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&page=1283",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=1281",
"results": [
{
"id": "jvasp-104705",
"created_at": "2022-09-04T14:36:55.307294Z",
"updated_at": "2022-09-04T14:36:55.307304Z",
"structure_string": "Pb2 Se1 S1\n1.0\n4.314001 -0.000000 0.000000\n0.000000 4.314001 0.000000\n0.000000 -0.000000 6.101364\nPb Se S\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 Pb\n0.500000 0.500000 -0.000000 Se\n0.000000 0.000000 0.500000 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pb",
"Se",
"S"
],
"chemical_system": "Pb-S-Se",
"density": 7.683735600366935,
"density_atomic": 0.03522674967047521,
"volume": 113.55007309551871,
"volume_molar": 17.095363087237565,
"formula_full": "Pb2 Se1 S1",
"formula_reduced": "Pb2SeS",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7902312516666666,
"spacegroup": 123
},
{
"id": "jvasp-98281",
"created_at": "2022-09-04T14:36:12.132389Z",
"updated_at": "2022-09-04T14:36:12.132408Z",
"structure_string": "Sr2 Cd22\n1.0\n7.125361 -0.000000 3.223396\n3.562680 8.555003 1.611698\n0.036566 -0.000000 9.406221\nSr Cd\n2 22\ndirect\n0.375000 0.250000 0.750000 Sr\n0.625000 0.750000 0.250000 Sr\n0.449238 0.831428 0.927996 Cd\n0.791339 0.927996 0.831428 Cd\n0.280666 0.927996 0.668572 Cd\n0.550762 0.168572 0.072004 Cd\n0.449238 0.427996 0.331428 Cd\n0.719334 0.072004 0.331428 Cd\n0.791338 0.331428 0.427996 Cd\n0.280666 0.168572 0.427996 Cd\n0.500000 0.500000 0.000000 Cd\n0.550763 0.572004 0.668572 Cd\n0.875000 0.250000 0.750000 Cd\n0.877234 0.331428 0.072004 Cd\n0.125000 0.750000 0.250000 Cd\n0.122767 0.668572 0.927996 Cd\n0.877234 0.572004 0.831428 Cd\n0.208662 0.668572 0.572004 Cd\n0.122766 0.427996 0.168572 Cd\n0.208662 0.072004 0.168572 Cd\n0.000000 0.000000 0.000000 Cd\n0.719335 0.831428 0.572004 Cd\n0.000000 0.000000 0.500000 Cd\n0.000000 0.500000 0.500000 Cd\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Sr",
"Cd"
],
"chemical_system": "Cd-Sr",
"density": 7.683083187000678,
"density_atomic": 0.041930829214318045,
"volume": 572.3712230285387,
"volume_molar": 14.362083633546723,
"formula_full": "Sr2 Cd22",
"formula_reduced": "SrCd11",
"formula_anonymous": "AB11",
"energy_above_hull": 0.0,
"spacegroup": 141
},
{
"id": "jvasp-18706",
"created_at": "2022-09-04T14:35:57.157154Z",
"updated_at": "2022-09-04T14:35:57.157180Z",
"structure_string": "Ti1 Ga1 Ni2\n1.0\n3.599874 -0.000000 2.078389\n1.199958 3.393994 2.078389\n-0.000000 -0.000000 4.156776\nTi Ga Ni\n1 1 2\ndirect\n0.500000 0.499999 0.500001 Ti\n0.000000 0.000000 0.000000 Ga\n0.250000 0.250000 0.250001 Ni\n0.750000 0.749999 0.750002 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Ga",
"Ni"
],
"chemical_system": "Ga-Ni-Ti",
"density": 7.682792261471678,
"density_atomic": 0.07875987151822648,
"volume": 50.787284474865174,
"volume_molar": 7.646204398145019,
"formula_full": "Ti1 Ga1 Ni2",
"formula_reduced": "TiGaNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2280163645833335,
"spacegroup": 225
},
{
"id": "jvasp-105285",
"created_at": "2022-09-04T14:36:53.319283Z",
"updated_at": "2022-09-04T14:36:53.319311Z",
"structure_string": "Ho4 Mg2 Cu4\n1.0\n7.548366 -0.000000 0.000000\n0.000000 7.548366 0.000000\n0.000000 -0.000000 3.651364\nHo Mg Cu\n4 2 4\ndirect\n0.668849 0.168848 0.499999 Ho\n0.331152 0.831152 0.499999 Ho\n0.168848 0.331152 0.499999 Ho\n0.831152 0.668849 0.499999 Ho\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 -0.000000 Mg\n0.124926 0.624926 -0.000000 Cu\n0.875075 0.375074 -0.000000 Cu\n0.624926 0.875075 -0.000000 Cu\n0.375074 0.124926 -0.000000 Cu\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ho",
"Mg",
"Cu"
],
"chemical_system": "Cu-Ho-Mg",
"density": 7.682378513713328,
"density_atomic": 0.048066109451446036,
"volume": 208.04679459446362,
"volume_molar": 12.52887081714667,
"formula_full": "Ho4 Mg2 Cu4",
"formula_reduced": "Ho2MgCu2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.1742262166666663,
"spacegroup": 127
},
{
"id": "jvasp-118955",
"created_at": "2022-09-04T14:38:30.838576Z",
"updated_at": "2022-09-04T14:38:30.838595Z",
"structure_string": "Tl2 Bi2 F8\n1.0\n5.541511 -0.022354 -4.377342\n-1.313937 5.383531 -4.377342\n0.017627 0.022354 7.061809\nTl Bi F\n2 2 8\ndirect\n0.000000 0.000000 0.000000 Tl\n0.750000 0.250000 0.500000 Tl\n0.500000 0.500000 0.000000 Bi\n0.250000 0.750000 0.500000 Bi\n0.375000 0.423232 0.548232 F\n0.875000 0.826768 0.451768 F\n0.576768 0.125000 0.951768 F\n0.875000 0.423233 0.048233 F\n0.173232 0.625000 0.048232 F\n0.375000 0.826767 0.951768 F\n0.173232 0.125000 0.548232 F\n0.576768 0.625000 0.451768 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tl",
"Bi",
"F"
],
"chemical_system": "Bi-F-Tl",
"density": 7.682144022107912,
"density_atomic": 0.0567229115972625,
"volume": 211.55472563187556,
"volume_molar": 10.616769468319456,
"formula_full": "Tl2 Bi2 F8",
"formula_reduced": "TlBiF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0073516666666664,
"spacegroup": 141
},
{
"id": "jvasp-86510",
"created_at": "2022-09-04T14:36:10.945795Z",
"updated_at": "2022-09-04T14:36:10.945823Z",
"structure_string": "Lu1 Si2 Cu2\n1.0\n3.694904 -0.000000 -1.344150\n-0.488982 3.662405 -1.344150\n-0.007891 -0.009014 5.728803\nLu Si Cu\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Lu\n0.615870 0.615870 0.231739 Si\n0.384130 0.384130 0.768260 Si\n0.250000 0.750000 0.500000 Cu\n0.750000 0.250000 0.500000 Cu\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Lu",
"Si",
"Cu"
],
"chemical_system": "Cu-Lu-Si",
"density": 7.682092450722734,
"density_atomic": 0.06457114435638144,
"volume": 77.43396914888129,
"volume_molar": 9.32636523640121,
"formula_full": "Lu1 Si2 Cu2",
"formula_reduced": "Lu(CuSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.33968477,
"spacegroup": 139
},
{
"id": "jvasp-110153",
"created_at": "2022-09-04T14:38:16.070035Z",
"updated_at": "2022-09-04T14:38:16.070062Z",
"structure_string": "Tb2 Y2 Ni4\n1.0\n4.188593 -0.000000 0.000000\n0.000000 5.390729 0.000000\n-0.000000 -0.000000 6.992613\nTb Y Ni\n2 2 4\ndirect\n-0.000000 0.115862 0.680629 Tb\n-0.000000 0.884138 0.180629 Tb\n0.500000 0.384356 0.319335 Y\n0.500000 0.615644 0.819335 Y\n-0.000000 0.620048 0.538200 Ni\n-0.000000 0.379952 0.038200 Ni\n0.500000 0.880829 0.461835 Ni\n0.500000 0.119171 0.961835 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tb",
"Y",
"Ni"
],
"chemical_system": "Ni-Tb-Y",
"density": 7.682031990828373,
"density_atomic": 0.050668124777616376,
"volume": 157.89019299830403,
"volume_molar": 11.885462085741917,
"formula_full": "Tb2 Y2 Ni4",
"formula_reduced": "TbYNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4673596624999998,
"spacegroup": 26
},
{
"id": "jvasp-8109",
"created_at": "2022-09-04T14:37:04.012204Z",
"updated_at": "2022-09-04T14:37:04.012229Z",
"structure_string": "Hg3 S3\n1.0\n2.127307 -3.684604 -0.000000\n2.127307 3.684604 0.000000\n0.000000 0.000000 9.624768\nHg S\n3 3\ndirect\n0.730792 0.730792 0.000000 Hg\n0.000000 0.269209 0.666667 Hg\n0.269209 0.000000 0.333333 Hg\n0.486526 0.486526 0.500000 S\n0.000001 0.513475 0.166667 S\n0.513475 0.000001 0.833333 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Hg",
"S"
],
"chemical_system": "Hg-S",
"density": 7.681419590048279,
"density_atomic": 0.03976582495444174,
"volume": 150.88332775376801,
"volume_molar": 15.144010634506762,
"formula_full": "Hg3 S3",
"formula_reduced": "HgS",
"formula_anonymous": "AB",
"energy_above_hull": 0.0647373,
"spacegroup": 152
},
{
"id": "jvasp-8198",
"created_at": "2022-09-04T14:37:56.525097Z",
"updated_at": "2022-09-04T14:37:56.525126Z",
"structure_string": "Hg3 S3\n1.0\n2.127000 -3.684073 0.000000\n2.127000 3.684073 -0.000000\n0.000000 0.000000 9.627826\nHg S\n3 3\ndirect\n0.269061 0.269061 0.000000 Hg\n0.000000 0.730939 0.333333 Hg\n0.730939 0.000000 0.666667 Hg\n0.513546 0.513546 0.500000 S\n0.000000 0.486454 0.833333 S\n0.486454 0.000000 0.166667 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Hg",
"S"
],
"chemical_system": "Hg-S",
"density": 7.681195114693335,
"density_atomic": 0.039764662871370156,
"volume": 150.8877371702777,
"volume_molar": 15.144453203288272,
"formula_full": "Hg3 S3",
"formula_reduced": "HgS",
"formula_anonymous": "AB",
"energy_above_hull": 0.0647473,
"spacegroup": 154
},
{
"id": "jvasp-66117",
"created_at": "2022-09-04T14:36:11.297261Z",
"updated_at": "2022-09-04T14:36:11.297284Z",
"structure_string": "Ba4 Re1 Ir1\n1.0\n0.000000 4.645922 4.645922\n4.645922 0.000000 4.645922\n4.645922 4.645922 -0.000000\nBa Re Ir\n4 1 1\ndirect\n0.125902 0.624699 0.624699 Ba\n0.624699 0.624699 0.624699 Ba\n0.624699 0.125902 0.624699 Ba\n0.624699 0.624699 0.125902 Ba\n0.000000 0.000000 0.000000 Re\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Re",
"Ir"
],
"chemical_system": "Ba-Ir-Re",
"density": 7.681143806945709,
"density_atomic": 0.029916136914032117,
"volume": 200.5606545137086,
"volume_molar": 20.130074873321377,
"formula_full": "Ba4 Re1 Ir1",
"formula_reduced": "Ba4ReIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.214497163333333,
"spacegroup": 216
},
{
"id": "jvasp-67077",
"created_at": "2022-09-04T14:36:12.472480Z",
"updated_at": "2022-09-04T14:36:12.472495Z",
"structure_string": "Be1 Ge1 Pd1\n1.0\n-1.618852 1.618852 3.878649\n1.618852 -1.618852 3.878649\n1.618852 1.618852 -3.878649\nBe Ge Pd\n1 1 1\ndirect\n0.013140 0.013140 0.000000 Be\n0.331730 0.331730 0.000000 Ge\n0.655130 0.655130 0.000000 Pd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Ge",
"Pd"
],
"chemical_system": "Be-Ge-Pd",
"density": 7.681020025386788,
"density_atomic": 0.07378472982662022,
"volume": 40.6588193390342,
"volume_molar": 8.161771106502473,
"formula_full": "Be1 Ge1 Pd1",
"formula_reduced": "BeGePd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2253959166666666,
"spacegroup": 107
},
{
"id": "jvasp-113782",
"created_at": "2022-09-04T14:38:49.297897Z",
"updated_at": "2022-09-04T14:38:49.297921Z",
"structure_string": "Ga1 Fe7 N2\n1.0\n4.595292 -0.000000 2.653093\n1.531764 4.332482 2.653093\n-0.000000 -0.000000 5.306186\nGa Fe N\n1 7 2\ndirect\n0.000000 0.000000 0.000000 Ga\n0.500000 0.000000 -0.000000 Fe\n-0.000000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.499999 0.500000 -0.000000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.500000 Fe\n0.499999 0.500000 0.500000 Fe\n0.250000 0.250000 0.250000 N\n0.749999 0.750000 0.750000 N\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ga",
"Fe",
"N"
],
"chemical_system": "Fe-Ga-N",
"density": 7.680966929798965,
"density_atomic": 0.09466025072298871,
"volume": 105.64096253308836,
"volume_molar": 6.361847463961443,
"formula_full": "Ga1 Fe7 N2",
"formula_reduced": "GaFe7N2",
"formula_anonymous": "AB2C7",
"energy_above_hull": 4.047527732499999,
"spacegroup": 225
}
]
}