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=1210",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=1208",
"results": [
{
"id": "jvasp-21229",
"created_at": "2022-09-04T14:37:00.549341Z",
"updated_at": "2022-09-04T14:37:00.549357Z",
"structure_string": "Pr4 Ga4 O12\n1.0\n5.507034 -0.000000 0.000000\n-0.000000 5.572023 0.000000\n0.000000 0.000000 7.817402\nPr Ga O\n4 4 12\ndirect\n0.010066 0.957666 0.750000 Pr\n0.510066 0.542334 0.250000 Pr\n0.489934 0.457666 0.750000 Pr\n0.989933 0.042334 0.250000 Pr\n0.500000 0.000000 0.500000 Ga\n0.000000 0.500000 0.500000 Ga\n0.000000 0.500000 0.000000 Ga\n0.500000 0.000000 0.000000 Ga\n0.579631 0.016852 0.750000 O\n0.079631 0.483148 0.250000 O\n0.713409 0.287397 0.042918 O\n0.213409 0.212603 0.957082 O\n0.786590 0.787396 0.457082 O\n0.213409 0.212603 0.542918 O\n0.286591 0.712603 0.957082 O\n0.786590 0.787396 0.042918 O\n0.420368 0.983147 0.250000 O\n0.713409 0.287397 0.457082 O\n0.286591 0.712603 0.542918 O\n0.920368 0.516852 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Pr",
"Ga",
"O"
],
"chemical_system": "Ga-O-Pr",
"density": 7.161317911270249,
"density_atomic": 0.08337520060828908,
"volume": 239.87948279685003,
"volume_molar": 7.222940054193146,
"formula_full": "Pr4 Ga4 O12",
"formula_reduced": "PrGaO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.2366525349999995,
"spacegroup": 62
},
{
"id": "jvasp-106760",
"created_at": "2022-09-04T14:37:00.552981Z",
"updated_at": "2022-09-04T14:37:00.553005Z",
"structure_string": "Pr2 Ge2 Pd2\n1.0\n4.470099 0.015982 3.645499\n2.203955 3.889038 3.645499\n0.017619 0.010309 7.564373\nPr Ge Pd\n2 2 2\ndirect\n0.534470 0.534471 0.704404 Pr\n0.465529 0.465530 0.295596 Pr\n0.840337 0.840337 0.111516 Ge\n0.159663 0.159663 0.888484 Ge\n0.181533 0.181533 0.284275 Pd\n0.818466 0.818467 0.715725 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"Ge",
"Pd"
],
"chemical_system": "Ge-Pd-Pr",
"density": 8.117835092966752,
"density_atomic": 0.045835957741235105,
"volume": 130.90159550876493,
"volume_molar": 13.138463897706105,
"formula_full": "Pr2 Ge2 Pd2",
"formula_reduced": "PrGePd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9387571666666664,
"spacegroup": 12
},
{
"id": "jvasp-18768",
"created_at": "2022-09-04T14:37:00.554028Z",
"updated_at": "2022-09-04T14:37:00.554048Z",
"structure_string": "Li1 Al2 Rh1\n1.0\n3.696171 0.000000 2.133985\n1.232057 3.484784 2.133985\n0.000000 0.000000 4.267971\nLi Al Rh\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.249999 Al\n0.750001 0.749999 0.749998 Al\n0.500000 0.499999 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Al",
"Rh"
],
"chemical_system": "Al-Li-Rh",
"density": 4.948106148733666,
"density_atomic": 0.07276300261006532,
"volume": 54.972992544519855,
"volume_molar": 8.276377477538228,
"formula_full": "Li1 Al2 Rh1",
"formula_reduced": "LiAl2Rh",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5565271500000004,
"spacegroup": 225
},
{
"id": "jvasp-106233",
"created_at": "2022-09-04T14:37:00.558892Z",
"updated_at": "2022-09-04T14:37:00.558912Z",
"structure_string": "Ca1 Y1 Zn2\n1.0\n4.398712 0.000000 2.539597\n1.466237 4.147145 2.539597\n0.000000 0.000000 5.079195\nCa Y Zn\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500001 0.500001 Y\n0.750000 0.750001 0.750001 Zn\n0.250000 0.250000 0.250000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Y",
"Zn"
],
"chemical_system": "Ca-Y-Zn",
"density": 4.656093597058597,
"density_atomic": 0.04317082583193536,
"volume": 92.65516521671503,
"volume_molar": 13.949561176902845,
"formula_full": "Ca1 Y1 Zn2",
"formula_reduced": "CaYZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107376",
"created_at": "2022-09-04T14:37:00.571664Z",
"updated_at": "2022-09-04T14:37:00.571688Z",
"structure_string": "Pd1 C1 N2\n1.0\n3.480918 -0.272312 -0.815474\n2.303649 0.908494 4.494005\n1.072018 0.422774 15.112961\nPd C N\n1 1 2\ndirect\n-0.000000 -0.000014 -0.000001 Pd\n0.000001 -0.000008 0.499992 C\n0.000003 0.654235 0.541538 N\n0.000002 0.345677 0.458474 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pd",
"C",
"N"
],
"chemical_system": "C-N-Pd",
"density": 4.927762889805643,
"density_atomic": 0.08105668105323255,
"volume": 49.34818386374678,
"volume_molar": 7.429542736946095,
"formula_full": "Pd1 C1 N2",
"formula_reduced": "PdCN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.59151805,
"spacegroup": 12
},
{
"id": "jvasp-27516",
"created_at": "2022-09-04T14:37:00.578898Z",
"updated_at": "2022-09-04T14:37:00.578923Z",
"structure_string": "Na12 Sb4 O12\n1.0\n7.782202 -0.000000 -2.751424\n-3.891101 6.739585 -2.751424\n0.000000 0.000000 8.254272\nNa Sb O\n12 4 12\ndirect\n0.243904 0.724030 0.724030 Na\n0.000000 0.275971 0.519874 Na\n0.480126 0.480126 0.756097 Na\n0.275971 0.519875 0.000001 Na\n0.519874 0.275971 0.000000 Na\n0.000000 0.519875 0.275971 Na\n0.756096 0.480126 0.480126 Na\n0.480126 0.756097 0.480126 Na\n0.519874 0.000000 0.275971 Na\n0.275971 0.000000 0.519874 Na\n0.724029 0.243904 0.724030 Na\n0.724029 0.724030 0.243904 Na\n0.711943 0.000000 0.000000 Sb\n0.000000 0.000000 0.711943 Sb\n0.000000 0.711944 0.000001 Sb\n0.288057 0.288057 0.288057 Sb\n0.518954 0.000000 0.777825 O\n0.222176 0.741131 0.222176 O\n0.741131 0.222176 0.222176 O\n0.777824 0.000000 0.518955 O\n0.000000 0.777825 0.518955 O\n0.222175 0.222176 0.741131 O\n0.777825 0.518955 0.000001 O\n0.518955 0.777825 0.000001 O\n0.000000 0.518955 0.777825 O\n0.258869 0.481046 0.481046 O\n0.481046 0.258869 0.481046 O\n0.481046 0.481046 0.258870 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Na",
"Sb",
"O"
],
"chemical_system": "Na-O-Sb",
"density": 3.6626643615600845,
"density_atomic": 0.064676066802696,
"volume": 432.92675922019475,
"volume_molar": 9.311235295695145,
"formula_full": "Na12 Sb4 O12",
"formula_reduced": "Na3SbO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.8494490857142858,
"spacegroup": 217
},
{
"id": "jvasp-50068",
"created_at": "2022-09-04T14:37:00.596179Z",
"updated_at": "2022-09-04T14:37:00.596198Z",
"structure_string": "Tm2 Bi2 O6\n1.0\n5.945499 0.000000 -0.000000\n-2.972749 1.716317 4.968618\n2.972749 -5.148953 -0.000000\nTm Bi O\n2 2 6\ndirect\n0.142647 0.427942 0.142646 Tm\n0.857354 0.572059 0.857353 Tm\n0.360944 0.082829 0.360943 Bi\n0.639057 0.917172 0.639056 Bi\n0.009267 0.249399 0.453964 O\n0.546036 0.750602 0.213832 O\n0.213833 0.750602 0.990733 O\n0.786168 0.249399 0.009266 O\n0.453965 0.249399 0.786167 O\n0.990734 0.750602 0.546035 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Tm",
"Bi",
"O"
],
"chemical_system": "Bi-O-Tm",
"density": 9.29944326436353,
"density_atomic": 0.0657441558836706,
"volume": 152.10477441818946,
"volume_molar": 9.159963618143841,
"formula_full": "Tm2 Bi2 O6",
"formula_reduced": "TmBiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.50007381,
"spacegroup": 148
},
{
"id": "jvasp-2616",
"created_at": "2022-09-04T14:37:00.605702Z",
"updated_at": "2022-09-04T14:37:00.605731Z",
"structure_string": "Rb2 Sc2 O4\n1.0\n1.632111 -2.826898 0.000000\n1.632111 2.826898 0.000000\n0.000000 0.000000 12.805840\nRb Sc O\n2 2 4\ndirect\n0.333333 0.666667 0.250000 Rb\n0.666667 0.333333 0.750000 Rb\n0.000000 0.000000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.333333 0.666667 0.584479 O\n0.666667 0.333333 0.084479 O\n0.333333 0.666667 0.915521 O\n0.666667 0.333333 0.415521 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Rb",
"Sc",
"O"
],
"chemical_system": "O-Rb-Sc",
"density": 4.564859537619702,
"density_atomic": 0.06770053327256606,
"volume": 118.167459151194,
"volume_molar": 8.895263403250505,
"formula_full": "Rb2 Sc2 O4",
"formula_reduced": "RbScO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8827030625000001,
"spacegroup": 194
},
{
"id": "jvasp-54773",
"created_at": "2022-09-04T14:37:00.619006Z",
"updated_at": "2022-09-04T14:37:00.619031Z",
"structure_string": "Ho2 H2 O4\n1.0\n-3.617263 0.001910 -0.000108\n0.002066 4.301294 -0.040967\n-0.000398 -2.006428 -5.598418\nHo H O\n2 2 4\ndirect\n0.750365 0.666717 0.811660 Ho\n0.250376 0.333413 0.190767 Ho\n0.752453 0.013796 0.421799 H\n0.252505 0.986359 0.580655 H\n0.750257 0.233518 0.949426 O\n0.250278 0.766603 0.052998 O\n0.750062 0.247500 0.439396 O\n0.250037 0.752648 0.563033 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ho",
"H",
"O"
],
"chemical_system": "H-Ho-O",
"density": 7.521104866850009,
"density_atomic": 0.09153041314151915,
"volume": 87.40264274379328,
"volume_molar": 6.579387717488947,
"formula_full": "Ho2 H2 O4",
"formula_reduced": "HoHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4854881416666663,
"spacegroup": 11
},
{
"id": "jvasp-52234",
"created_at": "2022-09-04T14:37:00.624518Z",
"updated_at": "2022-09-04T14:37:00.624545Z",
"structure_string": "Li1 Cu1 F2\n1.0\n2.901284 -0.000000 0.000000\n1.450642 2.512586 0.000000\n2.901284 1.675057 5.850754\nLi Cu F\n1 1 2\ndirect\n-0.000001 0.000001 0.500000 Li\n0.000000 0.000000 0.000000 Cu\n0.789504 0.789508 0.315742 F\n0.210492 0.210495 0.684257 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Cu",
"F"
],
"chemical_system": "Cu-F-Li",
"density": 4.223679888388021,
"density_atomic": 0.09378577565045229,
"volume": 42.65039098155297,
"volume_molar": 6.4211664489986635,
"formula_full": "Li1 Cu1 F2",
"formula_reduced": "LiCuF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-27528",
"created_at": "2022-09-04T14:37:00.772953Z",
"updated_at": "2022-09-04T14:37:00.772976Z",
"structure_string": "Dy8 S8 O4\n1.0\n0.000000 6.859173 0.013756\n6.898543 0.000000 0.000000\n0.000000 -1.354055 -8.141381\nDy S O\n8 8 4\ndirect\n0.249518 0.054422 0.137391 Dy\n0.250482 0.554422 0.862609 Dy\n0.750482 0.945578 0.862608 Dy\n0.749518 0.445578 0.137391 Dy\n0.320707 0.143163 0.576744 Dy\n0.179293 0.643163 0.423256 Dy\n0.679293 0.856837 0.423255 Dy\n0.820707 0.356837 0.576744 Dy\n0.924289 0.133987 0.319036 S\n0.530119 0.777686 0.076812 S\n0.969881 0.277686 0.923187 S\n0.469881 0.222314 0.923187 S\n0.575711 0.633987 0.680963 S\n0.424289 0.366013 0.319036 S\n0.030119 0.722314 0.076812 S\n0.075711 0.866013 0.680963 S\n0.350234 0.912914 0.383079 O\n0.649766 0.087086 0.616920 O\n0.149767 0.412914 0.616920 O\n0.850234 0.587085 0.383079 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Dy",
"S",
"O"
],
"chemical_system": "Dy-O-S",
"density": 6.987479074262419,
"density_atomic": 0.05193350884594476,
"volume": 385.10781274817913,
"volume_molar": 11.595867280726285,
"formula_full": "Dy8 S8 O4",
"formula_reduced": "Dy2S2O",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.3527193,
"spacegroup": 14
},
{
"id": "jvasp-107429",
"created_at": "2022-09-04T14:37:00.811371Z",
"updated_at": "2022-09-04T14:37:00.811386Z",
"structure_string": "Ba2 Ag1 Bi1\n1.0\n5.150551 -0.000000 2.973672\n1.716850 4.855986 2.973672\n-0.000000 -0.000000 5.947344\nBa Ag Bi\n2 1 1\ndirect\n0.750000 0.750001 0.749999 Ba\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.499999 Ag\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Ag",
"Bi"
],
"chemical_system": "Ag-Ba-Bi",
"density": 6.6031563150668156,
"density_atomic": 0.02689092950959624,
"volume": 148.74904188687745,
"volume_molar": 22.3946917039478,
"formula_full": "Ba2 Ag1 Bi1",
"formula_reduced": "Ba2AgBi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}