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=1177",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=1175",
"results": [
{
"id": "jvasp-51116",
"created_at": "2022-09-04T14:36:52.405896Z",
"updated_at": "2022-09-04T14:36:52.405922Z",
"structure_string": "Ir1 Os1 W1\n1.0\n0.000000 2.996768 2.996768\n2.996768 0.000000 2.996768\n2.996768 2.996768 0.000000\nIr Os W\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Ir\n0.250000 0.250000 0.250000 Os\n0.000000 0.000000 0.000000 W\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ir",
"Os",
"W"
],
"chemical_system": "Ir-Os-W",
"density": 17.47013761008246,
"density_atomic": 0.055735498689274555,
"volume": 53.82565995731019,
"volume_molar": 10.804856692093919,
"formula_full": "Ir1 Os1 W1",
"formula_reduced": "IrOsW",
"formula_anonymous": "ABC",
"energy_above_hull": 5.6577820333333335,
"spacegroup": 216
},
{
"id": "jvasp-50491",
"created_at": "2022-09-04T14:36:52.317072Z",
"updated_at": "2022-09-04T14:36:52.317092Z",
"structure_string": "Li12 Cu4 O8\n1.0\n0.000000 5.100630 -0.243741\n8.777402 0.000000 0.000000\n0.000000 -2.644042 -5.615351\nLi Cu O\n12 4 8\ndirect\n0.245398 0.491673 0.002299 Li\n0.771617 0.967553 0.869049 Li\n0.288289 0.807397 0.809030 Li\n0.228383 0.467553 0.630951 Li\n0.711712 0.307397 0.690970 Li\n0.245398 0.008327 0.502299 Li\n0.754602 0.508327 -0.002299 Li\n0.288289 0.692603 0.309030 Li\n0.771617 0.532447 0.369049 Li\n0.711712 0.192603 0.190970 Li\n0.228383 0.032447 0.130951 Li\n0.754602 0.991673 0.497701 Li\n0.730425 0.684666 0.680599 Cu\n0.269575 0.184666 0.819400 Cu\n0.730425 0.815333 0.180599 Cu\n0.269575 0.315333 0.319401 Cu\n0.086186 0.002659 0.786100 O\n0.497378 0.651836 0.109869 O\n0.913815 0.997341 0.213900 O\n0.502622 0.151836 0.390131 O\n0.086185 0.497341 0.286100 O\n0.913815 0.502659 0.713900 O\n0.497378 0.848163 0.609869 O\n0.502622 0.348163 0.890131 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Cu",
"O"
],
"chemical_system": "Cu-Li-O",
"density": 3.006848705970936,
"density_atomic": 0.09336431293350111,
"volume": 257.05753350419917,
"volume_molar": 6.450152709086265,
"formula_full": "Li12 Cu4 O8",
"formula_reduced": "Li3CuO2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.9312229083333337,
"spacegroup": 14
},
{
"id": "jvasp-13846",
"created_at": "2022-09-04T14:36:53.398682Z",
"updated_at": "2022-09-04T14:36:53.398703Z",
"structure_string": "Yb1 Co3 B2\n1.0\n2.566628 -4.445530 0.000000\n2.566628 4.445530 -0.000000\n-0.000000 -0.000000 2.780591\nYb Co B\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.666667 0.333333 0.000000 B\n0.333333 0.666667 0.000000 B\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Yb",
"Co",
"B"
],
"chemical_system": "B-Co-Yb",
"density": 9.720965983681202,
"density_atomic": 0.09455786739906996,
"volume": 63.4532077027259,
"volume_molar": 6.368735807655527,
"formula_full": "Yb1 Co3 B2",
"formula_reduced": "YbCo3B2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.256021427777778,
"spacegroup": 191
},
{
"id": "jvasp-22689",
"created_at": "2022-09-04T14:36:53.479671Z",
"updated_at": "2022-09-04T14:36:53.479755Z",
"structure_string": "Ba2 H6 Ru1\n1.0\n4.024417 4.024417 0.000000\n-0.000000 4.024417 4.024417\n4.024417 0.000000 4.024417\nBa H Ru\n2 6 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.250000 0.250000 0.250000 Ba\n0.217246 0.782755 0.782755 H\n0.217246 0.217246 0.782755 H\n0.217246 0.782755 0.217246 H\n0.782755 0.217246 0.217246 H\n0.782755 0.782755 0.217246 H\n0.782755 0.217246 0.782755 H\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ba",
"H",
"Ru"
],
"chemical_system": "Ba-H-Ru",
"density": 4.863107173989984,
"density_atomic": 0.06904044613834803,
"volume": 130.358369671673,
"volume_molar": 8.722627237854773,
"formula_full": "Ba2 H6 Ru1",
"formula_reduced": "Ba2H6Ru",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.4914824933333333,
"spacegroup": 225
},
{
"id": "jvasp-18852",
"created_at": "2022-09-04T14:36:53.480716Z",
"updated_at": "2022-09-04T14:36:53.480744Z",
"structure_string": "Ho3 In3 Ni3\n1.0\n3.702117 -6.412255 0.000000\n3.702117 6.412255 0.000000\n-0.000000 0.000000 3.767246\nHo In Ni\n3 3 3\ndirect\n0.409725 -0.000000 0.500001 Ho\n0.590275 0.590275 0.500001 Ho\n-0.000000 0.409725 0.500001 Ho\n-0.000000 0.743868 0.000000 In\n0.256133 0.256133 0.000000 In\n0.743868 -0.000000 0.000000 In\n0.333333 0.666667 0.000000 Ni\n0.000000 0.000000 0.500001 Ni\n0.666667 0.333333 0.000000 Ni\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ho",
"In",
"Ni"
],
"chemical_system": "Ho-In-Ni",
"density": 9.426258488001421,
"density_atomic": 0.05031849100149934,
"volume": 178.86068959682885,
"volume_molar": 11.9680472131419,
"formula_full": "Ho3 In3 Ni3",
"formula_reduced": "HoInNi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3937859788888888,
"spacegroup": 189
},
{
"id": "jvasp-21559",
"created_at": "2022-09-04T14:36:53.644680Z",
"updated_at": "2022-09-04T14:36:53.644691Z",
"structure_string": "Sr4 S4 O16\n1.0\n5.373796 -0.000000 0.000000\n-0.000000 6.892110 0.000000\n0.000000 0.000000 8.367036\nSr S O\n4 4 16\ndirect\n0.250000 0.342473 0.683268 Sr\n0.750001 0.657527 0.316732 Sr\n0.750001 0.842473 0.816733 Sr\n0.250000 0.157527 0.183268 Sr\n0.750001 0.316125 0.937330 S\n0.250000 0.683875 0.062671 S\n0.250000 0.816125 0.562671 S\n0.750001 0.183875 0.437329 S\n0.250000 0.958044 0.695602 O\n0.750001 0.041956 0.304398 O\n0.750001 0.410319 0.094521 O\n0.250000 0.589681 0.905479 O\n0.250000 0.910319 0.405479 O\n0.750001 0.089681 0.594521 O\n0.974937 0.310413 0.422279 O\n0.025064 0.689587 0.577721 O\n0.025064 0.810413 0.077721 O\n0.525064 0.189587 0.922280 O\n0.250000 0.541956 0.195602 O\n0.525064 0.310413 0.422279 O\n0.974937 0.189587 0.922280 O\n0.474936 0.810413 0.077721 O\n0.474936 0.689587 0.577721 O\n0.750001 0.458044 0.804399 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Sr",
"S",
"O"
],
"chemical_system": "O-S-Sr",
"density": 3.937060543232387,
"density_atomic": 0.07744729042439841,
"volume": 309.88818160692193,
"volume_molar": 7.775792706238862,
"formula_full": "Sr4 S4 O16",
"formula_reduced": "SrSO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.6354233850000006,
"spacegroup": 62
},
{
"id": "jvasp-105512",
"created_at": "2022-09-04T14:36:52.352173Z",
"updated_at": "2022-09-04T14:36:52.352189Z",
"structure_string": "Fe3 Co3 Si2\n1.0\n3.791325 -0.001343 5.723141\n1.722709 3.377339 5.723141\n-0.002194 -0.001343 6.865018\nFe Co Si\n3 3 2\ndirect\n0.625070 0.625073 0.625070 Fe\n0.749073 0.749075 0.749073 Fe\n0.250721 0.250722 0.250721 Fe\n0.376210 0.376211 0.376210 Co\n0.873836 0.873839 0.873836 Co\n0.125086 0.125087 0.125086 Co\n0.999285 0.999289 0.999285 Si\n0.500714 0.500716 0.500714 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Fe",
"Co",
"Si"
],
"chemical_system": "Co-Fe-Si",
"density": 7.559339533966736,
"density_atomic": 0.09093187899871591,
"volume": 87.97794665733204,
"volume_molar": 6.6226947318278135,
"formula_full": "Fe3 Co3 Si2",
"formula_reduced": "Fe3Co3Si2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 3.8085058,
"spacegroup": 160
},
{
"id": "jvasp-106400",
"created_at": "2022-09-04T14:36:52.369664Z",
"updated_at": "2022-09-04T14:36:52.369684Z",
"structure_string": "Dy3 In4 Co2\n1.0\n8.078074 -0.000000 0.000000\n-4.039038 6.995817 0.000000\n-0.000000 -0.000000 3.524040\nDy In Co\n3 4 2\ndirect\n0.413764 0.074245 0.500000 Dy\n0.660480 0.586236 0.500000 Dy\n0.925755 0.339520 0.500000 Dy\n0.333333 0.666667 0.500000 In\n0.247093 0.284321 -0.000000 In\n0.037228 0.752907 -0.000000 In\n0.715678 0.962772 -0.000000 In\n0.666666 0.333333 -0.000000 Co\n0.000000 0.000000 0.500000 Co\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Dy",
"In",
"Co"
],
"chemical_system": "Co-Dy-In",
"density": 8.87695713771025,
"density_atomic": 0.04519136011996213,
"volume": 199.15311192469466,
"volume_molar": 13.325867475583841,
"formula_full": "Dy3 In4 Co2",
"formula_reduced": "Dy3(In2Co)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.1315345755555557,
"spacegroup": 174
},
{
"id": "jvasp-80575",
"created_at": "2022-09-04T14:36:52.377287Z",
"updated_at": "2022-09-04T14:36:52.377307Z",
"structure_string": "Tl2 Hg1 Te1\n1.0\n-11.003708 -0.040977 -6.419909\n-7.089111 -0.560227 -0.493302\n-5.785902 3.125801 -2.750525\nTl Hg Te\n2 1 1\ndirect\n0.752349 0.000038 0.000037 Tl\n0.247651 -0.000038 -0.000038 Tl\n0.500000 0.000000 -0.000001 Hg\n0.000000 0.000000 0.000000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"Hg",
"Te"
],
"chemical_system": "Hg-Te-Tl",
"density": 9.42587791982334,
"density_atomic": 0.03080993569464935,
"volume": 129.82824890136547,
"volume_molar": 19.546099737708456,
"formula_full": "Tl2 Hg1 Te1",
"formula_reduced": "Tl2HgTe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-15376",
"created_at": "2022-09-04T14:36:52.382523Z",
"updated_at": "2022-09-04T14:36:52.382551Z",
"structure_string": "Yb1 Al4 Mo2\n1.0\n4.650976 0.000000 2.600829\n2.325488 4.794701 1.300415\n-0.014672 0.000000 5.485246\nYb Al Mo\n1 4 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.304351 -0.000000 0.391299 Al\n0.695650 0.608701 0.000000 Al\n0.304351 0.391299 0.000000 Al\n0.695650 -0.000000 0.608701 Al\n0.250001 0.500000 0.500001 Mo\n0.750001 0.500000 0.500001 Mo\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Yb",
"Al",
"Mo"
],
"chemical_system": "Al-Mo-Yb",
"density": 6.409410801393513,
"density_atomic": 0.05714091482435971,
"volume": 122.50416398681517,
"volume_molar": 10.53910456021034,
"formula_full": "Yb1 Al4 Mo2",
"formula_reduced": "Yb(Al2Mo)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.8821991000000007,
"spacegroup": 139
},
{
"id": "jvasp-104802",
"created_at": "2022-09-04T14:36:52.401255Z",
"updated_at": "2022-09-04T14:36:52.401280Z",
"structure_string": "Na3 Sc1 Cl6\n1.0\n6.236961 -0.000000 3.600911\n2.078987 5.880263 3.600911\n-0.000000 -0.000000 7.201822\nNa Sc Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.757971 0.242028 0.242028 Cl\n0.242029 0.242028 0.757971 Cl\n0.242029 0.757971 0.757971 Cl\n0.242029 0.757971 0.242028 Cl\n0.757971 0.242028 0.757971 Cl\n0.757972 0.757971 0.242028 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"Sc",
"Cl"
],
"chemical_system": "Cl-Na-Sc",
"density": 2.053575068481159,
"density_atomic": 0.03786063012099753,
"volume": 264.12661300251295,
"volume_molar": 15.906076419631793,
"formula_full": "Na3 Sc1 Cl6",
"formula_reduced": "Na3ScCl6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-47056",
"created_at": "2022-09-04T14:36:52.471173Z",
"updated_at": "2022-09-04T14:36:52.471194Z",
"structure_string": "Co4 Sn4 O12\n1.0\n5.354139 0.000057 0.000173\n-0.000075 5.411343 0.000120\n-0.000146 0.000046 7.791577\nCo Sn O\n4 4 12\ndirect\n0.025159 0.985694 0.750025 Co\n0.525154 0.514311 0.750000 Co\n0.474818 0.485721 0.250016 Co\n0.974826 0.014280 0.250006 Co\n0.499991 0.000014 0.000007 Sn\n0.500002 0.000004 0.499999 Sn\n0.999985 0.499998 0.000006 Sn\n-0.000001 0.499985 0.500002 Sn\n0.165003 0.837043 0.069204 O\n0.665040 0.662977 0.430783 O\n0.665025 0.662988 0.069237 O\n0.902367 0.628722 0.750000 O\n0.097616 0.371254 0.250001 O\n0.835017 0.162929 0.569202 O\n0.334996 0.337037 0.569210 O\n0.834965 0.162982 0.930774 O\n0.165063 0.836991 0.430746 O\n0.597618 0.128749 0.250001 O\n0.334972 0.337050 0.930784 O\n0.402370 0.871281 0.750001 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Co",
"Sn",
"O"
],
"chemical_system": "Co-O-Sn",
"density": 6.63907833717252,
"density_atomic": 0.08859514513490842,
"volume": 225.74600413538423,
"volume_molar": 6.79737106455413,
"formula_full": "Co4 Sn4 O12",
"formula_reduced": "CoSnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.07238462,
"spacegroup": 62
}
]
}