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=3819",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=3817",
"results": [
{
"id": "jvasp-108801",
"created_at": "2022-09-04T14:37:57.636861Z",
"updated_at": "2022-09-04T14:37:57.636882Z",
"structure_string": "Ca1 Er1 Al4\n1.0\n4.827999 -0.000000 2.787447\n1.609333 4.551881 2.787447\n-0.000000 -0.000000 5.574893\nCa Er Al\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Er\n0.625315 0.625315 0.124056 Al\n0.625315 0.124055 0.625316 Al\n0.124054 0.625315 0.625316 Al\n0.625315 0.625315 0.625316 Al\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Er",
"Al"
],
"chemical_system": "Al-Ca-Er",
"density": 4.272948972948497,
"density_atomic": 0.04897299254635477,
"volume": 122.51650732433342,
"volume_molar": 12.296860875511781,
"formula_full": "Ca1 Er1 Al4",
"formula_reduced": "CaErAl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.345121936666667,
"spacegroup": 216
},
{
"id": "jvasp-106376",
"created_at": "2022-09-04T14:38:39.157132Z",
"updated_at": "2022-09-04T14:38:39.157150Z",
"structure_string": "Ca1 Dy2 Te4\n1.0\n4.383841 0.000000 0.000000\n0.000000 7.134737 2.311990\n0.000000 0.021414 7.662128\nCa Dy Te\n1 2 4\ndirect\n0.000000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 -0.000000 Dy\n0.500000 0.760130 0.247568 Te\n0.000000 0.252076 0.241497 Te\n0.500000 0.239870 0.752432 Te\n0.000000 0.747924 0.758503 Te\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ca",
"Dy",
"Te"
],
"chemical_system": "Ca-Dy-Te",
"density": 6.07163508957001,
"density_atomic": 0.029235422038894336,
"volume": 239.43557204980016,
"volume_molar": 20.5987816833574,
"formula_full": "Ca1 Dy2 Te4",
"formula_reduced": "Ca(DyTe2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.7652263552380953,
"spacegroup": 10
},
{
"id": "jvasp-13309",
"created_at": "2022-09-04T14:36:52.357683Z",
"updated_at": "2022-09-04T14:36:52.357706Z",
"structure_string": "Ca2 Dy4 S8\n1.0\n7.232104 0.004135 0.000163\n-2.406802 6.819950 -0.000117\n-2.412517 -3.412097 5.902601\nCa Dy S\n2 4 8\ndirect\n0.625000 0.375000 0.250000 Ca\n0.874998 0.124998 0.749999 Ca\n0.122219 0.749999 0.872219 Dy\n0.249999 0.622218 0.372218 Dy\n0.377780 0.249999 0.627781 Dy\n0.750000 0.877781 0.127781 Dy\n0.137633 0.138068 0.144115 S\n0.493952 0.993519 0.355885 S\n0.362366 0.506480 0.000433 S\n0.638067 0.637633 0.644115 S\n0.493516 0.993950 0.855884 S\n0.006480 0.862365 0.500432 S\n0.861932 0.506047 0.999565 S\n0.006046 0.361931 0.499566 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Dy",
"S"
],
"chemical_system": "Ca-Dy-S",
"density": 5.626587382270878,
"density_atomic": 0.048078337485313,
"volume": 291.1914332369901,
"volume_molar": 12.525684278994978,
"formula_full": "Ca2 Dy4 S8",
"formula_reduced": "Ca(DyS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2994747742857142,
"spacegroup": 122
},
{
"id": "jvasp-40088",
"created_at": "2022-09-04T14:37:48.234348Z",
"updated_at": "2022-09-04T14:37:48.234369Z",
"structure_string": "Ca1 Dy1 Rh2\n1.0\n0.000000 3.398538 3.398538\n3.398538 0.000000 3.398538\n3.398538 3.398538 0.000000\nCa Dy Rh\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ca\n0.749999 0.749999 0.749999 Dy\n0.000000 0.000000 0.000000 Rh\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Dy",
"Rh"
],
"chemical_system": "Ca-Dy-Rh",
"density": 8.638070551863931,
"density_atomic": 0.050951104732118016,
"volume": 78.5066392776077,
"volume_molar": 11.819450808107458,
"formula_full": "Ca1 Dy1 Rh2",
"formula_reduced": "CaDyRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.51182823,
"spacegroup": 225
},
{
"id": "jvasp-40100",
"created_at": "2022-09-04T14:37:38.690104Z",
"updated_at": "2022-09-04T14:37:38.690121Z",
"structure_string": "Ca1 Dy1 Hg2\n1.0\n0.000001 3.708294 3.708294\n3.708289 -0.000002 3.708297\n3.708294 3.708300 -0.000007\nCa Dy Hg\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ca\n0.750000 0.749999 0.750000 Dy\n0.000000 0.000000 0.000000 Hg\n0.499999 0.499999 0.499999 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Dy",
"Hg"
],
"chemical_system": "Ca-Dy-Hg",
"density": 9.830120059395115,
"density_atomic": 0.0392199303070665,
"volume": 101.98896246583323,
"volume_molar": 15.354797198390107,
"formula_full": "Ca1 Dy1 Hg2",
"formula_reduced": "CaDyHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-106124",
"created_at": "2022-09-04T14:36:12.619520Z",
"updated_at": "2022-09-04T14:36:12.619544Z",
"structure_string": "Ca1 Dy1 Al4\n1.0\n4.856026 -0.000000 2.803628\n1.618675 4.578306 2.803628\n-0.000000 -0.000000 5.607257\nCa Dy Al\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Dy\n0.625300 0.625300 0.124100 Al\n0.625300 0.124101 0.625300 Al\n0.124101 0.625300 0.625300 Al\n0.625300 0.625300 0.625300 Al\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Dy",
"Al"
],
"chemical_system": "Al-Ca-Dy",
"density": 4.135997154623962,
"density_atomic": 0.048129901072999956,
"volume": 124.66262897361109,
"volume_molar": 12.51226498651234,
"formula_full": "Ca1 Dy1 Al4",
"formula_reduced": "CaDyAl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3530763533333334,
"spacegroup": 216
},
{
"id": "jvasp-109028",
"created_at": "2022-09-04T14:38:15.649966Z",
"updated_at": "2022-09-04T14:38:15.649985Z",
"structure_string": "Ca1 Dy3\n1.0\n4.594303 -0.014342 -4.076666\n-0.937979 4.497557 -4.076666\n0.011697 0.014342 6.142205\nCa Dy\n1 3\ndirect\n0.000000 0.000000 0.000000 Ca\n0.750000 0.250000 0.500000 Dy\n0.250000 0.750000 0.500000 Dy\n0.500000 0.500001 -0.000001 Dy\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Dy"
],
"chemical_system": "Ca-Dy",
"density": 6.877928380295349,
"density_atomic": 0.031403775637082076,
"volume": 127.373219265926,
"volume_molar": 19.17648638684376,
"formula_full": "Ca1 Dy3",
"formula_reduced": "CaDy3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.97357248,
"spacegroup": 139
},
{
"id": "jvasp-21297",
"created_at": "2022-09-04T14:37:07.151659Z",
"updated_at": "2022-09-04T14:37:07.151670Z",
"structure_string": "Ca2 Cu2 Si4 O12\n1.0\n5.136523 0.029170 1.090276\n1.278639 6.573335 0.604477\n0.017132 -0.006285 6.723743\nCa Cu Si O\n2 2 4 12\ndirect\n0.749999 0.297345 0.702655 Ca\n0.250001 0.702655 0.297346 Ca\n0.249999 0.096376 0.903624 Cu\n0.749998 0.903626 0.096377 Cu\n0.280768 0.192310 0.378382 Si\n0.219230 0.621618 0.807689 Si\n0.780768 0.378382 0.192311 Si\n0.719231 0.807690 0.621619 Si\n0.631858 0.976308 0.795557 O\n0.868141 0.204443 0.023693 O\n0.677358 0.606191 0.108792 O\n0.822640 0.891210 0.393810 O\n0.322640 0.393808 0.891209 O\n0.981833 0.628535 0.672883 O\n0.018165 0.371465 0.327118 O\n0.481835 0.672882 0.628536 O\n0.368140 0.023692 0.204444 O\n0.518165 0.327119 0.371464 O\n0.177359 0.108790 0.606190 O\n0.131859 0.795557 0.976308 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Cu",
"Si",
"O"
],
"chemical_system": "Ca-Cu-O-Si",
"density": 3.7479428510220867,
"density_atomic": 0.0882384607812876,
"volume": 226.65853215156406,
"volume_molar": 6.824847925358522,
"formula_full": "Ca2 Cu2 Si4 O12",
"formula_reduced": "CaCu(SiO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.123439907,
"spacegroup": 15
},
{
"id": "jvasp-92769",
"created_at": "2022-09-04T14:36:06.816422Z",
"updated_at": "2022-09-04T14:36:06.816446Z",
"structure_string": "Ca1 Cu2 Si2\n1.0\n4.079473 0.000000 0.000000\n0.000000 4.079473 0.000000\n-2.039737 -2.039737 4.967319\nCa Cu Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.249999 0.749999 0.500000 Cu\n0.749999 0.249999 0.500000 Cu\n0.619574 0.619574 0.239149 Si\n0.380425 0.380425 0.760851 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Cu",
"Si"
],
"chemical_system": "Ca-Cu-Si",
"density": 4.4862903397346825,
"density_atomic": 0.0604839056094649,
"volume": 82.66661931992647,
"volume_molar": 9.956600353958654,
"formula_full": "Ca1 Cu2 Si2",
"formula_reduced": "Ca(CuSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.979881704,
"spacegroup": 139
},
{
"id": "jvasp-15582",
"created_at": "2022-09-04T14:36:46.419106Z",
"updated_at": "2022-09-04T14:36:46.419133Z",
"structure_string": "Ca1 Si2 Cu2\n1.0\n3.814593 -0.000000 -1.446218\n-0.548301 3.774982 -1.446218\n-0.003680 -0.004253 5.744152\nCa Si Cu\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.619576 0.619576 0.239151 Si\n0.380424 0.380425 0.760848 Si\n0.250000 0.750000 0.499999 Cu\n0.750000 0.250000 0.499999 Cu\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Si",
"Cu"
],
"chemical_system": "Ca-Cu-Si",
"density": 4.486162377751931,
"density_atomic": 0.06048218043345081,
"volume": 82.6689772783829,
"volume_molar": 9.95688435311327,
"formula_full": "Ca1 Si2 Cu2",
"formula_reduced": "Ca(CuSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.9798737039999998,
"spacegroup": 139
},
{
"id": "jvasp-15653",
"created_at": "2022-09-04T14:35:58.965771Z",
"updated_at": "2022-09-04T14:35:58.965791Z",
"structure_string": "Ca2 Cu2 Sb2\n1.0\n2.235695 -3.872338 0.000000\n2.235695 3.872338 -0.000000\n-0.000000 0.000000 8.129527\nCa Cu Sb\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.333332 0.666666 0.750000 Cu\n0.666666 0.333332 0.250000 Cu\n0.333332 0.666666 0.250000 Sb\n0.666666 0.333332 0.750000 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Cu",
"Sb"
],
"chemical_system": "Ca-Cu-Sb",
"density": 5.317666396069848,
"density_atomic": 0.04262556645048617,
"volume": 140.76059275293375,
"volume_molar": 14.128001716986715,
"formula_full": "Ca2 Cu2 Sb2",
"formula_reduced": "CaCuSb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-79228",
"created_at": "2022-09-04T14:37:01.908330Z",
"updated_at": "2022-09-04T14:37:01.908351Z",
"structure_string": "Ca1 Cu1 S2\n1.0\n0.000000 0.000000 3.717595\n4.621879 0.000000 -0.000000\n0.000000 4.621879 0.000000\nCa Cu S\n1 1 2\ndirect\n0.499999 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.000000 S\n0.000000 0.000000 0.500000 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Cu",
"S"
],
"chemical_system": "Ca-Cu-S",
"density": 3.507702590568556,
"density_atomic": 0.05036870358243727,
"volume": 79.41439257917953,
"volume_molar": 11.956116262042967,
"formula_full": "Ca1 Cu1 S2",
"formula_reduced": "CaCuS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4482152174999999,
"spacegroup": 123
}
]
}