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_reduced&page=429",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=427",
"results": [
{
"id": "jvasp-1294",
"created_at": "2022-09-04T14:36:17.571797Z",
"updated_at": "2022-09-04T14:36:17.571823Z",
"structure_string": "Ba1 Se1\n1.0\n4.065586 0.000000 2.347268\n1.355195 3.833071 2.347268\n-0.000000 -0.000000 4.694534\nBa Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500001 0.500000 0.500000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 4.909271033851517,
"density_atomic": 0.027338047321439903,
"volume": 73.15811464089087,
"volume_molar": 22.028423205183085,
"formula_full": "Ba1 Se1",
"formula_reduced": "BaSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0129599999999998,
"spacegroup": 225
},
{
"id": "jvasp-119963",
"created_at": "2022-09-04T14:38:49.356193Z",
"updated_at": "2022-09-04T14:38:49.356222Z",
"structure_string": "Ba2 Se2\n1.0\n8.677699 -2.497922 -3.330053\n7.304342 -6.870340 -3.610766\n0.237539 -2.223701 -4.004335\nBa Se\n2 2\ndirect\n-0.025272 0.070838 -0.203570 Ba\n0.143337 0.409189 0.119823 Ba\n0.559701 0.241716 0.454659 Se\n0.391739 -0.095615 0.129129 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 4.893328018972552,
"density_atomic": 0.02724926613738993,
"volume": 146.7929440680027,
"volume_molar": 22.10019429380798,
"formula_full": "Ba2 Se2",
"formula_reduced": "BaSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.03966,
"spacegroup": 160
},
{
"id": "jvasp-119968",
"created_at": "2022-09-04T14:38:54.413994Z",
"updated_at": "2022-09-04T14:38:54.414019Z",
"structure_string": "Ba1 Se1\n1.0\n4.524387 -0.000000 0.000000\n-0.000000 4.524387 0.000000\n0.000000 -0.000000 5.342754\nBa Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.000000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 3.283937208321098,
"density_atomic": 0.018287120467106552,
"volume": 109.36658964966323,
"volume_molar": 32.93104986557155,
"formula_full": "Ba1 Se1",
"formula_reduced": "BaSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2985199999999999,
"spacegroup": 123
},
{
"id": "jvasp-117624",
"created_at": "2022-09-04T14:38:51.897868Z",
"updated_at": "2022-09-04T14:38:51.897896Z",
"structure_string": "Ba1 Se1\n1.0\n4.470795 -1.111017 0.912268\n1.195169 -4.480962 0.739867\n-1.229324 1.415219 -4.305892\nBa Se\n1 1\ndirect\n0.921710 0.745823 0.047399 Ba\n0.421732 0.245857 0.547365 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 4.893669673754848,
"density_atomic": 0.02725116869574159,
"volume": 73.39134781080162,
"volume_molar": 22.098651354138262,
"formula_full": "Ba1 Se1",
"formula_reduced": "BaSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-119960",
"created_at": "2022-09-04T14:38:53.692375Z",
"updated_at": "2022-09-04T14:38:53.692392Z",
"structure_string": "Ba1 Se1\n1.0\n7.408481 0.000000 0.000000\n0.000000 7.408481 0.000000\n0.000000 0.000000 10.583545\nBa Se\n1 1\ndirect\n0.000000 0.000000 0.869643 Ba\n0.000000 0.000000 0.130356 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 0.6182868512939949,
"density_atomic": 0.0034430275049691906,
"volume": 580.8841193146079,
"volume_molar": 174.90829658806018,
"formula_full": "Ba1 Se1",
"formula_reduced": "BaSe",
"formula_anonymous": "AB",
"energy_above_hull": 1.254725,
"spacegroup": 99
},
{
"id": "jvasp-117621",
"created_at": "2022-09-04T14:38:36.229416Z",
"updated_at": "2022-09-04T14:38:36.229436Z",
"structure_string": "Ba1 Se1\n1.0\n5.157240 -0.232885 0.364737\n2.346908 -4.568776 0.568612\n0.120099 -3.355455 -3.937401\nBa Se\n1 1\ndirect\n0.927562 0.974123 0.999276 Ba\n0.677516 0.474161 0.249173 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 3.6733048687525396,
"density_atomic": 0.020455375479493193,
"volume": 97.7738102145829,
"volume_molar": 29.4403823876872,
"formula_full": "Ba1 Se1",
"formula_reduced": "BaSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1725949999999998,
"spacegroup": 216
},
{
"id": "jvasp-7670",
"created_at": "2022-09-04T14:37:07.624157Z",
"updated_at": "2022-09-04T14:37:07.624180Z",
"structure_string": "Ba1 Se1\n1.0\n3.983533 -0.000000 0.000000\n0.000000 3.983533 0.000000\n0.000000 0.000000 3.983533\nBa Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 5.681647116993188,
"density_atomic": 0.031639144931508024,
"volume": 63.212833479841876,
"volume_molar": 19.03382905270242,
"formula_full": "Ba1 Se1",
"formula_reduced": "BaSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0947799999999998,
"spacegroup": 221
},
{
"id": "jvasp-2589",
"created_at": "2022-09-04T14:36:54.463249Z",
"updated_at": "2022-09-04T14:36:54.463275Z",
"structure_string": "Ba2 Se4\n1.0\n4.739299 0.000000 1.421251\n2.280886 4.900390 1.006616\n-0.015900 0.056247 8.665473\nBa Se\n2 4\ndirect\n0.125417 0.250000 0.750000 Ba\n0.874583 0.750000 0.250000 Ba\n0.469396 0.284114 0.027876 Se\n0.781386 0.215886 0.472124 Se\n0.218615 0.784114 0.527876 Se\n0.530604 0.715887 0.972124 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 4.871628628969118,
"density_atomic": 0.02980992187311265,
"volume": 201.27526752801583,
"volume_molar": 20.201799876006145,
"formula_full": "Ba2 Se4",
"formula_reduced": "BaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7388244555555553,
"spacegroup": 15
},
{
"id": "jvasp-117619",
"created_at": "2022-09-04T14:38:36.198582Z",
"updated_at": "2022-09-04T14:38:36.198617Z",
"structure_string": "Ba1 Se2\n1.0\n5.273159 0.000000 0.000000\n0.000000 5.155720 0.000000\n0.000000 0.000000 5.947697\nBa Se\n1 2\ndirect\n0.466645 0.000000 0.000000 Ba\n-0.033322 0.000000 0.703175 Se\n-0.033322 0.000000 0.296825 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 3.0319746449455462,
"density_atomic": 0.018552918165728714,
"volume": 161.6996298480772,
"volume_molar": 32.45926439283394,
"formula_full": "Ba1 Se2",
"formula_reduced": "BaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9595777888888888,
"spacegroup": 47
},
{
"id": "jvasp-117620",
"created_at": "2022-09-04T14:38:52.154606Z",
"updated_at": "2022-09-04T14:38:52.154629Z",
"structure_string": "Ba1 Se2\n1.0\n5.105974 -0.616452 -0.820855\n0.763709 -4.391448 -0.533618\n1.488982 -3.942298 -4.941100\nBa Se\n1 2\ndirect\n0.196017 0.004107 0.063358 Ba\n0.899850 0.004138 0.622769 Se\n0.492191 0.004076 0.503947 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 5.143475805542901,
"density_atomic": 0.0314733785345876,
"volume": 95.31865149790502,
"volume_molar": 19.13407787912563,
"formula_full": "Ba1 Se2",
"formula_reduced": "BaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.744631122222222,
"spacegroup": 12
},
{
"id": "jvasp-119966",
"created_at": "2022-09-04T14:38:49.411866Z",
"updated_at": "2022-09-04T14:38:49.411889Z",
"structure_string": "Ba1 Se2\n1.0\n4.873952 0.000000 -1.867244\n0.000000 5.209251 0.000000\n-0.801502 0.000000 5.974838\nBa Se\n1 2\ndirect\n0.466730 0.000000 0.133345 Ba\n-0.263452 0.000000 -0.277091 Se\n0.196722 0.000000 0.543746 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 3.4069463340706103,
"density_atomic": 0.020847402743427855,
"volume": 143.90281786759985,
"volume_molar": 28.88676749864431,
"formula_full": "Ba1 Se2",
"formula_reduced": "BaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9360377888888888,
"spacegroup": 10
},
{
"id": "jvasp-119964",
"created_at": "2022-09-04T14:38:52.362141Z",
"updated_at": "2022-09-04T14:38:52.362175Z",
"structure_string": "Ba1 Se2\n1.0\n5.014472 0.025105 0.207587\n2.150777 -9.851931 1.287978\n0.083661 3.643997 -2.486546\nBa Se\n1 2\ndirect\n0.087991 0.929160 0.031500 Ba\n0.015373 0.458704 0.590609 Se\n0.526581 0.053212 0.779561 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Se"
],
"chemical_system": "Ba-Se",
"density": 4.842591708428359,
"density_atomic": 0.029632242415444515,
"volume": 101.24107240822183,
"volume_molar": 20.322932957855468,
"formula_full": "Ba1 Se2",
"formula_reduced": "BaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7586577888888888,
"spacegroup": 6
}
]
}