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=structure_string&page=446",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=structure_string&page=444",
"results": [
{
"id": "jvasp-66486",
"created_at": "2022-09-04T14:35:43.181519Z",
"updated_at": "2022-09-04T14:35:43.181540Z",
"structure_string": "Ba4 Ni1 Rh1\n1.0\n-0.000000 4.723513 4.723513\n4.723513 0.000000 4.723513\n4.723513 4.723513 -0.000000\nBa Ni Rh\n4 1 1\ndirect\n0.124270 0.625243 0.625243 Ba\n0.625243 0.625243 0.625243 Ba\n0.625243 0.124270 0.625243 Ba\n0.625243 0.625243 0.124270 Ba\n0.250000 0.250000 0.250000 Ni\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ni",
"Rh"
],
"chemical_system": "Ba-Ni-Rh",
"density": 5.600624893516274,
"density_atomic": 0.028465964922583197,
"volume": 210.7780297038151,
"volume_molar": 21.15558273319726,
"formula_full": "Ba4 Ni1 Rh1",
"formula_reduced": "Ba4NiRh",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.7085498799999999,
"spacegroup": 216
},
{
"id": "jvasp-66649",
"created_at": "2022-09-04T14:36:00.168619Z",
"updated_at": "2022-09-04T14:36:00.168647Z",
"structure_string": "Ba4 Ni1 Sb1\n1.0\n-0.000000 5.038153 5.038153\n5.038153 0.000000 5.038153\n5.038153 5.038153 0.000000\nBa Ni Sb\n4 1 1\ndirect\n0.124354 0.625215 0.625215 Ba\n0.625215 0.625215 0.625215 Ba\n0.625215 0.124354 0.625215 Ba\n0.625215 0.625215 0.124354 Ba\n0.250000 0.250000 0.250000 Ni\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ni",
"Sb"
],
"chemical_system": "Ba-Ni-Sb",
"density": 4.737900473108627,
"density_atomic": 0.02345887592776836,
"volume": 255.7667306172065,
"volume_molar": 25.671054225030318,
"formula_full": "Ba4 Ni1 Sb1",
"formula_reduced": "Ba4NiSb",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3789603966666666,
"spacegroup": 216
},
{
"id": "jvasp-64027",
"created_at": "2022-09-04T14:36:05.642052Z",
"updated_at": "2022-09-04T14:36:05.642076Z",
"structure_string": "Ba4 Ni1 Se1\n1.0\n-0.000000 4.853848 4.853848\n4.853848 -0.000000 4.853848\n4.853848 4.853848 -0.000000\nBa Ni Se\n4 1 1\ndirect\n0.123797 0.625401 0.625401 Ba\n0.625401 0.625401 0.625401 Ba\n0.625401 0.123797 0.625401 Ba\n0.625401 0.625401 0.123797 Ba\n0.250000 0.250000 0.250000 Ni\n0.000000 0.000000 0.000000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ni",
"Se"
],
"chemical_system": "Ba-Ni-Se",
"density": 4.987614977244079,
"density_atomic": 0.026233892728203836,
"volume": 228.71176848068188,
"volume_molar": 22.95557438765329,
"formula_full": "Ba4 Ni1 Se1",
"formula_reduced": "Ba4NiSe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3323882744444444,
"spacegroup": 216
},
{
"id": "jvasp-64764",
"created_at": "2022-09-04T14:36:09.987350Z",
"updated_at": "2022-09-04T14:36:09.987380Z",
"structure_string": "Ba4 Ni1 W1\n1.0\n-0.000000 4.988688 4.988688\n4.988688 -0.000000 4.988688\n4.988688 4.988688 -0.000000\nBa Ni W\n4 1 1\ndirect\n0.124735 0.625088 0.625088 Ba\n0.625088 0.625088 0.625088 Ba\n0.625088 0.124735 0.625088 Ba\n0.625088 0.625088 0.124735 Ba\n0.250000 0.250000 0.250000 Ni\n0.000000 0.000000 0.000000 W\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ni",
"W"
],
"chemical_system": "Ba-Ni-W",
"density": 5.295393963547516,
"density_atomic": 0.024163632646000438,
"volume": 248.30703594532253,
"volume_molar": 24.92233203601853,
"formula_full": "Ba4 Ni1 W1",
"formula_reduced": "Ba4NiW",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.726747713333333,
"spacegroup": 216
},
{
"id": "jvasp-66199",
"created_at": "2022-09-04T14:35:44.185966Z",
"updated_at": "2022-09-04T14:35:44.186003Z",
"structure_string": "Ba4 Os1 Br1\n1.0\n0.000000 4.791688 4.791688\n4.791688 0.000000 4.791688\n4.791688 4.791688 -0.000000\nBa Os Br\n4 1 1\ndirect\n0.122043 0.625986 0.625986 Ba\n0.625986 0.625986 0.625986 Ba\n0.625986 0.122043 0.625986 Ba\n0.625986 0.625986 0.122043 Ba\n0.000000 0.000000 0.000000 Os\n0.250000 0.250000 0.250000 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Os",
"Br"
],
"chemical_system": "Ba-Br-Os",
"density": 6.184031952818984,
"density_atomic": 0.027268148982173234,
"volume": 220.0369377445659,
"volume_molar": 22.08489019161888,
"formula_full": "Ba4 Os1 Br1",
"formula_reduced": "Ba4OsBr",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.0296054975,
"spacegroup": 216
},
{
"id": "jvasp-66234",
"created_at": "2022-09-04T14:36:19.065547Z",
"updated_at": "2022-09-04T14:36:19.065566Z",
"structure_string": "Ba4 Os1 Cl1\n1.0\n-0.000000 4.763890 4.763890\n4.763890 -0.000000 4.763890\n4.763890 4.763890 -0.000000\nBa Os Cl\n4 1 1\ndirect\n0.122398 0.625867 0.625867 Ba\n0.625867 0.625867 0.625867 Ba\n0.625867 0.122398 0.625867 Ba\n0.625867 0.625867 0.122398 Ba\n0.000000 0.000000 0.000000 Os\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Os",
"Cl"
],
"chemical_system": "Ba-Cl-Os",
"density": 5.951556846659158,
"density_atomic": 0.02774828075482872,
"volume": 216.22961267450373,
"volume_molar": 21.702752733435695,
"formula_full": "Ba4 Os1 Cl1",
"formula_reduced": "Ba4OsCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.0627788245833334,
"spacegroup": 216
},
{
"id": "jvasp-66412",
"created_at": "2022-09-04T14:35:48.466020Z",
"updated_at": "2022-09-04T14:35:48.466046Z",
"structure_string": "Ba4 Os1 Pb1\n1.0\n0.000000 4.806487 4.806487\n4.806487 -0.000000 4.806487\n4.806487 4.806487 -0.000000\nBa Os Pb\n4 1 1\ndirect\n0.126723 0.624426 0.624426 Ba\n0.624426 0.624426 0.624426 Ba\n0.624426 0.126723 0.624426 Ba\n0.624426 0.624426 0.126723 Ba\n0.250000 0.250000 0.250000 Os\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Os",
"Pb"
],
"chemical_system": "Ba-Os-Pb",
"density": 7.078897025572039,
"density_atomic": 0.0270170507542354,
"volume": 222.08197536362823,
"volume_molar": 22.290148598310356,
"formula_full": "Ba4 Os1 Pb1",
"formula_reduced": "Ba4OsPb",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.1234682833333334,
"spacegroup": 216
},
{
"id": "jvasp-66136",
"created_at": "2022-09-04T14:35:50.512629Z",
"updated_at": "2022-09-04T14:35:50.512657Z",
"structure_string": "Ba4 Os1 Pd1\n1.0\n0.000000 4.665119 4.665119\n4.665119 -0.000000 4.665119\n4.665119 4.665119 -0.000000\nBa Os Pd\n4 1 1\ndirect\n0.126080 0.624640 0.624640 Ba\n0.624640 0.624640 0.624640 Ba\n0.624640 0.126080 0.624640 Ba\n0.624640 0.624640 0.126080 Ba\n0.250000 0.250000 0.250000 Os\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Os",
"Pd"
],
"chemical_system": "Ba-Os-Pd",
"density": 6.917986725917921,
"density_atomic": 0.02954833917548137,
"volume": 203.05709787501974,
"volume_molar": 20.380640428674432,
"formula_full": "Ba4 Os1 Pd1",
"formula_reduced": "Ba4OsPd",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.4176057633333334,
"spacegroup": 216
},
{
"id": "jvasp-66464",
"created_at": "2022-09-04T14:36:00.626944Z",
"updated_at": "2022-09-04T14:36:00.626971Z",
"structure_string": "Ba4 Os1 Se1\n1.0\n0.000000 4.720895 4.720895\n4.720895 0.000000 4.720895\n4.720895 4.720895 0.000000\nBa Os Se\n4 1 1\ndirect\n0.126256 0.624581 0.624581 Ba\n0.624581 0.624581 0.624581 Ba\n0.624581 0.126256 0.624581 Ba\n0.624581 0.624581 0.126256 Ba\n0.250000 0.250000 0.250000 Os\n0.000000 0.000000 0.000000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Os",
"Se"
],
"chemical_system": "Ba-Os-Se",
"density": 6.458976447125083,
"density_atomic": 0.028513349093256576,
"volume": 210.42775369446179,
"volume_molar": 21.12042587597765,
"formula_full": "Ba4 Os1 Se1",
"formula_reduced": "Ba4OsSe",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3007303744444445,
"spacegroup": 216
},
{
"id": "jvasp-66308",
"created_at": "2022-09-04T14:36:07.064182Z",
"updated_at": "2022-09-04T14:36:07.064210Z",
"structure_string": "Ba4 Os1 W1\n1.0\n0.000000 4.664160 4.664160\n4.664160 0.000000 4.664160\n4.664160 4.664160 -0.000000\nBa Os W\n4 1 1\ndirect\n0.125898 0.624701 0.624701 Ba\n0.624701 0.624701 0.624701 Ba\n0.624701 0.125898 0.624701 Ba\n0.624701 0.624701 0.125898 Ba\n0.250000 0.250000 0.250000 Os\n0.000000 0.000000 0.000000 W\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Os",
"W"
],
"chemical_system": "Ba-Os-W",
"density": 7.555762608050431,
"density_atomic": 0.029566569264514994,
"volume": 202.93189738455857,
"volume_molar": 20.36807417906146,
"formula_full": "Ba4 Os1 W1",
"formula_reduced": "Ba4OsW",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.69451148,
"spacegroup": 216
},
{
"id": "jvasp-57100",
"created_at": "2022-09-04T14:38:35.331541Z",
"updated_at": "2022-09-04T14:38:35.331557Z",
"structure_string": "Ba4 Os6 Cl1 O18\n1.0\n7.726605 -0.000000 -2.731768\n-3.863303 6.691438 -2.731768\n0.000000 0.000000 8.195302\nBa Os Cl O\n4 6 1 18\ndirect\n-0.000000 -0.000000 0.370795 Ba\n0.370795 0.000000 -0.000000 Ba\n0.629206 0.629206 0.629205 Ba\n0.000000 0.370795 0.000000 Ba\n0.365258 0.865258 0.500000 Os\n0.500001 0.634743 0.134742 Os\n0.634743 0.134743 0.500000 Os\n0.134743 0.500000 0.634742 Os\n0.865258 0.500000 0.365257 Os\n0.500000 0.365258 0.865257 Os\n0.000000 0.000000 0.000000 Cl\n0.350167 0.722814 0.654162 O\n0.649834 0.303996 0.372647 O\n0.303996 0.372647 0.649833 O\n0.277187 0.627353 0.931348 O\n0.337697 -0.000000 0.337696 O\n0.662304 0.662304 -0.000000 O\n0.696005 0.345838 0.068651 O\n0.000000 0.662304 0.662303 O\n0.372648 0.649834 0.303996 O\n0.345838 0.068651 0.696004 O\n0.627354 0.931349 0.277186 O\n0.654163 0.350167 0.722814 O\n0.337697 0.337697 -0.000000 O\n0.931349 0.277186 0.627352 O\n0.722815 0.654163 0.350166 O\n0.068652 0.696004 0.345837 O\n0.662304 -0.000000 0.662303 O\n0.000000 0.337697 0.337696 O\n",
"nsites": 29,
"nelements": 4,
"elements": [
"Ba",
"Os",
"Cl",
"O"
],
"chemical_system": "Ba-Cl-O-Os",
"density": 7.893389026540321,
"density_atomic": 0.06844234272556347,
"volume": 423.71430966766707,
"volume_molar": 8.798852464982483,
"formula_full": "Ba4 Os6 Cl1 O18",
"formula_reduced": "Ba4Os6ClO18",
"formula_anonymous": "AB4C6D18",
"energy_above_hull": 3.408025894741379,
"spacegroup": 197
},
{
"id": "jvasp-96913",
"created_at": "2022-09-04T14:36:36.204166Z",
"updated_at": "2022-09-04T14:36:36.204193Z",
"structure_string": "Ba4 P12 Pt8\n1.0\n5.843420 0.000000 0.000000\n0.000000 8.088078 -2.433852\n0.000000 0.001191 11.719063\nBa P Pt\n4 12 8\ndirect\n0.412544 0.240504 0.852605 Ba\n0.587456 0.759496 0.147395 Ba\n0.912544 0.759496 0.647395 Ba\n0.087456 0.240504 0.352605 Ba\n0.384450 0.725251 0.417228 P\n0.346399 0.454886 0.674830 P\n0.153601 0.454886 0.174830 P\n0.653601 0.545114 0.325170 P\n0.620127 0.932197 0.928175 P\n0.120127 0.067803 0.571825 P\n0.379873 0.067803 0.071825 P\n0.879873 0.932197 0.428175 P\n0.115550 0.725251 0.917228 P\n0.615550 0.274749 0.582772 P\n0.884450 0.274749 0.082772 P\n0.846399 0.545114 0.825170 P\n0.516532 0.337660 0.161300 Pt\n0.500000 -0.000000 0.500000 Pt\n0.000000 0.500000 0.000000 Pt\n0.500000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n0.483468 0.662340 0.838700 Pt\n0.983468 0.337660 0.661300 Pt\n0.016532 0.662340 0.338700 Pt\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ba",
"P",
"Pt"
],
"chemical_system": "Ba-P-Pt",
"density": 7.440012657963379,
"density_atomic": 0.043330393971560695,
"volume": 553.883724568765,
"volume_molar": 13.89819064177572,
"formula_full": "Ba4 P12 Pt8",
"formula_reduced": "BaP3Pt2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.4264808783333334,
"spacegroup": 14
}
]
}