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=1554",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=1552",
"results": [
{
"id": "jvasp-51126",
"created_at": "2022-09-04T14:37:03.484738Z",
"updated_at": "2022-09-04T14:37:03.484757Z",
"structure_string": "Hg1 Os1 Pb2\n1.0\n0.000000 3.597439 3.597439\n3.597439 0.000000 3.597439\n3.597439 3.597439 0.000000\nHg Os Pb\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Os\n0.750000 0.750000 0.750000 Pb\n0.250000 0.250000 0.250000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hg",
"Os",
"Pb"
],
"chemical_system": "Hg-Os-Pb",
"density": 14.359963613907302,
"density_atomic": 0.042958556529302756,
"volume": 93.11299827477984,
"volume_molar": 14.018489554909033,
"formula_full": "Hg1 Os1 Pb2",
"formula_reduced": "HgOsPb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.41503031,
"spacegroup": 225
},
{
"id": "jvasp-112969",
"created_at": "2022-09-04T14:38:45.569981Z",
"updated_at": "2022-09-04T14:38:45.569999Z",
"structure_string": "Hg2 P4 Pd4 O16\n1.0\n8.536299 0.006038 4.878380\n6.432556 5.613436 1.838143\n-0.001173 0.003126 6.716523\nHg P Pd O\n2 4 4 16\ndirect\n0.750000 0.750001 0.749999 Hg\n0.500000 0.500001 0.500000 Hg\n0.955033 0.955035 0.544966 P\n0.544966 0.544968 0.955033 P\n0.294966 0.294967 0.705033 P\n0.705033 0.705035 0.294966 P\n0.625000 0.125000 0.125000 Pd\n0.125000 0.125000 0.125000 Pd\n0.125000 0.625001 0.125000 Pd\n0.125000 0.125001 0.625000 Pd\n0.123852 0.897828 0.600706 O\n0.872386 0.649295 0.352172 O\n0.126147 0.352174 0.649293 O\n0.897827 0.123853 0.377614 O\n0.600706 0.377614 0.123852 O\n0.377614 0.600708 0.897826 O\n0.171419 0.532708 0.824589 O\n0.778717 0.425411 0.717292 O\n0.824589 0.471284 0.171419 O\n0.532707 0.171420 0.471283 O\n0.078581 0.717294 0.425410 O\n0.649293 0.872387 0.126147 O\n0.425410 0.778718 0.078580 O\n0.717292 0.078582 0.778717 O\n0.471282 0.824591 0.532707 O\n0.352173 0.126148 0.872386 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Hg",
"P",
"Pd",
"O"
],
"chemical_system": "Hg-O-P-Pd",
"density": 6.229661372763813,
"density_atomic": 0.08083008239024768,
"volume": 321.6624211079235,
"volume_molar": 7.450370681208886,
"formula_full": "Hg2 P4 Pd4 O16",
"formula_reduced": "HgP2(PdO4)2",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 2.4304903846153847,
"spacegroup": 70
},
{
"id": "jvasp-51104",
"created_at": "2022-09-04T14:36:08.086272Z",
"updated_at": "2022-09-04T14:36:08.086297Z",
"structure_string": "Hg1 P2 Se1\n1.0\n0.000000 3.395665 3.395665\n3.395665 -0.000000 3.395665\n3.395665 3.395665 -0.000000\nHg P Se\n1 2 1\ndirect\n0.499999 0.499999 0.499999 Hg\n0.000000 0.000000 0.000000 P\n0.749999 0.749999 0.749999 P\n0.250000 0.250000 0.250000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hg",
"P",
"Se"
],
"chemical_system": "Hg-P-Se",
"density": 7.241560213420329,
"density_atomic": 0.051080540123978696,
"volume": 78.30770759846142,
"volume_molar": 11.789500943771406,
"formula_full": "Hg1 P2 Se1",
"formula_reduced": "HgP2Se",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6064272416666667,
"spacegroup": 216
},
{
"id": "jvasp-111045",
"created_at": "2022-09-04T14:38:37.188628Z",
"updated_at": "2022-09-04T14:38:37.188655Z",
"structure_string": "Hg1 Pb2\n1.0\n3.559696 0.081742 0.176080\n1.722057 3.116511 0.176080\n-0.440994 -0.267035 8.122066\nHg Pb\n1 2\ndirect\n0.000000 0.000000 0.000000 Hg\n0.667474 0.667472 0.674084 Pb\n0.332529 0.332528 0.325916 Pb\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hg",
"Pb"
],
"chemical_system": "Hg-Pb",
"density": 11.437879063730833,
"density_atomic": 0.033600798911257605,
"volume": 89.28359137897999,
"volume_molar": 17.92261182808467,
"formula_full": "Hg1 Pb2",
"formula_reduced": "HgPb2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1829393444444444,
"spacegroup": 164
},
{
"id": "jvasp-29371",
"created_at": "2022-09-04T14:37:01.219533Z",
"updated_at": "2022-09-04T14:37:01.219544Z",
"structure_string": "Hg1 Pb2 Cl2 O2\n1.0\n3.793555 -0.000033 1.099273\n1.483441 5.742755 1.975916\n-0.002546 -0.035937 7.104328\nHg Pb Cl O\n1 2 2 2\ndirect\n-0.000001 0.000001 0.000000 Hg\n0.819312 0.611087 0.750293 Pb\n0.180685 0.388912 0.249708 Pb\n0.430209 0.795525 0.344068 Cl\n0.569788 0.204475 0.655933 Cl\n0.193278 0.680279 0.933173 O\n0.806720 0.319719 0.066828 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Hg",
"Pb",
"Cl",
"O"
],
"chemical_system": "Cl-Hg-O-Pb",
"density": 7.691006574937966,
"density_atomic": 0.04516180774322018,
"volume": 154.99822415879402,
"volume_molar": 13.334587477632718,
"formula_full": "Hg1 Pb2 Cl2 O2",
"formula_reduced": "HgPb2(ClO)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 0.4753544821428569,
"spacegroup": 12
},
{
"id": "jvasp-26342",
"created_at": "2022-09-04T14:38:28.820913Z",
"updated_at": "2022-09-04T14:38:28.820939Z",
"structure_string": "Hg1 Pb2 Cl2 O2\n1.0\n3.793530 -0.000034 1.099267\n1.483365 5.742831 1.976133\n-0.002534 -0.035645 7.104249\nHg Pb Cl O\n1 2 2 2\ndirect\n-0.000000 -0.000000 0.000000 Hg\n0.819310 0.611106 0.750283 Pb\n0.180690 0.388895 0.249717 Pb\n0.430201 0.795541 0.344070 Cl\n0.569799 0.204460 0.655930 Cl\n0.193279 0.680292 0.933160 O\n0.806720 0.319709 0.066840 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Hg",
"Pb",
"Cl",
"O"
],
"chemical_system": "Cl-Hg-O-Pb",
"density": 7.691127630193932,
"density_atomic": 0.045162518583100886,
"volume": 154.9957845490772,
"volume_molar": 13.33437759658823,
"formula_full": "Hg1 Pb2 Cl2 O2",
"formula_reduced": "HgPb2(ClO)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 0.4753544821428569,
"spacegroup": 12
},
{
"id": "jvasp-104737",
"created_at": "2022-09-04T14:38:47.771482Z",
"updated_at": "2022-09-04T14:38:47.771515Z",
"structure_string": "Hg1 Pb3\n1.0\n3.628746 0.000000 -0.000000\n0.000000 3.628746 -0.000000\n-0.000000 0.000000 9.090867\nHg Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Hg\n0.500001 0.500001 0.238015 Pb\n0.500001 0.500001 0.761985 Pb\n0.000000 -0.000000 0.500000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hg",
"Pb"
],
"chemical_system": "Hg-Pb",
"density": 11.40519837408121,
"density_atomic": 0.03341500627746667,
"volume": 119.70669605103112,
"volume_molar": 18.02226433834614,
"formula_full": "Hg1 Pb3",
"formula_reduced": "HgPb3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1608272133333333,
"spacegroup": 123
},
{
"id": "jvasp-31155",
"created_at": "2022-09-04T14:38:28.945695Z",
"updated_at": "2022-09-04T14:38:28.945720Z",
"structure_string": "Hg1 Pb1 F6\n1.0\n6.100253 -0.019188 -0.012774\n3.817151 4.758446 -0.012774\n3.817151 1.824113 4.394950\nHg Pb F\n1 1 6\ndirect\n0.499999 0.500000 0.500001 Hg\n0.000000 0.000000 0.000000 Pb\n0.063453 0.408886 0.763180 F\n0.408885 0.763180 0.063455 F\n0.763179 0.063453 0.408887 F\n0.236819 0.936546 0.591115 F\n0.591114 0.236819 0.936547 F\n0.936545 0.591114 0.236822 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Hg",
"Pb",
"F"
],
"chemical_system": "F-Hg-Pb",
"density": 6.7593493726812675,
"density_atomic": 0.06241054954845853,
"volume": 128.18345708986936,
"volume_molar": 9.649235271232666,
"formula_full": "Hg1 Pb1 F6",
"formula_reduced": "HgPbF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-87088",
"created_at": "2022-09-04T14:36:19.190948Z",
"updated_at": "2022-09-04T14:36:19.190977Z",
"structure_string": "Hg4 Pd4\n1.0\n5.304728 -0.000000 0.000000\n0.000000 5.304728 0.000000\n0.000000 0.000000 5.304728\nHg Pd\n4 4\ndirect\n0.843257 0.656744 0.343257 Hg\n0.656744 0.343257 0.843257 Hg\n0.343257 0.843257 0.656744 Hg\n0.156743 0.156743 0.156743 Hg\n0.152814 0.347187 0.652814 Pd\n0.347187 0.652814 0.152814 Pd\n0.652814 0.152814 0.347187 Pd\n0.847187 0.847187 0.847187 Pd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Hg",
"Pd"
],
"chemical_system": "Hg-Pd",
"density": 13.660677836821002,
"density_atomic": 0.05359208158612288,
"volume": 149.27578409403523,
"volume_molar": 11.236997298420615,
"formula_full": "Hg4 Pd4",
"formula_reduced": "HgPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.5433852333333333,
"spacegroup": 198
},
{
"id": "jvasp-15016",
"created_at": "2022-09-04T14:36:39.721388Z",
"updated_at": "2022-09-04T14:36:39.721413Z",
"structure_string": "Hg2 Pd2\n1.0\n3.814770 0.000000 -0.000000\n0.000000 4.347118 0.000000\n0.000000 0.000000 4.347118\nHg Pd\n2 2\ndirect\n0.000000 0.000000 0.000000 Hg\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hg",
"Pd"
],
"chemical_system": "Hg-Pd",
"density": 14.143614091938765,
"density_atomic": 0.0554866844377769,
"volume": 72.08936775607171,
"volume_molar": 10.853307998161728,
"formula_full": "Hg2 Pd2",
"formula_reduced": "HgPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.5088452333333333,
"spacegroup": 123
},
{
"id": "jvasp-38839",
"created_at": "2022-09-04T14:37:59.447113Z",
"updated_at": "2022-09-04T14:37:59.447153Z",
"structure_string": "Hg1 Pd2 Au1\n1.0\n0.000000 3.258026 3.258026\n3.258026 0.000000 3.258026\n3.258026 3.258026 -0.000000\nHg Pd Au\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Hg\n0.000000 0.000000 0.000000 Pd\n0.500001 0.500001 0.500001 Pd\n0.249999 0.249999 0.249999 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hg",
"Pd",
"Au"
],
"chemical_system": "Au-Hg-Pd",
"density": 14.654383350841785,
"density_atomic": 0.05783175319274594,
"volume": 69.1661549091985,
"volume_molar": 10.41320801727896,
"formula_full": "Hg1 Pd2 Au1",
"formula_reduced": "HgPd2Au",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4950358925000001,
"spacegroup": 225
},
{
"id": "jvasp-40954",
"created_at": "2022-09-04T14:37:36.803196Z",
"updated_at": "2022-09-04T14:37:36.803215Z",
"structure_string": "Hg1 Pd3\n1.0\n4.044363 -0.000000 0.000000\n-0.000000 4.044363 -0.000000\n-0.000000 0.000000 4.044363\nHg Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 Hg\n0.000000 0.500000 0.500000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hg",
"Pd"
],
"chemical_system": "Hg-Pd",
"density": 13.04898584560703,
"density_atomic": 0.06046577248410096,
"volume": 66.15312821897332,
"volume_molar": 9.959586246224637,
"formula_full": "Hg1 Pd3",
"formula_reduced": "HgPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0788554666666668,
"spacegroup": 221
}
]
}