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=chemical_system&page=4392",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4390",
"results": [
{
"id": "jvasp-155",
"created_at": "2022-09-04T14:36:58.147946Z",
"updated_at": "2022-09-04T14:36:58.147971Z",
"structure_string": "Pd4 S8\n1.0\n5.532249 0.000000 0.000000\n0.000000 5.612249 0.000000\n0.000000 0.000000 7.553893\nPd S\n4 8\ndirect\n0.500000 0.000000 0.500000 Pd\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.000000 0.000000 0.000000 Pd\n0.604570 0.109947 0.082911 S\n0.104570 0.390053 0.917088 S\n0.395431 0.609948 0.417089 S\n0.895431 0.890053 0.582911 S\n0.104570 0.109947 0.417089 S\n0.604570 0.390053 0.582911 S\n0.895431 0.609948 0.082911 S\n0.395431 0.890053 0.917088 S\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Pd",
"S"
],
"chemical_system": "Pd-S",
"density": 4.8300467414818895,
"density_atomic": 0.0511648572816802,
"volume": 234.53598109217538,
"volume_molar": 11.770072428514823,
"formula_full": "Pd4 S8",
"formula_reduced": "PdS2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5107585666666663,
"spacegroup": 61
},
{
"id": "jvasp-20302",
"created_at": "2022-09-04T14:38:29.441036Z",
"updated_at": "2022-09-04T14:38:29.441060Z",
"structure_string": "Pd16 S7\n1.0\n7.387873 0.000000 -2.612007\n-3.693937 6.398085 -2.612007\n-0.000000 -0.000000 7.836023\nPd S\n16 7\ndirect\n0.752359 0.752359 0.337499 Pd\n0.247641 0.585141 -0.000000 Pd\n-0.000000 0.247641 0.585140 Pd\n0.337499 0.752359 0.752358 Pd\n0.752359 0.337500 0.752358 Pd\n0.247641 0.000000 0.585140 Pd\n0.000000 0.000000 0.232233 Pd\n-0.000000 0.232233 -0.000000 Pd\n0.232233 -0.000000 -0.000000 Pd\n0.767766 0.767767 0.767766 Pd\n0.585140 0.247641 -0.000000 Pd\n0.414859 0.414860 0.662500 Pd\n0.662500 0.414860 0.414859 Pd\n-0.000000 0.585141 0.247641 Pd\n0.585140 -0.000000 0.247641 Pd\n0.414859 0.662501 0.414859 Pd\n0.312084 0.312085 0.312084 S\n0.687915 -0.000000 -0.000000 S\n-0.000000 0.687916 -0.000000 S\n0.000000 0.000000 0.687915 S\n-0.000000 0.500000 0.500000 S\n0.500000 -0.000000 0.500000 S\n0.500000 0.500000 -0.000000 S\n",
"nsites": 23,
"nelements": 2,
"elements": [
"Pd",
"S"
],
"chemical_system": "Pd-S",
"density": 8.639828502364846,
"density_atomic": 0.06209586873190436,
"volume": 370.39501128974115,
"volume_molar": 9.69813432516787,
"formula_full": "Pd16 S7",
"formula_reduced": "Pd16S7",
"formula_anonymous": "A7B16",
"energy_above_hull": 2.1966087478260867,
"spacegroup": 217
},
{
"id": "jvasp-25034",
"created_at": "2022-09-04T14:38:30.631779Z",
"updated_at": "2022-09-04T14:38:30.631794Z",
"structure_string": "Pd6 S2\n1.0\n4.597477 0.008992 0.000000\n-1.443637 4.364949 0.000000\n0.000000 0.000000 6.398531\nPd S\n6 2\ndirect\n0.147284 0.538491 0.750000 Pd\n0.535748 0.150039 0.750000 Pd\n0.998629 0.001371 0.000000 Pd\n0.998629 0.001371 0.500000 Pd\n0.461509 0.852716 0.250000 Pd\n0.849961 0.464252 0.250000 Pd\n0.309422 0.312183 0.250000 S\n0.687818 0.690578 0.750000 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pd",
"S"
],
"chemical_system": "Pd-S",
"density": 9.080887394316456,
"density_atomic": 0.06226301246217237,
"volume": 128.48719783451477,
"volume_molar": 9.67209989021769,
"formula_full": "Pd6 S2",
"formula_reduced": "Pd3S",
"formula_anonymous": "AB3",
"energy_above_hull": 1.666936775,
"spacegroup": 63
},
{
"id": "jvasp-87013",
"created_at": "2022-09-04T14:36:04.902234Z",
"updated_at": "2022-09-04T14:36:04.902257Z",
"structure_string": "Pd8 S2\n1.0\n5.192164 0.000000 0.000000\n0.000000 5.192164 0.000000\n-0.000000 0.000000 5.646508\nPd S\n8 2\ndirect\n0.768248 0.355014 0.843343 Pd\n0.855013 0.268249 0.343343 Pd\n0.144986 0.731751 0.343343 Pd\n0.644985 0.768248 0.156658 Pd\n0.268249 0.144986 0.656658 Pd\n0.731751 0.855013 0.656658 Pd\n0.231751 0.644985 0.843343 Pd\n0.355014 0.231751 0.156658 Pd\n0.500000 0.500000 0.500000 S\n0.000000 0.000000 0.000000 S\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Pd",
"S"
],
"chemical_system": "Pd-S",
"density": 9.986790769163985,
"density_atomic": 0.0656936283010824,
"volume": 152.22176425038828,
"volume_molar": 9.167008910513742,
"formula_full": "Pd8 S2",
"formula_reduced": "Pd4S",
"formula_anonymous": "AB4",
"energy_above_hull": 1.78791656,
"spacegroup": 114
},
{
"id": "jvasp-39231",
"created_at": "2022-09-04T14:37:52.691742Z",
"updated_at": "2022-09-04T14:37:52.691760Z",
"structure_string": "Sb1 Pd3\n1.0\n0.000000 3.225220 3.225220\n3.225220 -0.000000 3.225220\n3.225220 3.225220 -0.000000\nSb Pd\n1 3\ndirect\n0.750001 0.750001 0.750001 Sb\n0.000000 0.000000 0.000000 Pd\n0.499999 0.499999 0.499999 Pd\n0.250001 0.250001 0.250001 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb",
"density": 10.914387128741113,
"density_atomic": 0.05961450784193497,
"volume": 67.0977610115613,
"volume_molar": 10.101804037311554,
"formula_full": "Sb1 Pd3",
"formula_reduced": "SbPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5689958000000004,
"spacegroup": 225
},
{
"id": "jvasp-20142",
"created_at": "2022-09-04T14:38:08.415453Z",
"updated_at": "2022-09-04T14:38:08.415481Z",
"structure_string": "Sb8 Pd4\n1.0\n6.577213 -0.000000 -0.000000\n-0.000000 6.577213 0.000000\n0.000000 -0.000000 6.577213\nSb Pd\n8 4\ndirect\n0.373345 0.373345 0.373345 Sb\n0.126655 0.626655 0.873344 Sb\n0.873344 0.126655 0.626655 Sb\n0.626655 0.873344 0.126655 Sb\n0.626655 0.626655 0.626655 Sb\n0.873344 0.373345 0.126655 Sb\n0.126655 0.873344 0.373345 Sb\n0.373345 0.126655 0.873344 Sb\n0.000000 0.000000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb",
"density": 8.16915162132807,
"density_atomic": 0.04217504226760661,
"volume": 284.52846410581645,
"volume_molar": 14.278920508931952,
"formula_full": "Sb8 Pd4",
"formula_reduced": "Sb2Pd",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3412159666666668,
"spacegroup": 205
},
{
"id": "jvasp-19968",
"created_at": "2022-09-04T14:38:17.167643Z",
"updated_at": "2022-09-04T14:38:17.167660Z",
"structure_string": "Sb2 Pd2\n1.0\n2.071075 -3.587208 -0.000000\n2.071075 3.587208 -0.000000\n-0.000000 0.000000 5.711446\nSb Pd\n2 2\ndirect\n0.333334 0.666668 0.750001 Sb\n0.666668 0.333334 0.250000 Sb\n0.000000 0.000000 0.000000 Pd\n0.000000 0.000000 0.500000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb",
"density": 8.929522017734874,
"density_atomic": 0.047133700174337864,
"volume": 84.86496891194247,
"volume_molar": 12.776719709518542,
"formula_full": "Sb2 Pd2",
"formula_reduced": "SbPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.8934909000000002,
"spacegroup": 194
},
{
"id": "jvasp-102979",
"created_at": "2022-09-04T14:36:54.802977Z",
"updated_at": "2022-09-04T14:36:54.802999Z",
"structure_string": "Sb2 Pd6\n1.0\n5.753698 0.000000 0.000000\n-2.876848 4.982849 0.000000\n0.000000 0.000000 4.673262\nSb Pd\n2 6\ndirect\n0.333333 0.666667 0.750000 Sb\n0.666667 0.333333 0.250000 Sb\n0.166587 0.333173 0.250000 Pd\n0.666827 0.833414 0.250000 Pd\n0.166587 0.833414 0.250000 Pd\n0.833414 0.666827 0.750000 Pd\n0.333173 0.166587 0.750000 Pd\n0.833414 0.166587 0.750000 Pd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb",
"density": 10.931819664013938,
"density_atomic": 0.059709724549796665,
"volume": 133.98152579531944,
"volume_molar": 10.085695094737309,
"formula_full": "Sb2 Pd6",
"formula_reduced": "SbPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5708108000000005,
"spacegroup": 194
},
{
"id": "jvasp-22652",
"created_at": "2022-09-04T14:36:42.996273Z",
"updated_at": "2022-09-04T14:36:42.996292Z",
"structure_string": "Sc1 Sb1 Pd1\n1.0\n3.899830 0.000000 2.251568\n1.299943 3.676795 2.251568\n0.000000 0.000000 4.503137\nSc Sb Pd\n1 1 1\ndirect\n0.499999 0.500001 0.500001 Sc\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sc",
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb-Sc",
"density": 7.024212643833773,
"density_atomic": 0.04646126205911397,
"volume": 64.56992055409549,
"volume_molar": 12.961638347959342,
"formula_full": "Sc1 Sb1 Pd1",
"formula_reduced": "ScSbPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3948190166666663,
"spacegroup": 216
},
{
"id": "jvasp-20990",
"created_at": "2022-09-04T14:38:39.043120Z",
"updated_at": "2022-09-04T14:38:39.043145Z",
"structure_string": "Sb4 Pd4 Se4\n1.0\n6.429814 -0.000000 -0.000000\n0.000000 6.429814 -0.000000\n0.000000 -0.000000 6.429814\nSb Pd Se\n4 4 4\ndirect\n0.873400 0.626600 0.373400 Sb\n0.373400 0.873400 0.626600 Sb\n0.126600 0.126600 0.126600 Sb\n0.626600 0.373400 0.873400 Sb\n0.747131 0.247132 0.252868 Pd\n0.247132 0.252868 0.747131 Pd\n0.252868 0.747131 0.247132 Pd\n0.752868 0.752868 0.752868 Pd\n0.367962 0.367962 0.367962 Se\n0.132037 0.632037 0.867962 Se\n0.867962 0.132037 0.632037 Se\n0.632037 0.867962 0.132037 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sb",
"Pd",
"Se"
],
"chemical_system": "Pd-Sb-Se",
"density": 7.674502623420389,
"density_atomic": 0.04514254256417116,
"volume": 265.8246372131504,
"volume_molar": 13.340278189779383,
"formula_full": "Sb4 Pd4 Se4",
"formula_reduced": "SbPdSe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2447817222222226,
"spacegroup": 198
},
{
"id": "jvasp-104660",
"created_at": "2022-09-04T14:36:59.028832Z",
"updated_at": "2022-09-04T14:36:59.028849Z",
"structure_string": "Sm2 Sb2 Pd2\n1.0\n4.640882 -0.000000 0.000000\n-2.320440 4.019122 0.000000\n-0.000000 -0.000000 7.566088\nSm Sb Pd\n2 2 2\ndirect\n0.000000 0.000000 0.985004 Sm\n0.000000 0.000000 0.485004 Sm\n0.666666 0.333333 0.712511 Sb\n0.333333 0.666666 0.212511 Sb\n0.666666 0.333333 0.311486 Pd\n0.333333 0.666666 0.811486 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb-Sm",
"density": 8.908155045288245,
"density_atomic": 0.04251558377965522,
"volume": 141.1247233742831,
"volume_molar": 14.164549147933249,
"formula_full": "Sm2 Sb2 Pd2",
"formula_reduced": "SmSbPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0606102250000002,
"spacegroup": 186
},
{
"id": "jvasp-35065",
"created_at": "2022-09-04T14:37:41.209392Z",
"updated_at": "2022-09-04T14:37:41.209422Z",
"structure_string": "Sm2 Sb2 Pd2\n1.0\n2.296088 -3.976941 -0.000000\n2.296088 3.976941 0.000000\n0.000000 -0.000000 7.816053\nSm Sb Pd\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Sm\n0.000000 0.000000 0.000000 Sm\n0.333334 0.666667 0.250000 Sb\n0.666667 0.333334 0.750000 Sb\n0.333334 0.666667 0.750000 Pd\n0.666667 0.333334 0.250000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb-Sm",
"density": 8.80715627820369,
"density_atomic": 0.04203355113408553,
"volume": 142.74311444351238,
"volume_molar": 14.326985461660346,
"formula_full": "Sm2 Sb2 Pd2",
"formula_reduced": "SmSbPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0752235583333336,
"spacegroup": 194
}
]
}