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=3515",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=3513",
"results": [
{
"id": "jvasp-51317",
"created_at": "2022-09-04T14:37:01.901538Z",
"updated_at": "2022-09-04T14:37:01.901573Z",
"structure_string": "Mo1 Pt2 Br1\n1.0\n0.000000 3.223944 3.223945\n3.223945 -0.000000 3.223945\n3.223945 3.223944 0.000000\nMo Pt Br\n1 2 1\ndirect\n0.250000 0.250001 0.250000 Mo\n0.000000 0.000000 0.000000 Pt\n0.749999 0.750003 0.749999 Pt\n0.499999 0.500002 0.499999 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mo",
"Pt",
"Br"
],
"chemical_system": "Br-Mo-Pt",
"density": 14.024326133641544,
"density_atomic": 0.05968528304708896,
"volume": 67.01819604079255,
"volume_molar": 10.089825250973186,
"formula_full": "Mo1 Pt2 Br1",
"formula_reduced": "MoPt2Br",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.90564820125,
"spacegroup": 216
},
{
"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
},
{
"id": "jvasp-38273",
"created_at": "2022-09-04T14:37:01.910525Z",
"updated_at": "2022-09-04T14:37:01.910544Z",
"structure_string": "K1 Rh1 O3\n1.0\n3.938338 -0.000000 0.000000\n-0.000000 3.938338 -0.000000\n0.000000 -0.000000 3.938338\nK Rh O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"K",
"Rh",
"O"
],
"chemical_system": "K-O-Rh",
"density": 5.164976053585242,
"density_atomic": 0.08185233004775891,
"volume": 61.08561597553322,
"volume_molar": 7.357323556319315,
"formula_full": "K1 Rh1 O3",
"formula_reduced": "KRhO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7555383,
"spacegroup": 221
},
{
"id": "jvasp-28431",
"created_at": "2022-09-04T14:37:01.931345Z",
"updated_at": "2022-09-04T14:37:01.931371Z",
"structure_string": "Al2 Fe1 S4\n1.0\n-1.772672 -3.070357 0.000000\n1.772672 -3.070357 0.000000\n-0.000000 -2.046904 11.942283\nAl Fe S\n2 1 4\ndirect\n0.699872 0.699872 0.900385 Al\n0.468577 0.468577 0.594269 Al\n0.936960 0.936960 0.189124 Fe\n-0.000269 -0.000269 0.000807 S\n0.829650 0.829650 0.511051 S\n0.586051 0.586051 0.241846 S\n0.406361 0.406361 0.780917 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Al",
"Fe",
"S"
],
"chemical_system": "Al-Fe-S",
"density": 3.040994589274967,
"density_atomic": 0.053847237236133924,
"volume": 129.99738443967343,
"volume_molar": 11.18375067896496,
"formula_full": "Al2 Fe1 S4",
"formula_reduced": "Al2FeS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.2165887285714287,
"spacegroup": 160
},
{
"id": "jvasp-107481",
"created_at": "2022-09-04T14:37:01.937141Z",
"updated_at": "2022-09-04T14:37:01.937175Z",
"structure_string": "Sr1 Ac1 In2\n1.0\n4.991028 -0.000000 2.881571\n1.663676 4.705586 2.881571\n-0.000000 -0.000000 5.763143\nSr Ac In\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.499999 Ac\n0.250000 0.250000 0.250000 In\n0.750001 0.750001 0.749999 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Ac",
"In"
],
"chemical_system": "Ac-In-Sr",
"density": 6.6771203758770765,
"density_atomic": 0.029552680201149293,
"volume": 135.3515137298593,
"volume_molar": 20.377646694007133,
"formula_full": "Sr1 Ac1 In2",
"formula_reduced": "SrAcIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-1240",
"created_at": "2022-09-04T14:37:01.943094Z",
"updated_at": "2022-09-04T14:37:01.943109Z",
"structure_string": "Li2 Nb2 O6\n1.0\n4.593678 0.012360 3.134673\n1.662398 4.282344 3.134673\n0.018004 0.012360 5.561272\nLi Nb O\n2 2 6\ndirect\n0.281433 0.281433 0.281433 Li\n0.781433 0.781432 0.781432 Li\n0.000245 0.000245 0.000245 Nb\n0.500245 0.500244 0.500244 Nb\n0.103766 0.368651 0.719504 O\n0.719504 0.103766 0.368651 O\n0.368652 0.719504 0.103766 O\n0.868652 0.603766 0.219504 O\n0.219505 0.868650 0.603766 O\n0.603766 0.219504 0.868651 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Li",
"Nb",
"O"
],
"chemical_system": "Li-Nb-O",
"density": 4.507506209410453,
"density_atomic": 0.09180131350231932,
"volume": 108.93090325714516,
"volume_molar": 6.559972325284706,
"formula_full": "Li2 Nb2 O6",
"formula_reduced": "LiNbO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.32037198,
"spacegroup": 161
},
{
"id": "jvasp-102742",
"created_at": "2022-09-04T14:37:01.951276Z",
"updated_at": "2022-09-04T14:37:01.951305Z",
"structure_string": "Hg2 Te1 S1\n1.0\n4.283053 0.007239 6.479462\n1.953348 3.811696 6.479462\n0.011822 0.007239 7.767099\nHg Te S\n2 1 1\ndirect\n0.991160 0.991163 0.991161 Hg\n0.507533 0.507535 0.507534 Hg\n0.377205 0.377206 0.377206 Te\n0.874098 0.874100 0.874099 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hg",
"Te",
"S"
],
"chemical_system": "Hg-S-Te",
"density": 7.374175278867237,
"density_atomic": 0.031672438219898416,
"volume": 126.29277140674866,
"volume_molar": 19.01382115954859,
"formula_full": "Hg2 Te1 S1",
"formula_reduced": "Hg2TeS",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 160
},
{
"id": "jvasp-99649",
"created_at": "2022-09-04T14:37:01.955152Z",
"updated_at": "2022-09-04T14:37:01.955182Z",
"structure_string": "La1 Co5 H4\n1.0\n5.217107 -0.007636 0.000000\n-2.390010 4.637469 0.000000\n-0.000000 -0.000000 4.029539\nLa Co H\n1 5 4\ndirect\n0.500000 0.500000 0.500000 La\n0.865422 0.134577 0.500000 Co\n0.134578 0.865422 0.500000 Co\n0.000000 0.500000 -0.000000 Co\n0.500000 -0.000000 -0.000000 Co\n0.000000 0.000000 0.000000 Co\n0.646708 0.353292 -0.000000 H\n0.353292 0.646708 -0.000000 H\n0.000000 0.500000 0.500000 H\n0.500000 -0.000000 0.500000 H\n",
"nsites": 10,
"nelements": 3,
"elements": [
"La",
"Co",
"H"
],
"chemical_system": "Co-H-La",
"density": 7.459181671566933,
"density_atomic": 0.10265062385937422,
"volume": 97.41782001928655,
"volume_molar": 5.866638246884896,
"formula_full": "La1 Co5 H4",
"formula_reduced": "LaCo5H4",
"formula_anonymous": "AB4C5",
"energy_above_hull": 3.41582695,
"spacegroup": 65
},
{
"id": "jvasp-7674",
"created_at": "2022-09-04T14:37:01.957866Z",
"updated_at": "2022-09-04T14:37:01.957890Z",
"structure_string": "Th1 Ta1 N3\n1.0\n4.063938 0.000000 0.000000\n0.000000 4.063938 0.000000\n-0.000000 -0.000000 4.063938\nTh Ta N\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Th\n0.500000 0.500000 0.500000 Ta\n0.500000 0.000000 0.500000 N\n0.500000 0.500000 0.000000 N\n0.000000 0.500000 0.500000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Ta",
"N"
],
"chemical_system": "N-Ta-Th",
"density": 11.257061486131626,
"density_atomic": 0.07449528454269175,
"volume": 67.11834219700981,
"volume_molar": 8.083922085764813,
"formula_full": "Th1 Ta1 N3",
"formula_reduced": "ThTaN3",
"formula_anonymous": "ABC3",
"energy_above_hull": 5.15298291,
"spacegroup": 221
},
{
"id": "jvasp-8826",
"created_at": "2022-09-04T14:37:02.147148Z",
"updated_at": "2022-09-04T14:37:02.147168Z",
"structure_string": "Na2 Ce1 O3\n1.0\n4.565309 0.000000 0.000000\n-0.000000 4.565309 0.000000\n0.000000 0.000000 4.682047\nNa Ce O\n2 1 3\ndirect\n0.000000 0.500000 0.500000 Na\n0.500000 0.000000 0.500000 Na\n0.000000 0.000000 0.000000 Ce\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Ce",
"O"
],
"chemical_system": "Ce-Na-O",
"density": 3.983481186601522,
"density_atomic": 0.06148584214951411,
"volume": 97.58344019115651,
"volume_molar": 9.794353544603098,
"formula_full": "Na2 Ce1 O3",
"formula_reduced": "Na2CeO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.0639756666666669,
"spacegroup": 123
},
{
"id": "jvasp-11128",
"created_at": "2022-09-04T14:37:01.966589Z",
"updated_at": "2022-09-04T14:37:01.966616Z",
"structure_string": "Sm2 As2 O8\n1.0\n4.741893 0.000000 -1.916978\n-0.774966 4.678138 -1.916979\n-0.012133 -0.014309 6.793319\nSm As O\n2 2 8\ndirect\n0.375000 0.125000 0.750000 Sm\n0.624999 0.875000 0.249999 Sm\n0.874999 0.625000 0.750000 As\n0.125000 0.375000 0.250000 As\n0.939124 0.296790 0.592423 O\n0.295632 0.439125 0.092423 O\n0.796790 0.153299 0.092423 O\n0.653298 0.795632 0.592423 O\n0.346701 0.204368 0.407576 O\n0.203209 0.846701 0.907576 O\n0.704367 0.560875 0.907576 O\n0.060875 0.703210 0.407576 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sm",
"As",
"O"
],
"chemical_system": "As-O-Sm",
"density": 6.386160690172816,
"density_atomic": 0.07976728075607889,
"volume": 150.43762161950727,
"volume_molar": 7.549637774935766,
"formula_full": "Sm2 As2 O8",
"formula_reduced": "SmAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.075734104166667,
"spacegroup": 88
},
{
"id": "jvasp-105403",
"created_at": "2022-09-04T14:37:01.981316Z",
"updated_at": "2022-09-04T14:37:01.981336Z",
"structure_string": "Sr3 Pb1 S4\n1.0\n4.259850 -0.000000 0.000000\n0.000000 6.013365 0.000000\n-0.000000 -0.000000 8.523382\nSr Pb S\n3 1 4\ndirect\n0.500000 0.500000 0.248677 Sr\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.751322 Sr\n0.000000 0.000000 0.000000 Pb\n-0.000000 0.500000 0.500000 S\n0.500000 0.000000 0.747270 S\n-0.000000 0.500000 -0.000000 S\n0.500000 0.000000 0.252730 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sr",
"Pb",
"S"
],
"chemical_system": "Pb-S-Sr",
"density": 4.55049658057118,
"density_atomic": 0.036640902454296666,
"volume": 218.33523369078173,
"volume_molar": 16.435568876917277,
"formula_full": "Sr3 Pb1 S4",
"formula_reduced": "Sr3PbS4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.6492212187500002,
"spacegroup": 47
}
]
}