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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1097",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1095",
"results": [
{
"id": "jvasp-56172",
"created_at": "2022-09-04T14:38:36.367006Z",
"updated_at": "2022-09-04T14:38:36.367030Z",
"structure_string": "Mg6 Si16 Ir6\n1.0\n7.544074 -0.000000 4.355573\n2.514691 7.112621 4.355573\n-0.000000 -0.000000 8.711147\nMg Si Ir\n6 16 6\ndirect\n0.349994 0.349994 0.349994 Mg\n0.349994 0.950017 0.349994 Mg\n0.950016 0.349994 0.349994 Mg\n0.000000 0.000000 0.000000 Mg\n0.349994 0.349994 0.950017 Mg\n0.750000 0.750000 0.750000 Mg\n0.574207 0.574207 0.574208 Si\n0.667419 0.389140 0.971720 Si\n0.574207 0.277378 0.574208 Si\n0.389140 0.971720 0.971720 Si\n0.389140 0.971720 0.667419 Si\n0.971720 0.667419 0.389140 Si\n0.971720 0.667419 0.971720 Si\n0.277378 0.574207 0.574208 Si\n0.971720 0.389140 0.667419 Si\n0.971720 0.971720 0.667419 Si\n0.667419 0.971720 0.389140 Si\n0.667419 0.971720 0.971720 Si\n0.971720 0.389140 0.971720 Si\n0.389140 0.667419 0.971720 Si\n0.574207 0.574207 0.277378 Si\n0.971720 0.971720 0.389140 Si\n0.254955 0.745045 0.745045 Ir\n0.254955 0.745045 0.254955 Ir\n0.745044 0.745045 0.254955 Ir\n0.254955 0.254955 0.745045 Ir\n0.745044 0.254955 0.745045 Ir\n0.745044 0.254955 0.254955 Ir\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Mg",
"Si",
"Ir"
],
"chemical_system": "Ir-Mg-Si",
"density": 6.211604332194095,
"density_atomic": 0.05990279428716735,
"volume": 467.4239379513935,
"volume_molar": 10.053188389059994,
"formula_full": "Mg6 Si16 Ir6",
"formula_reduced": "Mg3Si8Ir3",
"formula_anonymous": "A3B3C8",
"energy_above_hull": 3.1829999464285708,
"spacegroup": 216
},
{
"id": "jvasp-39984",
"created_at": "2022-09-04T14:37:40.318197Z",
"updated_at": "2022-09-04T14:37:40.318221Z",
"structure_string": "Mg1 Si1 Ir2\n1.0\n-0.000000 3.022024 3.022024\n3.022024 -0.000000 3.022024\n3.022024 3.022024 0.000000\nMg Si Ir\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Mg\n0.749999 0.749999 0.749999 Si\n0.000000 0.000000 0.000000 Ir\n0.499999 0.499999 0.499999 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Si",
"Ir"
],
"chemical_system": "Ir-Mg-Si",
"density": 13.141119454984734,
"density_atomic": 0.07246633018911791,
"volume": 55.198048384140066,
"volume_molar": 8.310260426164552,
"formula_full": "Mg1 Si1 Ir2",
"formula_reduced": "MgSiIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.7491924625,
"spacegroup": 225
},
{
"id": "jvasp-21868",
"created_at": "2022-09-04T14:37:28.956851Z",
"updated_at": "2022-09-04T14:37:28.956868Z",
"structure_string": "Mg2 Si14 Ir6\n1.0\n6.694979 -0.004808 4.420448\n2.375932 6.259211 4.420448\n-0.006972 -0.004808 8.022659\nMg Si Ir\n2 14 6\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.650352 0.434372 0.826685 Si\n0.434372 0.826684 0.650352 Si\n0.934373 0.150352 0.326685 Si\n0.150352 0.326684 0.934373 Si\n0.326685 0.934372 0.150352 Si\n0.349648 0.565627 0.173316 Si\n0.173315 0.349648 0.565628 Si\n0.750000 0.749999 0.750001 Si\n0.250000 0.250000 0.250000 Si\n0.826685 0.650351 0.434373 Si\n0.673316 0.065627 0.849648 Si\n0.849648 0.673315 0.065628 Si\n0.065628 0.849648 0.673316 Si\n0.565628 0.173315 0.349648 Si\n0.250000 0.573658 0.926342 Ir\n0.073658 0.750000 0.426342 Ir\n0.750000 0.426341 0.073659 Ir\n0.426342 0.073658 0.750000 Ir\n0.926342 0.250000 0.573659 Ir\n0.573658 0.926341 0.250001 Ir\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Mg",
"Si",
"Ir"
],
"chemical_system": "Ir-Mg-Si",
"density": 7.869845979476639,
"density_atomic": 0.06536562992339351,
"volume": 336.56831618976696,
"volume_molar": 9.213008070231652,
"formula_full": "Mg2 Si14 Ir6",
"formula_reduced": "MgSi7Ir3",
"formula_anonymous": "AB3C7",
"energy_above_hull": 3.8070684136363626,
"spacegroup": 167
},
{
"id": "jvasp-77197",
"created_at": "2022-09-04T14:37:56.521350Z",
"updated_at": "2022-09-04T14:37:56.521377Z",
"structure_string": "Mg1 Sc1 Ir2\n1.0\n-10.524856 2.202624 -2.479660\n-7.413939 1.259492 0.789137\n-6.544210 3.719465 -0.717280\nMg Sc Ir\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500001 0.000000 -0.000001 Sc\n0.735190 0.015023 0.015021 Ir\n0.264811 -0.015022 -0.015023 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Sc",
"Ir"
],
"chemical_system": "Ir-Mg-Sc",
"density": 11.54553843992951,
"density_atomic": 0.061300099093263796,
"volume": 65.252749329398,
"volume_molar": 9.82403103596576,
"formula_full": "Mg1 Sc1 Ir2",
"formula_reduced": "MgScIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.620231625,
"spacegroup": 12
},
{
"id": "jvasp-107198",
"created_at": "2022-09-04T14:36:59.680296Z",
"updated_at": "2022-09-04T14:36:59.680322Z",
"structure_string": "Mg1 Sc1 Ir2\n1.0\n3.881104 -0.000000 2.240756\n1.293701 3.659140 2.240756\n-0.000000 -0.000000 4.481513\nMg Sc Ir\n1 1 2\ndirect\n0.499999 0.500000 0.500001 Mg\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Ir\n0.749999 0.750000 0.750001 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Sc",
"Ir"
],
"chemical_system": "Ir-Mg-Sc",
"density": 11.837337746962193,
"density_atomic": 0.06284938382602143,
"volume": 63.64421982358221,
"volume_molar": 9.58186125844986,
"formula_full": "Mg1 Sc1 Ir2",
"formula_reduced": "MgScIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.540704125,
"spacegroup": 225
},
{
"id": "jvasp-103282",
"created_at": "2022-09-04T14:36:33.362052Z",
"updated_at": "2022-09-04T14:36:33.362072Z",
"structure_string": "Mg1 Sc2 Ir1\n1.0\n4.077337 -0.000000 2.354051\n1.359112 3.844150 2.354051\n-0.000000 0.000000 4.708103\nMg Sc Ir\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Sc\n0.750000 0.750000 0.749999 Sc\n0.500000 0.500000 0.499999 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Sc",
"Ir"
],
"chemical_system": "Ir-Mg-Sc",
"density": 6.895454688457748,
"density_atomic": 0.054204719584016674,
"volume": 73.79431220560134,
"volume_molar": 11.109993384737933,
"formula_full": "Mg1 Sc2 Ir1",
"formula_reduced": "MgSc2Ir",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0872926624999995,
"spacegroup": 225
},
{
"id": "jvasp-102529",
"created_at": "2022-09-04T14:36:49.188714Z",
"updated_at": "2022-09-04T14:36:49.188728Z",
"structure_string": "Mg2 Ir1 Rh1\n1.0\n3.807834 -0.000000 2.198454\n1.269278 3.590061 2.198454\n-0.000000 -0.000000 4.396908\nMg Ir Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Mg\n0.750000 0.750000 0.749999 Mg\n0.500000 0.500000 0.499999 Ir\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Ir",
"Rh"
],
"chemical_system": "Ir-Mg-Rh",
"density": 9.49603879779382,
"density_atomic": 0.06654765821968885,
"volume": 60.107299144848895,
"volume_molar": 9.049365403842693,
"formula_full": "Mg2 Ir1 Rh1",
"formula_reduced": "Mg2IrRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.33819555,
"spacegroup": 225
},
{
"id": "jvasp-110821",
"created_at": "2022-09-04T14:38:36.818106Z",
"updated_at": "2022-09-04T14:38:36.818124Z",
"structure_string": "Mg2 Ir1 Pt1\n1.0\n3.827746 -0.000000 2.209950\n1.275915 3.608833 2.209950\n-0.000000 -0.000000 4.419900\nMg Ir Pt\n2 1 1\ndirect\n0.250001 0.250000 0.250000 Mg\n0.750002 0.749999 0.749999 Mg\n0.500001 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Ir",
"Pt"
],
"chemical_system": "Ir-Mg-Pt",
"density": 11.855628594092552,
"density_atomic": 0.06551453321120987,
"volume": 61.05515530583952,
"volume_molar": 9.192068484385661,
"formula_full": "Mg2 Ir1 Pt1",
"formula_reduced": "Mg2IrPt",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.21358765,
"spacegroup": 225
},
{
"id": "jvasp-105199",
"created_at": "2022-09-04T14:36:47.815655Z",
"updated_at": "2022-09-04T14:36:47.815684Z",
"structure_string": "Mg2 Ir1 Pd1\n1.0\n3.834523 0.000000 2.213863\n1.278174 3.615223 2.213863\n-0.000000 -0.000000 4.427726\nMg Ir Pd\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Mg\n0.749999 0.749999 0.750001 Mg\n0.499999 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Ir",
"Pd"
],
"chemical_system": "Ir-Mg-Pd",
"density": 9.394213450738798,
"density_atomic": 0.0651677632917029,
"volume": 61.38004126511545,
"volume_molar": 9.240981208828343,
"formula_full": "Mg2 Ir1 Pd1",
"formula_reduced": "Mg2IrPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9943312249999998,
"spacegroup": 225
},
{
"id": "jvasp-58164",
"created_at": "2022-09-04T14:36:32.170892Z",
"updated_at": "2022-09-04T14:36:32.170915Z",
"structure_string": "Mg4 Ti2 Ir2 O12\n1.0\n0.000000 5.142560 0.011432\n5.312342 0.000000 0.000000\n0.000000 -5.113236 -7.516085\nMg Ti Ir O\n4 2 2 12\ndirect\n0.247860 0.945291 0.253351 Mg\n0.752140 0.445291 0.246650 Mg\n0.247860 0.554708 0.753351 Mg\n0.752140 0.054709 0.746650 Mg\n0.000000 0.500000 0.000000 Ti\n-0.000000 0.000000 0.500000 Ti\n0.500000 0.500000 0.500000 Ir\n0.500000 0.000000 0.000000 Ir\n0.102656 0.812627 0.928353 O\n0.256863 0.321511 0.937153 O\n0.897344 0.312627 0.571648 O\n0.622471 0.069586 0.252337 O\n0.377529 0.930413 0.747664 O\n0.897344 0.187373 0.071648 O\n0.743137 0.678489 0.062848 O\n0.256863 0.178489 0.437152 O\n0.743137 0.821511 0.562849 O\n0.622471 0.430413 0.752337 O\n0.102657 0.687372 0.428353 O\n0.377529 0.569586 0.247664 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"Ti",
"Ir",
"O"
],
"chemical_system": "Ir-Mg-O-Ti",
"density": 6.2314721623712135,
"density_atomic": 0.097550660262875,
"volume": 205.02167741463694,
"volume_molar": 6.173347001211283,
"formula_full": "Mg4 Ti2 Ir2 O12",
"formula_reduced": "Mg2TiIrO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.304284853333333,
"spacegroup": 14
},
{
"id": "jvasp-22264",
"created_at": "2022-09-04T14:37:40.206279Z",
"updated_at": "2022-09-04T14:37:40.206299Z",
"structure_string": "Sr2 Mg1 Ir1 O6\n1.0\n4.852852 -0.000000 2.801796\n1.617617 4.575313 2.801796\n-0.000000 -0.000000 5.603591\nSr Mg Ir O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.749999 0.750001 Sr\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500001 Ir\n0.254978 0.745021 0.745022 O\n0.254978 0.745021 0.254979 O\n0.745022 0.254978 0.745023 O\n0.254978 0.254978 0.745022 O\n0.745022 0.254978 0.254979 O\n0.745022 0.745021 0.254979 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Ir",
"O"
],
"chemical_system": "Ir-Mg-O-Sr",
"density": 6.509828830691486,
"density_atomic": 0.08037402442577737,
"volume": 124.41830642976765,
"volume_molar": 7.492645544408739,
"formula_full": "Sr2 Mg1 Ir1 O6",
"formula_reduced": "Sr2MgIrO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.818393377,
"spacegroup": 225
},
{
"id": "jvasp-22415",
"created_at": "2022-09-04T14:37:11.885496Z",
"updated_at": "2022-09-04T14:37:11.885525Z",
"structure_string": "Sr6 Mg2 Ir2 O12\n1.0\n6.713100 0.009713 -0.271692\n-0.283302 6.707126 -0.271692\n0.009299 0.009713 6.718588\nSr Mg Ir O\n6 2 2 12\ndirect\n0.884453 0.249999 0.615547 Sr\n0.384453 0.115546 0.750000 Sr\n0.750000 0.384453 0.115547 Sr\n0.115547 0.750000 0.384454 Sr\n0.615547 0.884453 0.250001 Sr\n0.250000 0.615547 0.884454 Sr\n0.750000 0.750000 0.750001 Mg\n0.250000 0.250000 0.250000 Mg\n0.500000 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Ir\n0.095554 0.288520 0.963869 O\n0.788521 0.595553 0.463869 O\n0.536131 0.211479 0.404447 O\n0.404447 0.536131 0.211480 O\n0.211480 0.404446 0.536132 O\n0.711480 0.036130 0.904447 O\n0.904447 0.711479 0.036132 O\n0.036132 0.904447 0.711480 O\n0.463869 0.788520 0.595554 O\n0.595554 0.463868 0.788521 O\n0.963869 0.095553 0.288521 O\n0.288521 0.963869 0.095554 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Mg",
"Ir",
"O"
],
"chemical_system": "Ir-Mg-O-Sr",
"density": 6.315645172436947,
"density_atomic": 0.07271227883241835,
"volume": 302.562378091655,
"volume_molar": 8.282151043401301,
"formula_full": "Sr6 Mg2 Ir2 O12",
"formula_reduced": "Sr3MgIrO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.590688189090909,
"spacegroup": 167
}
]
}