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=933",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=931",
"results": [
{
"id": "jvasp-100756",
"created_at": "2022-09-04T14:36:39.914385Z",
"updated_at": "2022-09-04T14:36:39.914406Z",
"structure_string": "Sr1 Cd3\n1.0\n4.581597 -0.000000 2.645186\n1.527199 4.319571 2.645186\n-0.000000 -0.000000 5.290373\nSr Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Cd\n0.750001 0.750000 0.750000 Cd\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"Cd"
],
"chemical_system": "Cd-Sr",
"density": 6.738201452156677,
"density_atomic": 0.03820464737511275,
"volume": 104.69930426856074,
"volume_molar": 15.762848694483539,
"formula_full": "Sr1 Cd3",
"formula_reduced": "SrCd3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1596645563636363,
"spacegroup": 225
},
{
"id": "jvasp-91621",
"created_at": "2022-09-04T14:35:54.278002Z",
"updated_at": "2022-09-04T14:35:54.278027Z",
"structure_string": "Sr2 Cd4 Pd2\n1.0\n4.469896 -0.000000 -0.000000\n-2.234948 5.331229 0.000000\n-0.000000 0.000000 8.140413\nSr Cd Pd\n2 4 2\ndirect\n0.065965 0.131930 0.250000 Sr\n0.934035 0.868070 0.750000 Sr\n0.355629 0.711257 0.445229 Cd\n0.644372 0.288743 0.554770 Cd\n0.355629 0.711257 0.054771 Cd\n0.644372 0.288743 0.945229 Cd\n0.779052 0.558104 0.250000 Pd\n0.220948 0.441896 0.750000 Pd\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sr",
"Cd",
"Pd"
],
"chemical_system": "Cd-Pd-Sr",
"density": 7.170985752071446,
"density_atomic": 0.04124001279834639,
"volume": 193.98636074916004,
"volume_molar": 14.60266462439476,
"formula_full": "Sr2 Cd4 Pd2",
"formula_reduced": "SrCd2Pd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-86316",
"created_at": "2022-09-04T14:35:51.556863Z",
"updated_at": "2022-09-04T14:35:51.556889Z",
"structure_string": "Sr2 Cd4\n1.0\n4.664776 -0.000000 2.009318\n2.181948 5.844864 1.353917\n0.015326 0.047150 6.383882\nSr Cd\n2 4\ndirect\n0.457547 0.292454 0.792454 Sr\n0.542456 0.707545 0.207546 Sr\n0.835204 0.113751 0.215843 Cd\n0.164799 0.886248 0.784157 Cd\n0.164798 0.284157 0.386249 Cd\n0.835204 0.715842 0.613751 Cd\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sr",
"Cd"
],
"chemical_system": "Cd-Sr",
"density": 5.970838288950057,
"density_atomic": 0.0345253474024115,
"volume": 173.7853621012635,
"volume_molar": 17.44266521002297,
"formula_full": "Sr2 Cd4",
"formula_reduced": "SrCd2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1704780845454544,
"spacegroup": 74
},
{
"id": "jvasp-86944",
"created_at": "2022-09-04T14:36:03.939020Z",
"updated_at": "2022-09-04T14:36:03.939045Z",
"structure_string": "Sr2 Cd4\n1.0\n4.664776 -0.000000 2.009318\n2.181948 5.844864 1.353917\n0.015326 0.047150 6.383882\nSr Cd\n2 4\ndirect\n0.457547 0.292454 0.792454 Sr\n0.542456 0.707545 0.207546 Sr\n0.835204 0.113751 0.215843 Cd\n0.164799 0.886248 0.784157 Cd\n0.164798 0.284157 0.386249 Cd\n0.835204 0.715842 0.613751 Cd\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sr",
"Cd"
],
"chemical_system": "Cd-Sr",
"density": 5.970838288950057,
"density_atomic": 0.0345253474024115,
"volume": 173.7853621012635,
"volume_molar": 17.44266521002297,
"formula_full": "Sr2 Cd4",
"formula_reduced": "SrCd2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1704780845454544,
"spacegroup": 74
},
{
"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-18653",
"created_at": "2022-09-04T14:36:59.704844Z",
"updated_at": "2022-09-04T14:36:59.704857Z",
"structure_string": "Sr1 Cd1\n1.0\n4.018134 0.000000 -0.000000\n0.000000 4.018134 -0.000000\n0.000000 0.000000 4.018134\nSr Cd\n1 1\ndirect\n0.499999 0.499999 0.499999 Sr\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sr",
"Cd"
],
"chemical_system": "Cd-Sr",
"density": 5.1200376667869225,
"density_atomic": 0.030828809071142226,
"volume": 64.87438406669203,
"volume_molar": 19.53413362839603,
"formula_full": "Sr1 Cd1",
"formula_reduced": "SrCd",
"formula_anonymous": "AB",
"energy_above_hull": 0.1721651409090909,
"spacegroup": 221
},
{
"id": "jvasp-79384",
"created_at": "2022-09-04T14:37:11.886674Z",
"updated_at": "2022-09-04T14:37:11.886705Z",
"structure_string": "Sr1 Ca1 Tl2\n1.0\n-0.000004 3.956790 3.956764\n3.956756 0.000002 3.956758\n3.956766 3.956793 -0.000007\nSr Ca Tl\n1 1 2\ndirect\n0.749998 0.750001 0.750000 Sr\n0.249998 0.249999 0.250001 Ca\n0.000000 -0.000000 0.000000 Tl\n0.499999 0.500001 0.500001 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"Tl"
],
"chemical_system": "Ca-Sr-Tl",
"density": 7.190132178555064,
"density_atomic": 0.03228543920864683,
"volume": 123.89486090462422,
"volume_molar": 18.6528072952067,
"formula_full": "Sr1 Ca1 Tl2",
"formula_reduced": "SrCaTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-119144",
"created_at": "2022-09-04T14:38:35.495055Z",
"updated_at": "2022-09-04T14:38:35.495066Z",
"structure_string": "Sr2 Ca2 Ti4 O12\n1.0\n5.495092 0.000000 0.000000\n0.000000 5.522604 0.000000\n-0.000000 -0.000000 7.752269\nSr Ca Ti O\n2 2 4 12\ndirect\n0.252033 0.984309 0.500000 Sr\n0.747967 0.484310 0.500000 Sr\n0.244287 0.038409 -0.000000 Ca\n0.755713 0.538409 -0.000000 Ca\n0.253904 0.510445 0.755117 Ti\n0.746096 0.010446 0.244883 Ti\n0.253904 0.510445 0.244883 Ti\n0.746096 0.010446 0.755117 Ti\n0.679331 0.976887 -0.000000 O\n0.320669 0.476887 -0.000000 O\n0.968913 0.274443 0.789074 O\n0.031087 0.774443 0.210926 O\n0.528425 0.715742 0.272881 O\n0.968913 0.274443 0.210926 O\n0.528425 0.715742 0.727119 O\n0.471574 0.215742 0.272881 O\n0.202147 0.499128 0.500000 O\n0.031087 0.774443 0.789074 O\n0.471574 0.215742 0.727119 O\n0.797852 -0.000871 0.500000 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Ca",
"Ti",
"O"
],
"chemical_system": "Ca-O-Sr-Ti",
"density": 4.509256231804023,
"density_atomic": 0.08501240265491525,
"volume": 235.25979004716015,
"volume_molar": 7.083837854160227,
"formula_full": "Sr2 Ca2 Ti4 O12",
"formula_reduced": "SrCaTi2O6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.1881014396666667,
"spacegroup": 26
},
{
"id": "jvasp-78747",
"created_at": "2022-09-04T14:37:01.560276Z",
"updated_at": "2022-09-04T14:37:01.560302Z",
"structure_string": "Sr1 Ca1 Sn1\n1.0\n4.656906 -0.000000 2.688666\n1.552302 4.390572 2.688666\n-0.000000 -0.000000 5.377330\nSr Ca Sn\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500001 Sn\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"Sn"
],
"chemical_system": "Ca-Sn-Sr",
"density": 3.7215052551442294,
"density_atomic": 0.0272857559332122,
"volume": 109.94747616093723,
"volume_molar": 22.070639254930278,
"formula_full": "Sr1 Ca1 Sn1",
"formula_reduced": "SrCaSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-103052",
"created_at": "2022-09-04T14:36:36.356336Z",
"updated_at": "2022-09-04T14:36:36.356364Z",
"structure_string": "Sr1 Ca1 Si4\n1.0\n3.957243 0.000000 0.000000\n-1.978621 3.427073 0.000000\n-0.000000 0.000000 10.050758\nSr Ca Si\n1 1 4\ndirect\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Ca\n0.666667 0.333333 0.716559 Si\n0.666667 0.333333 0.198727 Si\n0.333333 0.666666 0.801274 Si\n0.333333 0.666666 0.283441 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"Si"
],
"chemical_system": "Ca-Si-Sr",
"density": 2.9242723934705275,
"density_atomic": 0.04401861351478268,
"volume": 136.30597424394188,
"volume_molar": 13.680896055432543,
"formula_full": "Sr1 Ca1 Si4",
"formula_reduced": "SrCaSi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0636635216666663,
"spacegroup": 164
},
{
"id": "jvasp-110168",
"created_at": "2022-09-04T14:38:14.323620Z",
"updated_at": "2022-09-04T14:38:14.323643Z",
"structure_string": "Sr1 Ca1 Si4\n1.0\n4.180989 -0.009893 -6.239380\n-0.394754 4.162323 -6.239380\n0.009020 0.009893 7.510689\nSr Ca Si\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250001 0.749999 0.500000 Ca\n0.666254 0.166251 0.500000 Si\n0.586114 0.586113 0.000001 Si\n0.833750 0.333747 0.500001 Si\n0.413888 0.413887 0.000000 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"Si"
],
"chemical_system": "Ca-Si-Sr",
"density": 3.0382250645482363,
"density_atomic": 0.04573392519311569,
"volume": 131.1936374292049,
"volume_molar": 13.167775856917938,
"formula_full": "Sr1 Ca1 Si4",
"formula_reduced": "SrCaSi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0652368549999998,
"spacegroup": 119
},
{
"id": "jvasp-103685",
"created_at": "2022-09-04T14:36:44.171574Z",
"updated_at": "2022-09-04T14:36:44.171605Z",
"structure_string": "Sr1 Ca2 Si6\n1.0\n6.359369 0.007750 0.281636\n5.144315 3.738671 0.281636\n-0.047434 -0.015448 8.424188\nSr Ca Si\n1 2 6\ndirect\n0.500000 0.500000 0.000001 Sr\n0.170521 0.170520 0.667751 Ca\n0.829479 0.829479 0.332250 Ca\n0.918639 0.918638 0.742213 Si\n0.586961 0.586961 0.425118 Si\n0.247379 0.247379 0.085791 Si\n0.413039 0.413038 0.574883 Si\n0.081361 0.081361 0.257788 Si\n0.752621 0.752620 0.914211 Si\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"Si"
],
"chemical_system": "Ca-Si-Sr",
"density": 2.7919753409204295,
"density_atomic": 0.04499790851486083,
"volume": 200.00929592155813,
"volume_molar": 13.3831570372013,
"formula_full": "Sr1 Ca2 Si6",
"formula_reduced": "Sr(CaSi3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.235633194444444,
"spacegroup": 12
}
]
}