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=4605",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=4603",
"results": [
{
"id": "jvasp-117590",
"created_at": "2022-09-04T14:38:53.375068Z",
"updated_at": "2022-09-04T14:38:53.375100Z",
"structure_string": "Ba1 O1 F1\n1.0\n4.942433 0.000000 0.000000\n0.000000 4.942433 0.000000\n0.000000 -0.000000 7.274732\nBa O F\n1 1 1\ndirect\n0.000000 0.000000 0.362891 Ba\n0.000000 0.000000 0.663996 O\n0.000000 0.000000 0.049702 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"O",
"F"
],
"chemical_system": "Ba-F-O",
"density": 1.6102685418438845,
"density_atomic": 0.016881952528586992,
"volume": 177.70456319670137,
"volume_molar": 35.672063108828375,
"formula_full": "Ba1 O1 F1",
"formula_reduced": "BaOF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.415699413333333,
"spacegroup": 99
},
{
"id": "jvasp-78405",
"created_at": "2022-09-04T14:37:14.145383Z",
"updated_at": "2022-09-04T14:37:14.145411Z",
"structure_string": "Ba2\n1.0\n0.000000 4.374004 0.000000\n0.000000 -2.187002 3.793870\n7.140421 0.000000 0.000000\nBa\n2\ndirect\n0.833820 0.167641 0.750000 Ba\n0.166180 0.832359 0.250000 Ba\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ba"
],
"chemical_system": "Ba",
"density": 3.8490148444453167,
"density_atomic": 0.016878916155300468,
"volume": 118.49102048960307,
"volume_molar": 35.67848020922169,
"formula_full": "Ba2",
"formula_reduced": "Ba",
"formula_anonymous": "A",
"energy_above_hull": 0.0148899999999999,
"spacegroup": 194
},
{
"id": "jvasp-25242",
"created_at": "2022-09-04T14:38:16.490606Z",
"updated_at": "2022-09-04T14:38:16.490622Z",
"structure_string": "Ba2\n1.0\n4.377573 0.000000 -0.000000\n-2.188787 3.791090 -0.000000\n-0.000000 0.000000 7.140938\nBa\n2\ndirect\n0.333332 0.666667 0.250000 Ba\n0.666666 0.333333 0.750000 Ba\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ba"
],
"chemical_system": "Ba",
"density": 3.848418305150356,
"density_atomic": 0.016876300177667253,
"volume": 118.50938765871445,
"volume_molar": 35.684010693109265,
"formula_full": "Ba2",
"formula_reduced": "Ba",
"formula_anonymous": "A",
"energy_above_hull": 0.01488,
"spacegroup": 194
},
{
"id": "jvasp-14788",
"created_at": "2022-09-04T14:38:32.532623Z",
"updated_at": "2022-09-04T14:38:32.532642Z",
"structure_string": "Ba2\n1.0\n2.188788 -3.791090 -0.000000\n2.188788 3.791090 -0.000000\n0.000000 -0.000000 7.140938\nBa\n2\ndirect\n0.333334 0.666668 0.250000 Ba\n0.666668 0.333334 0.750000 Ba\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ba"
],
"chemical_system": "Ba",
"density": 3.8484156677878256,
"density_atomic": 0.0168762886121569,
"volume": 118.50946887453038,
"volume_molar": 35.68403514776304,
"formula_full": "Ba2",
"formula_reduced": "Ba",
"formula_anonymous": "A",
"energy_above_hull": 0.01488,
"spacegroup": 194
},
{
"id": "jvasp-107180",
"created_at": "2022-09-04T14:36:46.409483Z",
"updated_at": "2022-09-04T14:36:46.409499Z",
"structure_string": "K3 Na1\n1.0\n6.017793 -0.000000 3.474374\n2.005931 5.673630 3.474374\n-0.000000 -0.000000 6.948749\nK Na\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.749999 0.750000 0.749999 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Na\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Na"
],
"chemical_system": "K-Na",
"density": 0.9818709939326308,
"density_atomic": 0.016859904552691696,
"volume": 237.2492671888464,
"volume_molar": 35.71871205545206,
"formula_full": "K3 Na1",
"formula_reduced": "K3Na",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0002099999999999,
"spacegroup": 225
},
{
"id": "jvasp-21194",
"created_at": "2022-09-04T14:38:01.808389Z",
"updated_at": "2022-09-04T14:38:01.808416Z",
"structure_string": "Ba1\n1.0\n4.013664 -0.000000 -1.419044\n-2.006832 3.475935 -1.419044\n-0.000000 -0.000000 4.257134\nBa\n1\ndirect\n0.000000 0.000000 0.000000 Ba\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ba"
],
"chemical_system": "Ba",
"density": 3.839503342504838,
"density_atomic": 0.016837205782581067,
"volume": 59.39227760906445,
"volume_molar": 35.766865581878236,
"formula_full": "Ba1",
"formula_reduced": "Ba",
"formula_anonymous": "A",
"energy_above_hull": 0.0,
"spacegroup": 229
},
{
"id": "jvasp-14604",
"created_at": "2022-09-04T14:37:09.346276Z",
"updated_at": "2022-09-04T14:37:09.346295Z",
"structure_string": "Ba1\n1.0\n4.013667 -0.000000 -1.419045\n-2.006833 3.475937 -1.419045\n-0.000000 -0.000000 4.257137\nBa\n1\ndirect\n0.000000 0.000000 0.000000 Ba\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ba"
],
"chemical_system": "Ba",
"density": 3.839495557803619,
"density_atomic": 0.016837171644671894,
"volume": 59.39239802882505,
"volume_molar": 35.7669381003531,
"formula_full": "Ba1",
"formula_reduced": "Ba",
"formula_anonymous": "A",
"energy_above_hull": 4.02999999998821e-06,
"spacegroup": 229
},
{
"id": "jvasp-114099",
"created_at": "2022-09-04T14:38:50.065991Z",
"updated_at": "2022-09-04T14:38:50.066021Z",
"structure_string": "Ba1 Te2\n1.0\n5.782028 0.000000 0.000000\n0.000000 4.859847 0.000000\n0.000000 0.000000 6.357967\nBa Te\n1 2\ndirect\n0.466679 0.000000 0.000000 Ba\n-0.033339 0.000000 0.726765 Te\n-0.033339 0.000000 0.273235 Te\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Te"
],
"chemical_system": "Ba-Te",
"density": 3.6483590783628608,
"density_atomic": 0.016791913871288627,
"volume": 178.65741945767718,
"volume_molar": 35.86333759308316,
"formula_full": "Ba1 Te2",
"formula_reduced": "BaTe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7548925888888889,
"spacegroup": 47
},
{
"id": "jvasp-25246",
"created_at": "2022-09-04T14:38:27.538283Z",
"updated_at": "2022-09-04T14:38:27.538316Z",
"structure_string": "Ba4\n1.0\n6.868915 -0.000000 2.733476\n3.434458 5.677569 1.366738\n1.335192 0.000000 6.641952\nBa\n4\ndirect\n0.178899 0.500000 0.142202 Ba\n0.821100 0.500000 0.857799 Ba\n0.678898 0.142202 0.500001 Ba\n0.321101 0.857798 0.500000 Ba\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ba"
],
"chemical_system": "Ba",
"density": 3.8276269594582066,
"density_atomic": 0.016785124800362563,
"volume": 238.3062412448431,
"volume_molar": 35.87784321907407,
"formula_full": "Ba4",
"formula_reduced": "Ba",
"formula_anonymous": "A",
"energy_above_hull": 0.1379599999999999,
"spacegroup": 140
},
{
"id": "jvasp-114447",
"created_at": "2022-09-04T14:38:41.661458Z",
"updated_at": "2022-09-04T14:38:41.661487Z",
"structure_string": "Ba1 Au1 O1\n1.0\n5.003442 -0.000000 -0.000000\n0.000000 5.003442 0.000000\n0.000000 0.000000 7.146880\nBa Au O\n1 1 1\ndirect\n0.000000 0.000000 0.394133 Ba\n0.000000 0.000000 -0.019464 Au\n0.000000 0.000000 0.698441 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Au",
"O"
],
"chemical_system": "Au-Ba-O",
"density": 3.2510697569821514,
"density_atomic": 0.01676745019443258,
"volume": 178.9180802812888,
"volume_molar": 35.91566213209672,
"formula_full": "Ba1 Au1 O1",
"formula_reduced": "BaAuO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7157190133333331,
"spacegroup": 99
},
{
"id": "jvasp-25077",
"created_at": "2022-09-04T14:37:56.607603Z",
"updated_at": "2022-09-04T14:37:56.607628Z",
"structure_string": "Ba1\n1.0\n3.798186 0.000000 2.192884\n1.266062 3.580964 2.192884\n-0.000000 0.000000 4.385768\nBa\n1\ndirect\n0.000000 0.000000 0.000000 Ba\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ba"
],
"chemical_system": "Ba",
"density": 3.822814213229751,
"density_atomic": 0.016764019675194215,
"volume": 59.65156444427848,
"volume_molar": 35.923011763765615,
"formula_full": "Ba1",
"formula_reduced": "Ba",
"formula_anonymous": "A",
"energy_above_hull": 0.0207199999999999,
"spacegroup": 225
},
{
"id": "jvasp-16303",
"created_at": "2022-09-04T14:38:19.629872Z",
"updated_at": "2022-09-04T14:38:19.629898Z",
"structure_string": "Ba1\n1.0\n3.798186 0.000000 2.192884\n1.266062 3.580965 2.192884\n-0.000000 -0.000000 4.385768\nBa\n1\ndirect\n0.000000 0.000000 0.000000 Ba\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ba"
],
"chemical_system": "Ba",
"density": 3.8228131456923093,
"density_atomic": 0.016764014993769047,
"volume": 59.651581102241096,
"volume_molar": 35.923021795425186,
"formula_full": "Ba1",
"formula_reduced": "Ba",
"formula_anonymous": "A",
"energy_above_hull": 0.0207199999999999,
"spacegroup": 225
}
]
}