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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3559",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3557",
"results": [
{
"id": "jvasp-22381",
"created_at": "2022-09-04T14:37:06.415733Z",
"updated_at": "2022-09-04T14:37:06.415767Z",
"structure_string": "Sr8 Ir2 O12\n1.0\n6.910883 -0.002784 -0.014434\n-0.014458 6.910868 -0.014434\n-0.002779 -0.002784 6.910898\nSr Ir O\n8 2 12\ndirect\n0.616122 0.883878 0.250001 Sr\n0.250000 0.616123 0.883878 Sr\n0.883877 0.250001 0.616123 Sr\n0.383877 0.116123 0.750001 Sr\n0.750000 0.383878 0.116123 Sr\n0.116122 0.750000 0.383878 Sr\n0.749999 0.750001 0.750001 Sr\n0.250000 0.250000 0.250000 Sr\n0.500000 0.500001 0.500001 Ir\n0.000000 0.000000 0.000000 Ir\n0.073195 0.285858 0.941304 O\n0.785857 0.573196 0.441304 O\n0.558696 0.214143 0.426806 O\n0.426805 0.558697 0.214143 O\n0.214142 0.426806 0.558697 O\n0.714142 0.058698 0.926806 O\n0.926804 0.714143 0.058698 O\n0.058696 0.926806 0.714143 O\n0.441303 0.785858 0.573196 O\n0.573195 0.441304 0.785858 O\n0.941303 0.073196 0.285858 O\n0.285857 0.941304 0.073196 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
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"Ir",
"O"
],
"chemical_system": "Ir-O-Sr",
"density": 6.426462786810396,
"density_atomic": 0.06665353024611366,
"volume": 330.06503809725433,
"volume_molar": 9.034991451711036,
"formula_full": "Sr8 Ir2 O12",
"formula_reduced": "Sr4IrO6",
"formula_anonymous": "AB4C6",
"energy_above_hull": 1.621909758181818,
"spacegroup": 167
},
{
"id": "jvasp-21528",
"created_at": "2022-09-04T14:36:04.061798Z",
"updated_at": "2022-09-04T14:36:04.061834Z",
"structure_string": "Sr8 Ir4 O16\n1.0\n5.385686 0.000000 -1.122470\n-0.233942 5.380603 -1.122470\n0.037553 0.039221 13.661854\nSr Ir O\n8 4 16\ndirect\n0.199996 0.949996 0.899993 Sr\n0.449997 0.699996 0.399993 Sr\n0.300004 0.550003 0.100007 Sr\n0.050004 0.800003 0.600007 Sr\n0.949997 0.199996 0.399993 Sr\n0.699997 0.449996 0.899993 Sr\n0.550004 0.300003 0.600007 Sr\n0.800004 0.050004 0.100007 Sr\n0.625000 0.874999 0.750000 Ir\n0.875001 0.625000 0.250000 Ir\n0.125000 0.375000 0.750000 Ir\n0.375000 0.125000 0.250000 Ir\n0.064747 0.935253 0.250000 O\n0.814747 0.564747 0.750000 O\n0.954953 0.704952 0.409904 O\n0.314747 0.685253 0.750000 O\n0.564748 0.814747 0.250000 O\n0.185253 0.435253 0.250000 O\n0.935253 0.064747 0.750000 O\n0.704953 0.954952 0.909903 O\n0.454952 0.204952 0.409904 O\n0.795048 0.545047 0.090096 O\n0.045048 0.295047 0.590096 O\n0.295048 0.045048 0.090096 O\n0.545048 0.795047 0.590096 O\n0.204952 0.454952 0.909903 O\n0.685253 0.314747 0.250000 O\n0.435253 0.185253 0.750000 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Sr",
"Ir",
"O"
],
"chemical_system": "Ir-O-Sr",
"density": 7.23007308706749,
"density_atomic": 0.07064094923386699,
"volume": 396.3706646594171,
"volume_molar": 8.524999770406312,
"formula_full": "Sr8 Ir4 O16",
"formula_reduced": "Sr2IrO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.825702531428571,
"spacegroup": 142
},
{
"id": "jvasp-36603",
"created_at": "2022-09-04T14:37:20.211900Z",
"updated_at": "2022-09-04T14:37:20.211917Z",
"structure_string": "Sr1 Ir1 O3\n1.0\n3.994572 -0.000000 0.000000\n-0.000000 3.994572 -0.000000\n-0.000000 -0.000000 3.994572\nSr Ir O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Ir\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Ir",
"O"
],
"chemical_system": "Ir-O-Sr",
"density": 8.540708893636864,
"density_atomic": 0.07844391201042375,
"volume": 63.73980939828182,
"volume_molar": 7.67700208424048,
"formula_full": "Sr1 Ir1 O3",
"formula_reduced": "SrIrO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.066269582,
"spacegroup": 221
},
{
"id": "jvasp-15942",
"created_at": "2022-09-04T14:37:56.025472Z",
"updated_at": "2022-09-04T14:37:56.025508Z",
"structure_string": "Sr2 Ir1 O4\n1.0\n3.789856 0.000000 -1.092614\n-0.315000 3.776743 -1.092614\n-0.050001 -0.054345 6.945647\nSr Ir O\n2 1 4\ndirect\n0.645967 0.645966 0.291935 Sr\n0.354034 0.354034 0.708067 Sr\n0.000000 0.000000 0.000000 Ir\n0.500001 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.836571 0.836570 0.673142 O\n0.163430 0.163431 0.326860 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Sr",
"Ir",
"O"
],
"chemical_system": "Ir-O-Sr",
"density": 7.239389402924352,
"density_atomic": 0.07073197367961821,
"volume": 98.96514455692456,
"volume_molar": 8.514029012222109,
"formula_full": "Sr2 Ir1 O4",
"formula_reduced": "Sr2IrO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.8307296742857144,
"spacegroup": 139
},
{
"id": "jvasp-102735",
"created_at": "2022-09-04T14:36:58.514560Z",
"updated_at": "2022-09-04T14:36:58.514585Z",
"structure_string": "Ir1 Os1 Ru1\n1.0\n2.725768 -0.000000 0.000000\n-1.362883 2.360584 0.000000\n-0.000000 -0.000000 6.690524\nIr Os Ru\n1 1 1\ndirect\n0.000000 0.000000 -0.000304 Ir\n0.666667 0.333333 0.339101 Os\n0.333334 0.666665 0.661203 Ru\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ir",
"Os",
"Ru"
],
"chemical_system": "Ir-Os-Ru",
"density": 18.650580971260684,
"density_atomic": 0.06968716130158205,
"volume": 43.04953658561342,
"volume_molar": 8.641678965711126,
"formula_full": "Ir1 Os1 Ru1",
"formula_reduced": "IrOsRu",
"formula_anonymous": "ABC",
"energy_above_hull": 4.472945533333332,
"spacegroup": 156
},
{
"id": "jvasp-22217",
"created_at": "2022-09-04T14:37:34.851724Z",
"updated_at": "2022-09-04T14:37:34.851745Z",
"structure_string": "Sr4 Y2 Ir2 O12\n1.0\n0.000000 5.806967 0.000693\n5.846632 0.000000 0.000000\n0.000000 -5.752477 -8.230087\nSr Y Ir O\n4 2 2 12\ndirect\n0.741716 0.965285 0.749203 Sr\n0.258285 0.465285 0.750798 Sr\n0.258285 0.034715 0.250797 Sr\n0.741716 0.534714 0.249203 Sr\n0.000000 0.500000 0.000000 Y\n-0.000000 0.000000 0.500000 Y\n0.500000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Ir\n0.265480 0.701069 0.537078 O\n0.734521 0.201069 0.962923 O\n0.659515 0.727243 0.961618 O\n0.340485 0.227243 0.538383 O\n0.340485 0.272757 0.038383 O\n0.193289 0.015990 0.764420 O\n0.806712 0.984009 0.235580 O\n0.193289 0.484009 0.264420 O\n0.265480 0.798930 0.037077 O\n0.806712 0.515990 0.735581 O\n0.659515 0.772756 0.461618 O\n0.734521 0.298930 0.462923 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Y",
"Ir",
"O"
],
"chemical_system": "Ir-O-Sr-Y",
"density": 6.565645171150647,
"density_atomic": 0.07158246994967027,
"volume": 279.398014822093,
"volume_molar": 8.412870866616053,
"formula_full": "Sr4 Y2 Ir2 O12",
"formula_reduced": "Sr2YIrO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.2398090170000007,
"spacegroup": 14
},
{
"id": "jvasp-21417",
"created_at": "2022-09-04T14:36:53.395438Z",
"updated_at": "2022-09-04T14:36:53.395455Z",
"structure_string": "Sr6 Zn2 Ir2 O12\n1.0\n6.730047 0.035891 -0.193457\n-0.200125 6.727167 -0.193457\n0.034654 0.035891 6.732738\nSr Zn Ir O\n6 2 2 12\ndirect\n0.613751 0.886249 0.249999 Sr\n0.249999 0.613752 0.886248 Sr\n0.886248 0.250000 0.613751 Sr\n0.386248 0.113752 0.750000 Sr\n0.750000 0.386248 0.113751 Sr\n0.113751 0.750000 0.386248 Sr\n0.749999 0.750000 0.749999 Zn\n0.250000 0.250000 0.250000 Zn\n0.500000 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Ir\n0.093921 0.286199 0.959533 O\n0.786199 0.593921 0.459532 O\n0.540467 0.213801 0.406078 O\n0.406078 0.540467 0.213800 O\n0.213800 0.406079 0.540467 O\n0.713801 0.040467 0.906079 O\n0.906079 0.713801 0.040466 O\n0.040466 0.906079 0.713801 O\n0.459532 0.786199 0.593921 O\n0.593921 0.459533 0.786199 O\n0.959533 0.093921 0.286199 O\n0.286199 0.959533 0.093921 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Zn",
"Ir",
"O"
],
"chemical_system": "Ir-O-Sr-Zn",
"density": 6.713614968967091,
"density_atomic": 0.07214053118481273,
"volume": 304.9603272762083,
"volume_molar": 8.347790986695426,
"formula_full": "Sr6 Zn2 Ir2 O12",
"formula_reduced": "Sr3ZnIrO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.5341846754545452,
"spacegroup": 167
},
{
"id": "jvasp-106977",
"created_at": "2022-09-04T14:38:47.899560Z",
"updated_at": "2022-09-04T14:38:47.899594Z",
"structure_string": "Sc2 Ir1 Os1\n1.0\n3.939415 -0.000000 2.274422\n1.313138 3.714116 2.274422\n-0.000000 -0.000000 4.548844\nSc Ir Os\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sc\n0.749999 0.750001 0.749999 Sc\n0.499999 0.500001 0.499999 Ir\n0.000000 0.000000 0.000000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Ir",
"Os"
],
"chemical_system": "Ir-Os-Sc",
"density": 11.78508961102224,
"density_atomic": 0.060099623358631955,
"volume": 66.55615753414685,
"volume_molar": 10.02026372788417,
"formula_full": "Sc2 Ir1 Os1",
"formula_reduced": "Sc2IrOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.73471665,
"spacegroup": 225
},
{
"id": "jvasp-51124",
"created_at": "2022-09-04T14:36:57.758525Z",
"updated_at": "2022-09-04T14:36:57.758541Z",
"structure_string": "Tc1 Ir1 Os1\n1.0\n-0.000000 2.948276 2.948276\n2.948276 0.000000 2.948276\n2.948276 2.948276 0.000000\nTc Ir Os\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Tc\n0.000000 0.000000 0.000000 Ir\n0.500001 0.500001 0.500001 Os\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tc",
"Ir",
"Os"
],
"chemical_system": "Ir-Os-Tc",
"density": 15.565396079071018,
"density_atomic": 0.05853112177141991,
"volume": 51.254783937267135,
"volume_molar": 10.288784116453657,
"formula_full": "Tc1 Ir1 Os1",
"formula_reduced": "TcIrOs",
"formula_anonymous": "ABC",
"energy_above_hull": 4.909729199999999,
"spacegroup": 216
},
{
"id": "jvasp-77098",
"created_at": "2022-09-04T14:37:09.149560Z",
"updated_at": "2022-09-04T14:37:09.149579Z",
"structure_string": "Ti2 Ir1 Os1\n1.0\n-10.196932 2.042824 -2.551283\n-7.234359 1.203322 0.709492\n-6.391071 3.588497 -0.751124\nTi Ir Os\n2 1 1\ndirect\n0.744896 0.004077 0.004075 Ti\n0.255073 -0.004045 -0.004046 Ti\n0.500036 -0.000028 -0.000029 Ir\n-0.000005 -0.000002 -0.000002 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Ir",
"Os"
],
"chemical_system": "Ir-Os-Ti",
"density": 12.92669215367204,
"density_atomic": 0.06511873933719876,
"volume": 61.42625058029985,
"volume_molar": 9.247938183839935,
"formula_full": "Ti2 Ir1 Os1",
"formula_reduced": "Ti2IrOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.445030691666667,
"spacegroup": 12
},
{
"id": "jvasp-81585",
"created_at": "2022-09-04T14:36:51.335266Z",
"updated_at": "2022-09-04T14:36:51.335285Z",
"structure_string": "Ti2 Ir1 Os1\n1.0\n-8.430531 0.000001 -4.867370\n-5.595785 0.266016 -0.042556\n-4.800839 2.514460 -1.419441\nTi Ir Os\n2 1 1\ndirect\n0.750282 -0.000000 -0.000000 Ti\n0.249718 -0.000000 -0.000000 Ti\n0.500000 -0.000000 -0.000000 Ir\n0.000000 0.000000 0.000000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Ir",
"Os"
],
"chemical_system": "Ir-Os-Ti",
"density": 12.300979420689542,
"density_atomic": 0.06196668590584362,
"volume": 64.55081374010982,
"volume_molar": 9.718352162887085,
"formula_full": "Ti2 Ir1 Os1",
"formula_reduced": "Ti2IrOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.590298191666667,
"spacegroup": 71
},
{
"id": "jvasp-41493",
"created_at": "2022-09-04T14:37:37.267963Z",
"updated_at": "2022-09-04T14:37:37.267972Z",
"structure_string": "Tm2 Ir1 Os1\n1.0\n0.000000 3.362359 3.362359\n3.362359 0.000000 3.362359\n3.362359 3.362359 0.000000\nTm Ir Os\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500001 0.500001 0.500001 Tm\n0.250000 0.250000 0.250000 Ir\n0.750000 0.750000 0.750000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Ir",
"Os"
],
"chemical_system": "Ir-Os-Tm",
"density": 15.73292852943597,
"density_atomic": 0.05261356765291815,
"volume": 76.02601721265607,
"volume_molar": 11.445984426919944,
"formula_full": "Tm2 Ir1 Os1",
"formula_reduced": "Tm2IrOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.1482686500000003,
"spacegroup": 225
}
]
}