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=elements&page=4446",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=4444",
"results": [
{
"id": "jvasp-104693",
"created_at": "2022-09-04T14:36:53.403454Z",
"updated_at": "2022-09-04T14:36:53.403485Z",
"structure_string": "Sr1 Ca1 Cr2 O6\n1.0\n3.803405 -0.000000 0.000000\n0.000000 3.803405 0.000000\n-0.000000 -0.000000 7.577759\nSr Ca Cr O\n1 1 2 6\ndirect\n0.499999 0.499999 -0.000000 Sr\n0.499999 0.499999 0.500000 Ca\n0.000000 0.000000 0.253389 Cr\n0.000000 0.000000 0.746611 Cr\n0.000000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.499999 0.000000 0.743336 O\n0.499999 0.000000 0.256664 O\n-0.000000 0.499999 0.256664 O\n-0.000000 0.499999 0.743336 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Cr",
"O"
],
"chemical_system": "Ca-Cr-O-Sr",
"density": 4.963886520455705,
"density_atomic": 0.0912250404904605,
"volume": 109.6190250641293,
"volume_molar": 6.601411989101546,
"formula_full": "Sr1 Ca1 Cr2 O6",
"formula_reduced": "SrCaCr2O6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.497093253,
"spacegroup": 123
},
{
"id": "jvasp-107031",
"created_at": "2022-09-04T14:36:56.685344Z",
"updated_at": "2022-09-04T14:36:56.685366Z",
"structure_string": "Sr1 Ca1 Cu2 O4\n1.0\n4.646997 -0.019302 -2.153144\n-1.903621 4.239243 -2.153144\n0.012548 0.019302 5.121567\nSr Ca Cu O\n1 1 2 4\ndirect\n0.500000 0.500000 0.000001 Sr\n0.000000 0.000000 0.000000 Ca\n0.250000 0.749999 0.500001 Cu\n0.750001 0.250000 0.500001 Cu\n0.500000 0.500000 0.500001 O\n0.000000 -0.000000 0.500000 O\n-0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000001 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Cu",
"O"
],
"chemical_system": "Ca-Cu-O-Sr",
"density": 5.236374710676414,
"density_atomic": 0.0791352877983841,
"volume": 101.09270115225836,
"volume_molar": 7.609930951843925,
"formula_full": "Sr1 Ca1 Cu2 O4",
"formula_reduced": "SrCa(CuO2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.88759395375,
"spacegroup": 139
},
{
"id": "jvasp-107287",
"created_at": "2022-09-04T14:36:53.171953Z",
"updated_at": "2022-09-04T14:36:53.171964Z",
"structure_string": "Sr1 Ca1 Cu2 O4\n1.0\n8.210021 -0.027883 0.000000\n-7.475219 3.395044 0.000000\n-0.000000 -0.000000 3.915878\nSr Ca Cu O\n1 1 2 4\ndirect\n0.670382 0.329618 0.500000 Sr\n0.331339 0.668660 -0.000000 Ca\n0.937065 0.062936 0.500000 Cu\n0.061797 0.938201 -0.000000 Cu\n0.054818 0.945179 0.500000 O\n0.940374 0.059627 -0.000000 O\n0.820323 0.179678 0.500000 O\n0.183900 0.816098 -0.000000 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Cu",
"O"
],
"chemical_system": "Ca-Cu-O-Sr",
"density": 4.886427498586668,
"density_atomic": 0.07384667212951289,
"volume": 108.3325730097835,
"volume_molar": 8.154925044473664,
"formula_full": "Sr1 Ca1 Cu2 O4",
"formula_reduced": "SrCa(CuO2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.88954770375,
"spacegroup": 38
},
{
"id": "jvasp-119145",
"created_at": "2022-09-04T14:38:51.643218Z",
"updated_at": "2022-09-04T14:38:51.643240Z",
"structure_string": "Sr1 Ca2 Fe3 O6\n1.0\n3.847547 -0.000000 0.000000\n0.000000 3.847547 0.000000\n-0.000000 -0.000000 9.859974\nSr Ca Fe O\n1 2 3 6\ndirect\n0.500000 0.500000 -0.000000 Sr\n0.500000 0.500000 0.338771 Ca\n0.500000 0.500000 0.661229 Ca\n0.000000 0.000000 0.814153 Fe\n0.000000 0.000000 0.185847 Fe\n0.000000 0.000000 0.500000 Fe\n-0.000000 0.500000 0.181583 O\n-0.000000 0.500000 0.500000 O\n-0.000000 0.500000 0.818417 O\n0.500000 0.000000 0.181583 O\n0.500000 0.000000 0.500000 O\n0.500000 0.000000 0.818417 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Fe",
"O"
],
"chemical_system": "Ca-Fe-O-Sr",
"density": 4.906732359606142,
"density_atomic": 0.08221245344199511,
"volume": 145.9632877696149,
"volume_molar": 7.325095539508395,
"formula_full": "Sr1 Ca2 Fe3 O6",
"formula_reduced": "SrCa2(FeO2)3",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 2.185236220833333,
"spacegroup": 123
},
{
"id": "jvasp-116773",
"created_at": "2022-09-04T14:38:45.165350Z",
"updated_at": "2022-09-04T14:38:45.165377Z",
"structure_string": "Sr3 Ca1 Fe4 O12\n1.0\n5.389787 0.003138 0.006968\n-0.004277 7.598776 -0.028781\n0.018799 0.020711 5.390684\nSr Ca Fe O\n3 1 4 12\ndirect\n0.498716 0.749994 0.498699 Sr\n0.500468 0.250000 0.500406 Sr\n0.999660 0.750006 -0.000289 Sr\n0.003438 0.250010 0.003265 Ca\n0.000186 0.498081 0.499892 Fe\n0.499923 0.001918 0.000216 Fe\n0.000187 0.001913 0.499893 Fe\n0.499924 0.498089 0.000216 Fe\n0.757310 0.021523 0.757295 O\n0.757241 0.478497 0.757236 O\n0.248010 0.513489 0.248021 O\n0.247954 0.986503 0.247974 O\n0.250183 0.495937 0.749508 O\n0.984600 0.749995 0.514832 O\n0.513721 0.749995 0.983395 O\n0.014265 0.249999 0.473652 O\n0.749299 0.497299 0.250415 O\n0.475426 0.250005 0.015440 O\n0.250242 0.004061 0.749455 O\n0.749246 0.002691 0.250479 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Fe",
"O"
],
"chemical_system": "Ca-Fe-O-Sr",
"density": 5.402538553957511,
"density_atomic": 0.09058710420197588,
"volume": 220.78197748111435,
"volume_molar": 6.647900728312105,
"formula_full": "Sr3 Ca1 Fe4 O12",
"formula_reduced": "Sr3Ca(FeO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.4496091675,
"spacegroup": 38
},
{
"id": "jvasp-22111",
"created_at": "2022-09-04T14:38:14.903235Z",
"updated_at": "2022-09-04T14:38:14.903245Z",
"structure_string": "Sr4 Ca2 Ir2 O12\n1.0\n0.000000 5.779777 -0.001003\n5.882604 0.000000 0.000000\n0.000000 -5.727903 -8.218441\nSr Ca Ir O\n4 2 2 12\ndirect\n0.240631 0.044279 0.250279 Sr\n0.759370 0.544278 0.249721 Sr\n0.240631 0.455721 0.750279 Sr\n0.759370 0.955721 0.749721 Sr\n0.500000 0.500000 0.500000 Ca\n0.500000 0.000000 -0.000000 Ca\n0.000000 0.000000 0.500000 Ir\n0.000000 0.500000 0.000000 Ir\n0.232035 0.808890 0.460427 O\n0.767965 0.308890 0.039573 O\n0.857131 0.771330 0.043775 O\n0.142870 0.271330 0.456224 O\n0.142870 0.228670 0.956224 O\n0.691552 0.521137 0.769725 O\n0.308449 0.478862 0.230275 O\n0.691552 0.978862 0.269725 O\n0.232035 0.691109 0.960427 O\n0.308449 0.021138 0.730275 O\n0.857131 0.728670 0.543775 O\n0.767966 0.191110 0.539573 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Ir",
"O"
],
"chemical_system": "Ca-Ir-O-Sr",
"density": 5.983881570700023,
"density_atomic": 0.07156609721335873,
"volume": 279.4619348931989,
"volume_molar": 8.414795544943997,
"formula_full": "Sr4 Ca2 Ir2 O12",
"formula_reduced": "Sr2CaIrO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.864264514,
"spacegroup": 14
},
{
"id": "jvasp-122464",
"created_at": "2022-09-04T14:38:50.386520Z",
"updated_at": "2022-09-04T14:38:50.386549Z",
"structure_string": "Sr7 Ca1 Ir2 O12\n1.0\n6.867260 0.013857 -0.100282\n-0.101959 6.866517 -0.100282\n0.013625 0.013857 6.867979\nSr Ca Ir O\n7 1 2 12\ndirect\n0.136001 0.864000 0.500000 Sr\n0.500001 0.136001 0.864000 Sr\n0.864000 0.500001 0.136001 Sr\n0.000000 0.365998 0.634003 Sr\n0.634003 0.000000 0.365998 Sr\n0.365997 0.634003 0.000000 Sr\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500001 0.500000 Ca\n0.746400 0.746401 0.746400 Ir\n0.253600 0.253601 0.253600 Ir\n0.332407 0.200813 0.539872 O\n0.689941 0.823492 0.033678 O\n0.823491 0.033679 0.689941 O\n0.033678 0.689942 0.823491 O\n0.310059 0.966323 0.176509 O\n0.460128 0.799188 0.667594 O\n0.176510 0.310059 0.966322 O\n0.799188 0.667595 0.460128 O\n0.667594 0.460129 0.799188 O\n0.539872 0.332407 0.200813 O\n0.966322 0.176510 0.310059 O\n0.200813 0.539873 0.332406 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Ir",
"O"
],
"chemical_system": "Ca-Ir-O-Sr",
"density": 6.305389281102303,
"density_atomic": 0.06792586510357587,
"volume": 323.8825146570248,
"volume_molar": 8.865754968033484,
"formula_full": "Sr7 Ca1 Ir2 O12",
"formula_reduced": "Sr7Ca(IrO6)2",
"formula_anonymous": "AB2C7D12",
"energy_above_hull": 1.8342081268181816,
"spacegroup": 155
},
{
"id": "jvasp-24357",
"created_at": "2022-09-04T14:37:07.139804Z",
"updated_at": "2022-09-04T14:37:07.139827Z",
"structure_string": "Sr6 Ca2 Ir2 O12\n1.0\n6.827558 -0.003948 -0.156336\n-0.159867 6.825688 -0.156336\n-0.003859 -0.003948 6.829347\nSr Ca Ir O\n6 2 2 12\ndirect\n0.750000 0.385550 0.114449 Sr\n0.614449 0.885551 0.249999 Sr\n0.885551 0.250000 0.614449 Sr\n0.114449 0.750000 0.385550 Sr\n0.385551 0.114449 0.750000 Sr\n0.250000 0.614449 0.885550 Sr\n0.250000 0.250000 0.250000 Ca\n0.750000 0.750000 0.749999 Ca\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Ir\n0.917587 0.713103 0.050541 O\n0.050542 0.917587 0.713103 O\n0.082412 0.286897 0.949458 O\n0.949458 0.082412 0.286896 O\n0.550542 0.213103 0.417587 O\n0.213103 0.417587 0.550542 O\n0.449458 0.786897 0.582412 O\n0.417587 0.550542 0.213103 O\n0.286896 0.949458 0.082412 O\n0.713103 0.050541 0.917587 O\n0.582412 0.449458 0.786896 O\n0.786897 0.582412 0.449457 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Ir",
"O"
],
"chemical_system": "Ca-Ir-O-Sr",
"density": 6.1688497730093985,
"density_atomic": 0.06912721485648898,
"volume": 318.2538171930249,
"volume_molar": 8.711678566107745,
"formula_full": "Sr6 Ca2 Ir2 O12",
"formula_reduced": "Sr3CaIrO6",
"formula_anonymous": "ABC3D6",
"energy_above_hull": 1.6294392227272725,
"spacegroup": 167
},
{
"id": "jvasp-116647",
"created_at": "2022-09-04T14:38:52.438108Z",
"updated_at": "2022-09-04T14:38:52.438127Z",
"structure_string": "Sr2 Ca2 Mn4 O12\n1.0\n6.208415 -0.009773 2.135893\n-3.117452 5.308051 2.283173\n-0.122867 -0.009777 6.564403\nSr Ca Mn O\n2 2 4 12\ndirect\n0.500003 0.000003 -0.000003 Sr\n0.000002 0.000003 0.499997 Sr\n0.499989 0.499983 0.499988 Ca\n-0.000008 0.499984 -0.000011 Ca\n0.500017 -0.000014 0.499976 Mn\n0.000018 0.499997 0.499966 Mn\n0.000018 -0.000014 -0.000024 Mn\n0.500019 0.499998 -0.000035 Mn\n0.750005 0.296491 0.453513 O\n0.249990 0.296484 0.953533 O\n0.038849 0.788858 0.250010 O\n0.538840 0.788860 0.750018 O\n-0.038864 0.211150 0.750014 O\n0.250005 0.500006 0.250026 O\n0.749983 -0.000008 0.250019 O\n0.250000 0.000022 0.750005 O\n0.750004 0.703523 0.046481 O\n0.749988 0.500003 0.750011 O\n0.461142 0.211149 0.250009 O\n0.249989 0.703518 0.546501 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Mn",
"O"
],
"chemical_system": "Ca-Mn-O-Sr",
"density": 5.088095264620371,
"density_atomic": 0.0918583232420298,
"volume": 217.72659563253376,
"volume_molar": 6.555901030473598,
"formula_full": "Sr2 Ca2 Mn4 O12",
"formula_reduced": "SrCaMn2O6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.379195221275862,
"spacegroup": 65
},
{
"id": "jvasp-116648",
"created_at": "2022-09-04T14:38:41.518160Z",
"updated_at": "2022-09-04T14:38:41.518188Z",
"structure_string": "Sr2 Ca2 Mn4 O12\n1.0\n5.361616 -0.000000 0.000000\n0.000000 5.362650 0.000000\n-0.000000 -0.000000 7.577617\nSr Ca Mn O\n2 2 4 12\ndirect\n0.018965 0.247904 0.500000 Sr\n0.518965 0.752096 0.500000 Sr\n0.965078 0.256025 -0.000000 Ca\n0.465078 0.743975 -0.000000 Ca\n0.492623 0.246548 0.755351 Mn\n-0.007377 0.753452 0.244649 Mn\n0.492623 0.246548 0.244649 Mn\n-0.007377 0.753452 0.755351 Mn\n0.017414 0.817989 -0.000000 O\n0.517414 0.182011 -0.000000 O\n0.722132 0.532028 0.788751 O\n0.222132 0.467972 0.211249 O\n0.283067 0.969508 0.269855 O\n0.722132 0.532028 0.211249 O\n0.283067 0.969508 0.730146 O\n0.783068 0.030492 0.269855 O\n0.502904 0.294044 0.500000 O\n0.222132 0.467972 0.788751 O\n0.783068 0.030492 0.730146 O\n0.002903 0.705956 0.500000 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Mn",
"O"
],
"chemical_system": "Ca-Mn-O-Sr",
"density": 5.08462473381012,
"density_atomic": 0.09179566774436133,
"volume": 217.87520578528094,
"volume_molar": 6.5603757867646415,
"formula_full": "Sr2 Ca2 Mn4 O12",
"formula_reduced": "SrCaMn2O6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.377509221275861,
"spacegroup": 26
},
{
"id": "jvasp-11727",
"created_at": "2022-09-04T14:38:10.313927Z",
"updated_at": "2022-09-04T14:38:10.313948Z",
"structure_string": "Sr2 Ca1 Mo1 O6\n1.0\n5.073671 -0.000000 2.929285\n1.691224 4.783503 2.929285\n-0.000000 0.000000 5.858570\nSr Ca Mo O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.749999 Sr\n0.500000 0.500000 0.499999 Ca\n0.000000 0.000000 0.000000 Mo\n0.231501 0.768498 0.768498 O\n0.231501 0.768498 0.231501 O\n0.768498 0.231502 0.768498 O\n0.231502 0.231502 0.768498 O\n0.768498 0.231502 0.231501 O\n0.768498 0.768498 0.231501 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Mo",
"O"
],
"chemical_system": "Ca-Mo-O-Sr",
"density": 4.756143028519706,
"density_atomic": 0.07032990386926816,
"volume": 142.18702784790338,
"volume_molar": 8.562702959461141,
"formula_full": "Sr2 Ca1 Mo1 O6",
"formula_reduced": "Sr2CaMoO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.972631994,
"spacegroup": 225
},
{
"id": "jvasp-110087",
"created_at": "2022-09-04T14:38:27.188774Z",
"updated_at": "2022-09-04T14:38:27.188784Z",
"structure_string": "Sr2 Ca1 Os1 O6\n1.0\n5.063115 -0.000000 2.923191\n1.687705 4.773551 2.923191\n-0.000000 -0.000000 5.846382\nSr Ca Os O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750001 0.750000 0.749999 Sr\n0.500001 0.500000 0.499999 Ca\n0.000000 0.000000 0.000000 Os\n0.767044 0.232956 0.232956 O\n0.232957 0.767043 0.767043 O\n0.232957 0.767043 0.232956 O\n0.767044 0.232956 0.767043 O\n0.232957 0.232956 0.767043 O\n0.767045 0.767043 0.232955 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Os",
"O"
],
"chemical_system": "Ca-O-Os-Sr",
"density": 5.89402448864182,
"density_atomic": 0.07077069373270692,
"volume": 141.30142679919027,
"volume_molar": 8.5093708177356,
"formula_full": "Sr2 Ca1 Os1 O6",
"formula_reduced": "Sr2CaOsO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.0122379040000005,
"spacegroup": 225
}
]
}