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=energy_above_hull&page=30",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=28",
"results": [
{
"id": "jvasp-65186",
"created_at": "2022-09-04T14:35:43.806085Z",
"updated_at": "2022-09-04T14:35:43.806106Z",
"structure_string": "Be1 In1 Cu4\n1.0\n-0.000000 3.451895 3.451895\n3.451895 -0.000000 3.451895\n3.451895 3.451895 -0.000000\nBe In Cu\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 In\n0.123007 0.625665 0.625665 Cu\n0.625665 0.625665 0.625665 Cu\n0.625665 0.123007 0.625665 Cu\n0.625665 0.625665 0.123007 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"In",
"Cu"
],
"chemical_system": "Be-Cu-In",
"density": 7.63052579621655,
"density_atomic": 0.07293710546580584,
"volume": 82.26265577282749,
"volume_molar": 8.256621539256562,
"formula_full": "Be1 In1 Cu4",
"formula_reduced": "BeInCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-69369",
"created_at": "2022-09-04T14:35:44.459937Z",
"updated_at": "2022-09-04T14:35:44.459965Z",
"structure_string": "K2 Ba1 Zn1\n1.0\n4.230659 -0.000000 0.000000\n-0.000000 4.230659 -0.000000\n0.000000 -0.000000 11.013340\nK Ba Zn\n2 1 1\ndirect\n0.000000 0.000000 0.989886 K\n0.500000 0.500000 0.318564 K\n0.500000 0.500000 0.671703 Ba\n0.000000 0.000000 0.519847 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Zn"
],
"chemical_system": "Ba-K-Zn",
"density": 2.3665525132939855,
"density_atomic": 0.020292002218202144,
"volume": 197.1219969812519,
"volume_molar": 29.677410317834852,
"formula_full": "K2 Ba1 Zn1",
"formula_reduced": "K2BaZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-69272",
"created_at": "2022-09-04T14:35:41.598843Z",
"updated_at": "2022-09-04T14:35:41.598866Z",
"structure_string": "Ba2 Mg1 Sn1\n1.0\n0.000000 4.254230 4.254230\n4.254230 0.000000 4.254230\n4.254230 4.254230 0.000000\nBa Mg Sn\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Sn"
],
"chemical_system": "Ba-Mg-Sn",
"density": 4.503896966519163,
"density_atomic": 0.025975690329221056,
"volume": 153.9901326703239,
"volume_molar": 23.18375636479413,
"formula_full": "Ba2 Mg1 Sn1",
"formula_reduced": "Ba2MgSn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-86741",
"created_at": "2022-09-04T14:35:46.499932Z",
"updated_at": "2022-09-04T14:35:46.499950Z",
"structure_string": "Rb2 Au2 I6\n1.0\n7.024643 -0.057577 3.261862\n2.600762 6.525716 3.261862\n-0.127262 -0.085518 8.710718\nRb Au I\n2 2 6\ndirect\n0.276687 0.276688 0.221355 Rb\n0.723312 0.723312 0.778645 Rb\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 Au\n0.723793 0.723794 0.356819 I\n0.199348 0.721294 0.813808 I\n0.800651 0.278705 0.186192 I\n0.278705 0.800652 0.186191 I\n0.721294 0.199348 0.813809 I\n0.276206 0.276206 0.643181 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Au",
"I"
],
"chemical_system": "Au-I-Rb",
"density": 5.443615733935413,
"density_atomic": 0.024717130361103568,
"volume": 404.57771002966547,
"volume_molar": 24.36423918157109,
"formula_full": "Rb2 Au2 I6",
"formula_reduced": "RbAuI3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 12
},
{
"id": "jvasp-64584",
"created_at": "2022-09-04T14:35:41.603769Z",
"updated_at": "2022-09-04T14:35:41.603796Z",
"structure_string": "Ba4 Na1 Ge1\n1.0\n0.000000 5.104615 5.104615\n5.104615 -0.000000 5.104615\n5.104615 5.104615 0.000000\nBa Na Ge\n4 1 1\ndirect\n0.131019 0.622995 0.622995 Ba\n0.622995 0.622995 0.622995 Ba\n0.622995 0.131019 0.622995 Ba\n0.622995 0.622995 0.131019 Ba\n0.000000 0.000000 0.000000 Na\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Ge"
],
"chemical_system": "Ba-Ge-Na",
"density": 4.025760515088669,
"density_atomic": 0.022554451903188284,
"volume": 266.0228688222676,
"volume_molar": 26.70045269044518,
"formula_full": "Ba4 Na1 Ge1",
"formula_reduced": "Ba4NaGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-65263",
"created_at": "2022-09-04T14:35:45.089717Z",
"updated_at": "2022-09-04T14:35:45.089741Z",
"structure_string": "Sr1 Be1 Cu4\n1.0\n-0.000000 3.609037 3.609037\n3.609037 -0.000000 3.609037\n3.609037 3.609037 0.000000\nSr Be Cu\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Be\n0.118334 0.627223 0.627223 Cu\n0.627223 0.627223 0.627223 Cu\n0.627223 0.118334 0.627223 Cu\n0.627223 0.627223 0.118334 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Be",
"Cu"
],
"chemical_system": "Be-Cu-Sr",
"density": 6.196189851255876,
"density_atomic": 0.06381859683914133,
"volume": 94.01648261122642,
"volume_molar": 9.436341534081633,
"formula_full": "Sr1 Be1 Cu4",
"formula_reduced": "SrBeCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-68962",
"created_at": "2022-09-04T14:35:41.612855Z",
"updated_at": "2022-09-04T14:35:41.612887Z",
"structure_string": "Ba1 Sr1 Mg2\n1.0\n4.246360 -0.000000 0.000000\n-0.000000 4.246360 -0.000000\n0.000000 -0.000000 8.475200\nBa Sr Mg\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Sr\n-0.000000 0.000000 0.265445 Mg\n-0.000000 0.000000 0.734555 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Mg"
],
"chemical_system": "Ba-Mg-Sr",
"density": 2.972441757690679,
"density_atomic": 0.02617438072782067,
"volume": 152.82118960500992,
"volume_molar": 23.007767872800464,
"formula_full": "Ba1 Sr1 Mg2",
"formula_reduced": "BaSrMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-69123",
"created_at": "2022-09-04T14:35:46.507818Z",
"updated_at": "2022-09-04T14:35:46.507848Z",
"structure_string": "Ba1 Mg1 Ga2\n1.0\n5.220410 0.000000 0.000000\n-0.000000 5.220410 -0.000000\n0.000000 0.000000 4.135199\nBa Mg Ga\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Ba\n0.500000 0.500000 0.500000 Mg\n0.500000 0.000000 0.000000 Ga\n0.000000 0.500000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Ga"
],
"chemical_system": "Ba-Ga-Mg",
"density": 4.436316065856881,
"density_atomic": 0.03549395148589016,
"volume": 112.69525743252656,
"volume_molar": 16.966667581077783,
"formula_full": "Ba1 Mg1 Ga2",
"formula_reduced": "BaMgGa2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-63504",
"created_at": "2022-09-04T14:35:57.852544Z",
"updated_at": "2022-09-04T14:35:57.852572Z",
"structure_string": "K1 Au1 F6\n1.0\n3.267770 -3.795391 -0.029738\n3.267775 3.795396 -0.029739\n-1.095692 -0.000001 4.887098\nK Au F\n1 1 6\ndirect\n0.500012 0.500000 0.500000 K\n0.000014 0.000002 0.000002 Au\n0.278607 0.927146 0.278596 F\n0.278608 0.278596 0.927146 F\n0.927157 0.278596 0.278595 F\n0.721415 0.721403 0.072854 F\n0.721416 0.072855 0.721403 F\n0.072866 0.721404 0.721404 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Au",
"F"
],
"chemical_system": "Au-F-K",
"density": 4.8048860380282825,
"density_atomic": 0.06612829696829496,
"volume": 120.97695490079806,
"volume_molar": 9.106753139109722,
"formula_full": "K1 Au1 F6",
"formula_reduced": "KAuF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-93832",
"created_at": "2022-09-04T14:35:46.567895Z",
"updated_at": "2022-09-04T14:35:46.567924Z",
"structure_string": "Ca2 Cl2 O2\n1.0\n-1.968600 -3.409615 0.000000\n-1.968600 3.409615 0.000000\n0.000000 0.000000 -9.191588\nCa Cl O\n2 2 2\ndirect\n0.333332 0.666668 0.812242 Ca\n0.666668 0.333332 0.312242 Ca\n0.333322 0.666678 0.506190 Cl\n0.666678 0.333322 0.006189 Cl\n0.000007 0.999993 0.264569 O\n0.999993 0.000007 0.764569 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Cl",
"O"
],
"chemical_system": "Ca-Cl-O",
"density": 2.4635483176868047,
"density_atomic": 0.04862592562678002,
"volume": 123.39096732167064,
"volume_molar": 12.384629562061015,
"formula_full": "Ca2 Cl2 O2",
"formula_reduced": "CaClO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 186
},
{
"id": "jvasp-94794",
"created_at": "2022-09-04T14:35:41.626238Z",
"updated_at": "2022-09-04T14:35:41.626265Z",
"structure_string": "Mg7 V1\n1.0\n-4.358589 -4.358589 0.000000\n-4.358589 0.000000 -4.358589\n0.000000 -4.358589 -4.358589\nMg V\n7 1\ndirect\n0.500000 0.500000 0.500000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 V\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"V"
],
"chemical_system": "Mg-V",
"density": 2.2167868001415134,
"density_atomic": 0.0483083535336432,
"volume": 165.602828803275,
"volume_molar": 12.466044316343806,
"formula_full": "Mg7 V1",
"formula_reduced": "Mg7V",
"formula_anonymous": "AB7",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-64209",
"created_at": "2022-09-04T14:36:04.979338Z",
"updated_at": "2022-09-04T14:36:04.979358Z",
"structure_string": "Ba4 Mg1 Se1\n1.0\n-0.000000 5.067230 5.067230\n5.067230 -0.000000 5.067230\n5.067230 5.067230 0.000000\nBa Mg Se\n4 1 1\ndirect\n0.120989 0.626337 0.626337 Ba\n0.626337 0.626337 0.626337 Ba\n0.626337 0.120989 0.626337 Ba\n0.626337 0.626337 0.120989 Ba\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Se"
],
"chemical_system": "Ba-Mg-Se",
"density": 4.164245749652435,
"density_atomic": 0.023057350585119204,
"volume": 260.2207039291102,
"volume_molar": 26.11809512878978,
"formula_full": "Ba4 Mg1 Se1",
"formula_reduced": "Ba4MgSe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
}
]
}