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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4522",
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"results": [
{
"id": "jvasp-101119",
"created_at": "2022-09-04T14:37:02.642431Z",
"updated_at": "2022-09-04T14:37:02.642459Z",
"structure_string": "Sn3 Sb1\n1.0\n4.535211 0.000969 0.000000\n-3.410298 2.989650 0.000000\n0.000000 0.000000 8.546535\nSn Sb\n3 1\ndirect\n0.000000 0.000000 0.500000 Sn\n-0.000000 0.500000 0.748299 Sn\n0.500000 0.000000 0.251702 Sn\n0.500000 0.500000 -0.000000 Sb\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Sb-Sn",
"density": 6.846416001750316,
"density_atomic": 0.03451010138592985,
"volume": 115.9080918154255,
"volume_molar": 17.450371103387404,
"formula_full": "Sn3 Sb1",
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"spacegroup": 21
},
{
"id": "jvasp-122607",
"created_at": "2022-09-04T14:38:54.923601Z",
"updated_at": "2022-09-04T14:38:54.923626Z",
"structure_string": "Sn7 Sb1\n1.0\n6.702819 -0.000000 -0.000000\n0.000000 6.702819 -0.000000\n0.000000 -0.000000 6.702819\nSn Sb\n7 1\ndirect\n0.253392 0.253392 0.753393 Sn\n0.000000 0.500000 0.000000 Sn\n0.253392 0.746608 0.246608 Sn\n0.500000 0.000000 0.000000 Sn\n0.746608 0.253392 0.246608 Sn\n0.500000 0.500000 0.500000 Sn\n0.746608 0.746608 0.753393 Sn\n0.000000 0.000000 0.500000 Sb\n",
"nsites": 8,
"nelements": 2,
"elements": [
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],
"chemical_system": "Sb-Sn",
"density": 5.25347248517618,
"density_atomic": 0.02656547042326879,
"volume": 301.14279448229803,
"volume_molar": 22.669053715401876,
"formula_full": "Sn7 Sb1",
"formula_reduced": "Sn7Sb",
"formula_anonymous": "AB7",
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"spacegroup": 215
},
{
"id": "jvasp-107525",
"created_at": "2022-09-04T14:36:55.458663Z",
"updated_at": "2022-09-04T14:36:55.458685Z",
"structure_string": "Sn1 Sb1\n1.0\n4.105312 -0.092418 1.420612\n0.982207 3.987154 1.420612\n-0.120721 -0.092418 4.342482\nSn Sb\n1 1\ndirect\n0.347405 0.347404 0.347405 Sn\n0.652596 0.652594 0.652595 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn",
"density": 5.501361611339383,
"density_atomic": 0.027554351067987846,
"volume": 72.58381789014673,
"volume_molar": 21.85549841163349,
"formula_full": "Sn1 Sb1",
"formula_reduced": "SnSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.7350539000000003,
"spacegroup": 160
},
{
"id": "jvasp-19782",
"created_at": "2022-09-04T14:38:30.819649Z",
"updated_at": "2022-09-04T14:38:30.819663Z",
"structure_string": "Sn1 Sb1\n1.0\n3.825081 -0.000000 -0.000000\n-0.000000 3.825081 -0.000000\n0.000000 0.000000 3.825081\nSn Sb\n1 1\ndirect\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn",
"density": 7.134903312163997,
"density_atomic": 0.035736176712014324,
"volume": 55.965695942163,
"volume_molar": 16.851664934753323,
"formula_full": "Sn1 Sb1",
"formula_reduced": "SnSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.7430789000000002,
"spacegroup": 221
},
{
"id": "jvasp-104694",
"created_at": "2022-09-04T14:36:53.865936Z",
"updated_at": "2022-09-04T14:36:53.865950Z",
"structure_string": "Sn1 Sb1\n1.0\n3.104069 0.000000 0.000000\n0.000000 3.104069 0.000000\n0.000000 0.000000 6.218092\nSn Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Sn\n0.000000 0.000000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn",
"density": 6.66484608283656,
"density_atomic": 0.033381828309932006,
"volume": 59.91283585282072,
"volume_molar": 18.040176541823055,
"formula_full": "Sn1 Sb1",
"formula_reduced": "SnSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.6876689000000002,
"spacegroup": 123
},
{
"id": "jvasp-3909",
"created_at": "2022-09-04T14:36:12.956463Z",
"updated_at": "2022-09-04T14:36:12.956491Z",
"structure_string": "Sn1 Sb2 Te4\n1.0\n4.308681 -0.022652 13.490596\n2.083199 3.771674 13.490596\n-0.038622 -0.022652 14.161900\nSn Sb Te\n1 2 4\ndirect\n0.000000 0.000000 0.000000 Sn\n0.426715 0.426715 0.426715 Sb\n0.573286 0.573285 0.573285 Sb\n0.133467 0.133467 0.133467 Te\n0.866534 0.866533 0.866533 Te\n0.287668 0.287668 0.287667 Te\n0.712333 0.712333 0.712333 Te\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Sn",
"Sb",
"Te"
],
"chemical_system": "Sb-Sn-Te",
"density": 6.20653257200611,
"density_atomic": 0.029982499977245263,
"volume": 233.46952406612317,
"volume_molar": 20.08551910137716,
"formula_full": "Sn1 Sb2 Te4",
"formula_reduced": "Sn(SbTe2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.1616678523809525,
"spacegroup": 166
},
{
"id": "jvasp-97947",
"created_at": "2022-09-04T14:36:17.493829Z",
"updated_at": "2022-09-04T14:36:17.493855Z",
"structure_string": "Ti4 Sn4 Sb4\n1.0\n5.304585 0.000000 1.520439\n2.652292 4.919770 0.760219\n-0.047460 -0.000000 10.179251\nTi Sn Sb\n4 4 4\ndirect\n0.001441 0.250000 0.997118 Ti\n0.748558 0.250000 0.502882 Ti\n0.998558 0.750000 0.002882 Ti\n0.251440 0.750000 0.497119 Ti\n0.707741 0.584517 0.250000 Sn\n0.042258 0.915483 0.250000 Sn\n0.292258 0.415483 0.750000 Sn\n0.957741 0.084517 0.750000 Sn\n0.452539 0.250000 0.094921 Sb\n0.297460 0.250000 0.405080 Sb\n0.547459 0.750000 0.905080 Sb\n0.702539 0.750000 0.594921 Sb\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ti",
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn-Ti",
"density": 7.199750287256562,
"density_atomic": 0.045111702294564716,
"volume": 266.0063661895069,
"volume_molar": 13.349398168744294,
"formula_full": "Ti4 Sn4 Sb4",
"formula_reduced": "TiSnSb",
"formula_anonymous": "ABC",
"energy_above_hull": 1.6235587111111114,
"spacegroup": 70
},
{
"id": "jvasp-96861",
"created_at": "2022-09-04T14:36:13.991546Z",
"updated_at": "2022-09-04T14:36:13.991561Z",
"structure_string": "Ti4 Sn4 Sb4\n1.0\n5.301662 0.000000 1.519601\n2.650831 4.923355 0.759801\n-0.049231 -0.000000 10.179916\nTi Sn Sb\n4 4 4\ndirect\n0.001425 0.250000 0.997152 Ti\n0.748576 0.250000 0.502848 Ti\n0.998576 0.749999 0.002848 Ti\n0.251424 0.749999 0.497152 Ti\n0.707814 0.584372 0.250000 Sn\n0.042187 0.915627 0.250000 Sn\n0.292186 0.415627 0.750000 Sn\n0.957814 0.084372 0.750000 Sn\n0.452514 0.250000 0.094972 Sb\n0.297486 0.250000 0.405028 Sb\n0.547486 0.749999 0.905028 Sb\n0.702514 0.749999 0.594972 Sb\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ti",
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn-Ti",
"density": 7.197646259828197,
"density_atomic": 0.04509851902359266,
"volume": 266.0841255945094,
"volume_molar": 13.353300486097117,
"formula_full": "Ti4 Sn4 Sb4",
"formula_reduced": "TiSnSb",
"formula_anonymous": "ABC",
"energy_above_hull": 1.6260220444444444,
"spacegroup": 70
},
{
"id": "jvasp-101076",
"created_at": "2022-09-04T14:36:42.641766Z",
"updated_at": "2022-09-04T14:36:42.641786Z",
"structure_string": "Zn1 Sn1 Sb2\n1.0\n4.531193 -0.000000 0.000000\n0.000000 4.531193 0.000000\n-0.000000 -0.000000 6.329934\nZn Sn Sb\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Sn\n-0.000000 0.500000 0.221722 Sb\n0.500000 0.000000 0.778277 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn-Zn",
"density": 5.463891912233241,
"density_atomic": 0.030777666400178823,
"volume": 129.96436922770596,
"volume_molar": 19.566593131846442,
"formula_full": "Zn1 Sn1 Sb2",
"formula_reduced": "ZnSnSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.502093575,
"spacegroup": 115
},
{
"id": "jvasp-8066",
"created_at": "2022-09-04T14:36:42.079936Z",
"updated_at": "2022-09-04T14:36:42.079963Z",
"structure_string": "Zn2 Sn2 Sb4\n1.0\n5.817835 -0.000000 -2.601815\n-1.163567 5.700291 -2.601815\n0.011545 0.014140 7.831260\nZn Sn Sb\n2 2 4\ndirect\n0.250000 0.750000 0.499999 Zn\n0.000000 0.000000 0.000000 Zn\n0.750000 0.250000 0.499999 Sn\n0.499999 0.500000 -0.000001 Sn\n0.901843 0.875000 0.249999 Sb\n0.625000 0.098156 0.750000 Sb\n0.125000 0.651844 0.750000 Sb\n0.348155 0.375000 0.249999 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zn",
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn-Zn",
"density": 5.459477641122463,
"density_atomic": 0.03075280116385464,
"volume": 260.13890433508914,
"volume_molar": 19.582413738226016,
"formula_full": "Zn2 Sn2 Sb4",
"formula_reduced": "ZnSnSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.501006075,
"spacegroup": 122
},
{
"id": "jvasp-103667",
"created_at": "2022-09-04T14:37:05.186762Z",
"updated_at": "2022-09-04T14:37:05.186784Z",
"structure_string": "Zr3 Sn4 Sb2\n1.0\n5.604049 -0.008015 0.022282\n-2.805161 4.851443 0.022282\n-0.002435 -0.004213 7.678034\nZr Sn Sb\n3 4 2\ndirect\n0.504841 0.010070 0.162651 Zr\n0.989930 0.495158 0.837348 Zr\n0.505620 0.494380 0.499999 Zr\n0.835515 0.164484 0.499999 Sn\n0.169814 0.343024 0.169701 Sn\n0.656977 0.830186 0.830298 Sn\n0.174853 0.825147 0.499999 Sn\n0.834523 0.672070 0.167326 Sb\n0.327929 0.165477 0.832673 Sb\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Zr",
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn-Zr",
"density": 7.897852055290283,
"density_atomic": 0.04314959508921569,
"volume": 208.57669652268316,
"volume_molar": 13.956424730171118,
"formula_full": "Zr3 Sn4 Sb2",
"formula_reduced": "Zr3(Sn2Sb)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.2931547222222224,
"spacegroup": 5
},
{
"id": "jvasp-16283",
"created_at": "2022-09-04T14:37:55.800445Z",
"updated_at": "2022-09-04T14:37:55.800467Z",
"structure_string": "Sr2 Sb4\n1.0\n0.000000 4.883211 0.056643\n4.392714 0.000000 0.000000\n0.000000 -1.947296 -8.980219\nSr Sb\n2 4\ndirect\n0.412866 0.749999 0.289364 Sr\n0.587133 0.250000 0.710636 Sr\n0.805971 0.749999 0.018351 Sb\n0.194029 0.250000 0.981650 Sb\n0.047002 0.749999 0.613627 Sb\n0.952998 0.250000 0.386374 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
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"Sb"
],
"chemical_system": "Sb-Sr",
"density": 5.72346640780316,
"density_atomic": 0.031226236958537264,
"volume": 192.1461112322597,
"volume_molar": 19.285515472121414,
"formula_full": "Sr2 Sb4",
"formula_reduced": "SrSb2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6280597166666667,
"spacegroup": 11
}
]
}