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=-energy_above_hull&page=1034",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=1032",
"results": [
{
"id": "jvasp-99914",
"created_at": "2022-09-04T14:36:33.254612Z",
"updated_at": "2022-09-04T14:36:33.254633Z",
"structure_string": "Ti2 Mn2 Sb2\n1.0\n4.552322 -0.000000 0.000000\n-2.276161 3.942428 -0.000000\n0.000000 0.000000 5.588674\nTi Mn Sb\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.333333 0.666667 0.749999 Mn\n0.666667 0.333333 0.250000 Mn\n0.333333 0.666667 0.250000 Sb\n0.666667 0.333333 0.749999 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"Sb"
],
"chemical_system": "Mn-Sb-Ti",
"density": 7.4355950306736975,
"density_atomic": 0.05981990642116351,
"volume": 100.30105961311362,
"volume_molar": 10.067118322788689,
"formula_full": "Ti2 Mn2 Sb2",
"formula_reduced": "TiMnSb",
"formula_anonymous": "ABC",
"energy_above_hull": 2.820760558237548,
"spacegroup": 194
},
{
"id": "jvasp-79215",
"created_at": "2022-09-04T14:36:45.835511Z",
"updated_at": "2022-09-04T14:36:45.835535Z",
"structure_string": "Ti3 Ag1\n1.0\n0.000000 0.000000 4.074660\n4.074485 0.000000 -0.000000\n0.000000 4.074485 0.000000\nTi Ag\n3 1\ndirect\n0.000000 0.500001 0.500001 Ti\n0.500000 0.500001 0.000000 Ti\n0.500000 0.000000 0.500001 Ti\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Ag"
],
"chemical_system": "Ag-Ti",
"density": 6.173011344024387,
"density_atomic": 0.059132081765303164,
"volume": 67.64517467651669,
"volume_molar": 10.184219090919273,
"formula_full": "Ti3 Ag1",
"formula_reduced": "Ti3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 2.820745565,
"spacegroup": 221
},
{
"id": "jvasp-54573",
"created_at": "2022-09-04T14:38:35.513075Z",
"updated_at": "2022-09-04T14:38:35.513096Z",
"structure_string": "Ti3 Ag1\n1.0\n4.074522 0.000000 0.000000\n0.000000 4.074522 -0.000000\n0.000000 -0.000000 4.074606\nTi Ag\n3 1\ndirect\n0.500000 0.000000 0.500000 Ti\n0.000000 0.500000 0.500000 Ti\n0.500000 0.500000 0.000000 Ti\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Ag"
],
"chemical_system": "Ag-Ti",
"density": 6.172981040818579,
"density_atomic": 0.059131791486937604,
"volume": 67.64550674713809,
"volume_molar": 10.184269085319881,
"formula_full": "Ti3 Ag1",
"formula_reduced": "Ti3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 2.820745565,
"spacegroup": 221
},
{
"id": "jvasp-79357",
"created_at": "2022-09-04T14:37:04.025846Z",
"updated_at": "2022-09-04T14:37:04.025870Z",
"structure_string": "Ti3 Ag1\n1.0\n0.000000 0.000000 4.074660\n4.074485 0.000000 -0.000000\n0.000000 4.074485 0.000000\nTi Ag\n3 1\ndirect\n0.000000 0.500001 0.500001 Ti\n0.500000 0.500001 0.000000 Ti\n0.500000 0.000000 0.500001 Ti\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Ag"
],
"chemical_system": "Ag-Ti",
"density": 6.173011344024387,
"density_atomic": 0.059132081765303164,
"volume": 67.64517467651669,
"volume_molar": 10.184219090919273,
"formula_full": "Ti3 Ag1",
"formula_reduced": "Ti3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 2.820745565,
"spacegroup": 221
},
{
"id": "jvasp-69621",
"created_at": "2022-09-04T14:36:09.190989Z",
"updated_at": "2022-09-04T14:36:09.191014Z",
"structure_string": "Be2 V1 Fe1\n1.0\n-1.913754 1.913754 2.706050\n1.913754 -1.913754 2.706050\n1.913754 1.913754 -2.706050\nBe V Fe\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.749999 0.250000 0.499999 V\n0.500000 0.500000 0.000000 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Fe"
],
"chemical_system": "Be-Fe-V",
"density": 5.227974444708382,
"density_atomic": 0.1009001844794433,
"volume": 39.643138618987685,
"volume_molar": 5.968414023293396,
"formula_full": "Be2 V1 Fe1",
"formula_reduced": "Be2VFe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.820730475,
"spacegroup": 216
},
{
"id": "jvasp-55392",
"created_at": "2022-09-04T14:37:53.975608Z",
"updated_at": "2022-09-04T14:37:53.975626Z",
"structure_string": "Lu4 Mn4 O14\n1.0\n6.008631 -0.000000 3.469085\n2.002877 5.664992 3.469085\n-0.000000 -0.000000 6.938170\nLu Mn O\n4 4 14\ndirect\n0.499999 0.500001 0.500000 Lu\n0.000000 0.500001 0.500000 Lu\n0.499999 0.000000 0.500000 Lu\n0.499999 0.500001 0.000001 Lu\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.499999 0.000000 0.000000 Mn\n0.000000 0.500001 0.999999 Mn\n0.668430 0.081570 0.081569 O\n0.668430 0.081570 0.668432 O\n0.081570 0.668430 0.081569 O\n0.625000 0.624999 0.625002 O\n0.918431 0.331569 0.331570 O\n0.331569 0.918431 0.331570 O\n0.331569 0.331569 0.918432 O\n0.918431 0.918431 0.331570 O\n0.918431 0.331569 0.918432 O\n0.081570 0.668430 0.668432 O\n0.331569 0.918431 0.918432 O\n0.374999 0.375000 0.375001 O\n0.668431 0.668430 0.081571 O\n0.081570 0.081570 0.668430 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Lu",
"Mn",
"O"
],
"chemical_system": "Lu-Mn-O",
"density": 8.040960819024344,
"density_atomic": 0.09315430050221776,
"volume": 236.1673039397278,
"volume_molar": 6.464694305612469,
"formula_full": "Lu4 Mn4 O14",
"formula_reduced": "Lu2Mn2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.820729134796238,
"spacegroup": 227
},
{
"id": "jvasp-44612",
"created_at": "2022-09-04T14:38:30.019903Z",
"updated_at": "2022-09-04T14:38:30.019932Z",
"structure_string": "Li6 Fe2 Si2 C2 O14\n1.0\n0.000000 4.941210 0.025707\n6.359260 0.000000 0.000000\n0.000000 -0.512360 -8.437657\nLi Fe Si C O\n6 2 2 2 14\ndirect\n0.234246 0.750000 0.112055 Li\n0.758554 0.984669 0.265062 Li\n0.758554 0.515331 0.265062 Li\n0.241446 0.484669 0.734938 Li\n0.241446 0.015331 0.734938 Li\n0.765754 0.250000 0.887945 Li\n0.208667 0.250000 0.346791 Fe\n0.791333 0.750000 0.653209 Fe\n0.718225 0.250000 0.580719 Si\n0.281775 0.750000 0.419281 Si\n0.281644 0.250000 0.033899 C\n0.718356 0.750000 0.966101 C\n0.538604 0.750000 0.845896 O\n0.823899 0.052440 0.693772 O\n0.823899 0.447560 0.693772 O\n0.380879 0.250000 0.558993 O\n0.175823 0.750000 0.598466 O\n0.824177 0.250000 0.401534 O\n0.636558 0.750000 0.109044 O\n0.176101 0.552440 0.306228 O\n0.176101 0.947560 0.306228 O\n0.461396 0.250000 0.154104 O\n0.029041 0.250000 0.061401 O\n0.970959 0.750000 0.938599 O\n0.619121 0.750000 0.441007 O\n0.363442 0.250000 0.890956 O\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Li",
"Fe",
"Si",
"C",
"O"
],
"chemical_system": "C-Fe-Li-O-Si",
"density": 2.866385796021004,
"density_atomic": 0.09809543785928033,
"volume": 265.0480039377312,
"volume_molar": 6.13906303026943,
"formula_full": "Li6 Fe2 Si2 C2 O14",
"formula_reduced": "Li3FeSiCO7",
"formula_anonymous": "ABCD3E7",
"energy_above_hull": 2.820703738461538,
"spacegroup": 11
},
{
"id": "jvasp-12445",
"created_at": "2022-09-04T14:37:16.593463Z",
"updated_at": "2022-09-04T14:37:16.593478Z",
"structure_string": "Rb1 Sr2 Nb3 O10\n1.0\n3.982242 0.000000 0.000000\n0.000000 3.982242 -0.000000\n0.000000 0.000000 15.331240\nRb Sr Nb O\n1 2 3 10\ndirect\n0.500000 0.500000 0.500000 Rb\n0.500000 0.500000 0.146310 Sr\n0.500000 0.500000 0.853690 Sr\n0.000000 0.000000 0.000000 Nb\n0.000000 0.000000 0.286908 Nb\n0.000000 0.000000 0.713092 Nb\n0.000000 0.000000 0.595763 O\n0.000000 0.000000 0.404237 O\n0.500000 0.000000 0.740719 O\n0.000000 0.500000 0.740719 O\n0.500000 0.000000 0.259281 O\n0.000000 0.500000 0.259281 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.129370 O\n0.000000 0.000000 0.870630 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Rb",
"Sr",
"Nb",
"O"
],
"chemical_system": "Nb-O-Rb-Sr",
"density": 4.776998982382785,
"density_atomic": 0.06580932001773333,
"volume": 243.1266573744958,
"volume_molar": 9.15089345760941,
"formula_full": "Rb1 Sr2 Nb3 O10",
"formula_reduced": "RbSr2Nb3O10",
"formula_anonymous": "AB2C3D10",
"energy_above_hull": 2.82059723875,
"spacegroup": 123
},
{
"id": "jvasp-119356",
"created_at": "2022-09-04T14:38:31.294292Z",
"updated_at": "2022-09-04T14:38:31.294318Z",
"structure_string": "Li4 Al1 Cr3 O8\n1.0\n5.033085 0.002348 -0.000043\n1.675920 4.754802 -2.905766\n0.000059 -0.000040 5.811508\nLi Al Cr O\n4 1 3 8\ndirect\n0.000002 -0.000002 0.000004 Li\n-0.000003 0.000002 0.500006 Li\n0.503922 -0.001151 0.249389 Li\n0.496075 0.001152 0.750542 Li\n0.000001 0.499999 0.500005 Al\n0.499999 0.500000 0.251838 Cr\n0.000001 0.500000 0.000011 Cr\n0.499999 0.500000 0.748167 Cr\n0.752141 0.277179 0.388592 O\n0.247858 0.722820 0.611413 O\n0.259058 0.725277 0.112639 O\n0.740942 0.274723 0.887361 O\n0.235759 0.277594 0.630809 O\n0.235760 0.277592 0.146798 O\n0.764241 0.722407 0.853217 O\n0.764239 0.722407 0.369207 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Al",
"Cr",
"O"
],
"chemical_system": "Al-Cr-Li-O",
"density": 4.045006567928168,
"density_atomic": 0.11506352823501255,
"volume": 139.05361886105783,
"volume_molar": 5.233752912304257,
"formula_full": "Li4 Al1 Cr3 O8",
"formula_reduced": "Li4AlCr3O8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 2.8203433125000004,
"spacegroup": 12
},
{
"id": "jvasp-92714",
"created_at": "2022-09-04T14:36:03.874577Z",
"updated_at": "2022-09-04T14:36:03.874599Z",
"structure_string": "Nd1 Si3 Rh1\n1.0\n4.274215 0.000000 0.000000\n0.000000 4.274215 0.000000\n-2.137108 -2.137108 4.924511\nNd Si Rh\n1 3 1\ndirect\n0.000101 0.000101 0.000202 Nd\n0.413987 0.413987 0.827973 Si\n0.762539 0.262539 0.525077 Si\n0.262539 0.762539 0.525077 Si\n0.654836 0.654836 0.309671 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Nd",
"Si",
"Rh"
],
"chemical_system": "Nd-Rh-Si",
"density": 6.116894686265292,
"density_atomic": 0.05557688022401002,
"volume": 89.96546729227754,
"volume_molar": 10.835694151465429,
"formula_full": "Nd1 Si3 Rh1",
"formula_reduced": "NdSi3Rh",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.8201780599999995,
"spacegroup": 107
},
{
"id": "jvasp-122525",
"created_at": "2022-09-04T14:38:53.502879Z",
"updated_at": "2022-09-04T14:38:53.502899Z",
"structure_string": "Ti2 V2 O8\n1.0\n3.776942 0.000030 0.013331\n-0.000087 9.454778 -0.000084\n-0.013504 0.000032 3.776982\nTi V O\n2 2 8\ndirect\n0.000001 0.750002 0.500000 Ti\n0.500001 0.250004 -0.000000 Ti\n0.499998 0.499996 0.500000 V\n0.999998 0.000000 0.000001 V\n-0.000001 0.963348 0.500001 O\n0.499999 0.463338 0.000000 O\n-0.000000 0.536660 0.500000 O\n0.500000 0.036650 0.000000 O\n0.500000 0.293737 0.499999 O\n-0.000000 0.793740 0.000001 O\n0.000000 0.206260 -0.000001 O\n0.500000 0.706263 0.500000 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ti",
"V",
"O"
],
"chemical_system": "O-Ti-V",
"density": 4.008738422812374,
"density_atomic": 0.08896910027525697,
"volume": 134.87828878648668,
"volume_molar": 6.7688003378346036,
"formula_full": "Ti2 V2 O8",
"formula_reduced": "TiVO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.8199260888888897,
"spacegroup": 119
},
{
"id": "jvasp-117249",
"created_at": "2022-09-04T14:38:49.346524Z",
"updated_at": "2022-09-04T14:38:49.346547Z",
"structure_string": "Ti4 V4 O16\n1.0\n3.777789 0.007622 -0.000556\n-0.038546 18.907588 0.003602\n0.000564 -0.000728 3.776186\nTi V O\n4 4 16\ndirect\n-0.000062 0.374967 0.499999 Ti\n0.500001 0.624965 0.000003 Ti\n0.000057 0.874968 0.499999 Ti\n0.500106 0.124967 -0.000001 Ti\n0.999955 0.500021 -0.000003 V\n0.500003 0.750020 0.500002 V\n0.000046 0.000023 0.999997 V\n0.499853 0.250020 0.499997 V\n0.499926 0.353139 0.500002 O\n0.000080 0.103138 0.000001 O\n-0.000075 0.396860 -0.000001 O\n0.500064 0.146863 0.500000 O\n0.000052 0.896862 -0.000003 O\n0.500020 0.646862 0.500002 O\n0.500072 0.018325 0.999998 O\n0.499895 0.231689 1.000000 O\n0.499967 0.518323 -0.000000 O\n-0.000092 0.268324 0.500001 O\n-0.000000 0.603137 0.000003 O\n0.000086 0.981689 0.499998 O\n0.500004 0.731689 0.000001 O\n-0.000042 0.481687 0.500000 O\n0.000013 0.768325 0.500001 O\n0.500049 0.853137 0.499999 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ti",
"V",
"O"
],
"chemical_system": "O-Ti-V",
"density": 4.009135586469747,
"density_atomic": 0.08897791484221836,
"volume": 269.7298542290907,
"volume_molar": 6.768129788924438,
"formula_full": "Ti4 V4 O16",
"formula_reduced": "TiVO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.8198910888888893,
"spacegroup": 119
}
]
}