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=-nelements&page=4627",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4625",
"results": [
{
"id": "jvasp-16081",
"created_at": "2022-09-04T14:35:55.439033Z",
"updated_at": "2022-09-04T14:35:55.439054Z",
"structure_string": "Zr1\n1.0\n2.766957 0.000000 1.597503\n0.922319 2.608713 1.597503\n0.000000 0.000000 3.195007\nZr\n1\ndirect\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Zr"
],
"chemical_system": "Zr",
"density": 6.568371111441703,
"density_atomic": 0.043361018384075654,
"volume": 23.06218897218637,
"volume_molar": 13.888374822422604,
"formula_full": "Zr1",
"formula_reduced": "Zr",
"formula_anonymous": "A",
"energy_above_hull": 0.0351945000000002,
"spacegroup": 225
},
{
"id": "jvasp-25043",
"created_at": "2022-09-04T14:38:14.822295Z",
"updated_at": "2022-09-04T14:38:14.822317Z",
"structure_string": "Se3\n1.0\n4.236454 -0.000000 -0.000000\n-2.118227 3.668877 0.000000\n-0.000000 0.000000 5.131578\nSe\n3\ndirect\n0.237168 0.000000 0.333333 Se\n-0.000000 0.237168 0.666667 Se\n0.762831 0.762833 0.000000 Se\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 4.9316348165232196,
"density_atomic": 0.037612714098635945,
"volume": 79.76026383346787,
"volume_molar": 16.010917861996028,
"formula_full": "Se3",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy_above_hull": 3.3666666665599365e-06,
"spacegroup": 152
},
{
"id": "jvasp-26",
"created_at": "2022-09-04T14:35:53.904287Z",
"updated_at": "2022-09-04T14:35:53.904312Z",
"structure_string": "P4\n1.0\n1.670562 5.358323 -0.000000\n-1.670562 5.358323 -0.000000\n0.000000 0.000000 4.469533\nP\n4\ndirect\n0.100703 0.100703 0.082184 P\n0.600704 0.600704 0.417819 P\n0.399297 0.399297 0.582182 P\n0.899297 0.899297 0.917816 P\n",
"nsites": 4,
"nelements": 1,
"elements": [
"P"
],
"chemical_system": "P",
"density": 2.5711026394391028,
"density_atomic": 0.04998921993544273,
"volume": 80.0172518228069,
"volume_molar": 12.046878842632744,
"formula_full": "P4",
"formula_reduced": "P",
"formula_anonymous": "A",
"energy_above_hull": 0.0002399999999997,
"spacegroup": 64
},
{
"id": "jvasp-14813",
"created_at": "2022-09-04T14:35:54.566533Z",
"updated_at": "2022-09-04T14:35:54.566556Z",
"structure_string": "Rb1\n1.0\n4.528428 0.000000 -1.601041\n-2.264214 3.921735 -1.601041\n-0.000000 -0.000000 4.803124\nRb\n1\ndirect\n0.000000 0.000000 0.000000 Rb\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.663803802865864,
"density_atomic": 0.011723316502055867,
"volume": 85.30009403265998,
"volume_molar": 51.36891731059145,
"formula_full": "Rb1",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy_above_hull": 0.0310099999999999,
"spacegroup": 229
},
{
"id": "jvasp-96161",
"created_at": "2022-09-04T14:36:02.114087Z",
"updated_at": "2022-09-04T14:36:02.114122Z",
"structure_string": "C60\n1.0\n8.637989 -0.000000 4.987144\n2.879329 8.143973 4.987144\n-0.000000 -0.000000 9.974290\nC\n60\ndirect\n0.704306 0.398485 0.927644 C\n0.197122 0.969178 0.601058 C\n0.197545 0.802455 0.703198 C\n0.197122 0.232642 0.969178 C\n0.295694 0.601515 0.072355 C\n0.703198 0.197545 0.802454 C\n0.767358 0.398942 0.030821 C\n0.969179 0.197122 0.232641 C\n0.802878 0.398942 0.767358 C\n0.927645 0.969564 0.704305 C\n0.802878 0.030822 0.398942 C\n0.802455 0.197545 0.296801 C\n0.969179 0.601058 0.197121 C\n0.030822 0.398942 0.802878 C\n0.197545 0.296802 0.802455 C\n0.704307 0.969564 0.398485 C\n0.927645 0.398485 0.969563 C\n0.232642 0.969178 0.197121 C\n0.802455 0.703198 0.197544 C\n0.197545 0.703198 0.296802 C\n0.072355 0.030436 0.295694 C\n0.601515 0.072355 0.295693 C\n0.802878 0.767358 0.030821 C\n0.030822 0.767358 0.398942 C\n0.969564 0.704306 0.927644 C\n0.232642 0.197122 0.601058 C\n0.296802 0.802455 0.197545 C\n0.197122 0.601058 0.232641 C\n0.030822 0.802878 0.767358 C\n0.295694 0.072355 0.030436 C\n0.398942 0.767358 0.802878 C\n0.030436 0.072355 0.601515 C\n0.767359 0.802878 0.398941 C\n0.398485 0.927644 0.704306 C\n0.030436 0.295694 0.072355 C\n0.601058 0.969178 0.232641 C\n0.927645 0.704306 0.398484 C\n0.601058 0.232642 0.197122 C\n0.703198 0.296802 0.197545 C\n0.601058 0.197122 0.969178 C\n0.030436 0.601515 0.295693 C\n0.398942 0.802878 0.030821 C\n0.703198 0.802455 0.296801 C\n0.072356 0.601515 0.030436 C\n0.704307 0.927644 0.969563 C\n0.072356 0.295694 0.601515 C\n0.232642 0.601058 0.969178 C\n0.398485 0.969564 0.927644 C\n0.601515 0.030436 0.072355 C\n0.601515 0.295694 0.030436 C\n0.767358 0.030822 0.802878 C\n0.295694 0.030436 0.601515 C\n0.296802 0.197545 0.703198 C\n0.969179 0.232642 0.601057 C\n0.398942 0.030822 0.767358 C\n0.969564 0.398485 0.704306 C\n0.969564 0.927644 0.398484 C\n0.296802 0.703198 0.802455 C\n0.398485 0.704306 0.969563 C\n0.802455 0.296802 0.703198 C\n",
"nsites": 60,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 1.7054449459814844,
"density_atomic": 0.0855106657120762,
"volume": 701.6668564132875,
"volume_molar": 7.042560959912544,
"formula_full": "C60",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.4149700000000003,
"spacegroup": 202
},
{
"id": "jvasp-14846",
"created_at": "2022-09-04T14:35:54.732607Z",
"updated_at": "2022-09-04T14:35:54.732630Z",
"structure_string": "Ca1\n1.0\n-0.000000 -0.000000 -4.300413\n-2.166170 -2.166170 -2.150206\n-2.166170 2.166170 -2.150206\nCa\n1\ndirect\n0.000000 0.000000 0.000000 Ca\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ca"
],
"chemical_system": "Ca",
"density": 1.649035112184018,
"density_atomic": 0.02477848587051847,
"volume": 40.35759106611932,
"volume_molar": 24.3039094134689,
"formula_full": "Ca1",
"formula_reduced": "Ca",
"formula_anonymous": "A",
"energy_above_hull": 0.01449042,
"spacegroup": 229
},
{
"id": "jvasp-14816",
"created_at": "2022-09-04T14:36:01.922628Z",
"updated_at": "2022-09-04T14:36:01.922653Z",
"structure_string": "Ti1\n1.0\n2.640006 -0.000000 -0.933383\n-1.320002 2.286312 -0.933383\n-0.000000 -0.000000 2.800149\nTi\n1\ndirect\n0.000000 0.000000 0.000000 Ti\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ti"
],
"chemical_system": "Ti",
"density": 4.702878468439625,
"density_atomic": 0.059166850071873965,
"volume": 16.901356059773885,
"volume_molar": 10.17823452268373,
"formula_full": "Ti1",
"formula_reduced": "Ti",
"formula_anonymous": "A",
"energy_above_hull": 0.1126400000000007,
"spacegroup": 229
},
{
"id": "jvasp-21215",
"created_at": "2022-09-04T14:36:05.833182Z",
"updated_at": "2022-09-04T14:36:05.833203Z",
"structure_string": "S9\n1.0\n7.542814 -0.000000 -0.000000\n-3.771407 6.532269 0.000000\n0.000000 -0.000000 4.396737\nS\n9\ndirect\n0.886011 0.886011 0.500000 S\n0.313228 0.545210 0.262793 S\n0.545209 0.313229 0.737208 S\n-0.000000 0.113989 0.833334 S\n0.454790 0.768019 0.929459 S\n0.231981 0.686772 0.596126 S\n0.768018 0.454790 0.070541 S\n0.686771 0.231981 0.403874 S\n0.113989 0.000000 0.166667 S\n",
"nsites": 9,
"nelements": 1,
"elements": [
"S"
],
"chemical_system": "S",
"density": 2.2120498189298003,
"density_atomic": 0.041544598104884825,
"volume": 216.6346627611684,
"volume_molar": 14.495604807143183,
"formula_full": "S9",
"formula_reduced": "S",
"formula_anonymous": "A",
"energy_above_hull": 0.0173800000000001,
"spacegroup": 154
},
{
"id": "jvasp-21199",
"created_at": "2022-09-04T14:35:53.508452Z",
"updated_at": "2022-09-04T14:35:53.508471Z",
"structure_string": "Th1\n1.0\n3.166958 -0.000000 -1.706713\n-0.919770 3.030453 -1.706713\n-0.107047 -0.144359 3.593006\nTh\n1\ndirect\n0.000000 0.000000 0.000000 Th\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Th"
],
"chemical_system": "Th",
"density": 11.703431558050442,
"density_atomic": 0.030374203370758295,
"volume": 32.9226741453478,
"volume_molar": 19.826497789889714,
"formula_full": "Th1",
"formula_reduced": "Th",
"formula_anonymous": "A",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107978",
"created_at": "2022-09-04T14:35:56.985775Z",
"updated_at": "2022-09-04T14:35:56.985804Z",
"structure_string": "Rh4\n1.0\n2.711851 0.000000 0.000000\n-1.355926 2.348532 0.000000\n-0.000000 -0.000000 8.843839\nRh\n4\ndirect\n0.000000 0.000000 0.000000 Rh\n0.333332 0.666666 0.250000 Rh\n0.000000 0.000000 0.500000 Rh\n0.666666 0.333333 0.750000 Rh\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Rh"
],
"chemical_system": "Rh",
"density": 12.135133046424855,
"density_atomic": 0.07101610640068101,
"volume": 56.325250745676506,
"volume_molar": 8.479964708318972,
"formula_full": "Rh4",
"formula_reduced": "Rh",
"formula_anonymous": "A",
"energy_above_hull": 0.0107530000000002,
"spacegroup": 194
},
{
"id": "jvasp-14625",
"created_at": "2022-09-04T14:35:49.449393Z",
"updated_at": "2022-09-04T14:35:49.449415Z",
"structure_string": "Cr8\n1.0\n4.528916 0.000000 -0.000000\n0.000000 4.528916 0.000000\n-0.000000 0.000000 4.528916\nCr\n8\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.250000 0.000000 0.500000 Cr\n0.750001 0.000000 0.500000 Cr\n0.000000 0.500000 0.250000 Cr\n0.000000 0.500000 0.750001 Cr\n0.500000 0.750001 0.000000 Cr\n0.500000 0.250000 0.000000 Cr\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Cr"
],
"chemical_system": "Cr",
"density": 7.435789001831158,
"density_atomic": 0.08612062836666966,
"volume": 92.89295900093727,
"volume_molar": 6.992680933956915,
"formula_full": "Cr8",
"formula_reduced": "Cr",
"formula_anonymous": "A",
"energy_above_hull": 0.0657000000000005,
"spacegroup": 223
},
{
"id": "jvasp-96736",
"created_at": "2022-09-04T14:35:57.211825Z",
"updated_at": "2022-09-04T14:35:57.211853Z",
"structure_string": "Si2\n1.0\n3.364158 -0.000000 1.942298\n1.121386 3.171759 1.942298\n-0.000000 -0.000000 3.884595\nSi\n2\ndirect\n0.875001 0.875000 0.875001 Si\n0.125000 0.125000 0.125000 Si\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Si"
],
"chemical_system": "Si",
"density": 2.2502923346377885,
"density_atomic": 0.0482511516441613,
"volume": 41.44978786722934,
"volume_molar": 12.480822850429764,
"formula_full": "Si2",
"formula_reduced": "Si",
"formula_anonymous": "A",
"energy_above_hull": 2.9999999999752447e-05,
"spacegroup": 227
}
]
}