.564559 0.564559 0.750000 O\n0.737021 0.737021 0.395135 O\n0.262980 0.262980 0.895135 O\n0.737021 0.737021 0.104865 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Sr",
"Sc",
"O"
],
"chemical_system": "O-Sc-Sr",
"density": 4.497688984795995,
"density_atomic": 0.07849975793985357,
"volume": 178.34449898210877,
"volume_molar": 7.671540547442399,
"formula_full": "Sr2 Sc4 O8",
"formula_reduced": "SrSc2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.8134586871428569,
"spacegroup": 63
}
]
}