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=-volume_molar&page=1125",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=1123",
"results": [
{
"id": "jvasp-28436",
"created_at": "2022-09-04T14:37:07.774452Z",
"updated_at": "2022-09-04T14:37:07.774472Z",
"structure_string": "Cu2 W1 Se4\n1.0\n5.588831 -0.000000 0.000000\n-0.000000 5.588831 0.000000\n-2.794416 -2.794416 5.427381\nCu W Se\n2 1 4\ndirect\n-0.000000 0.500000 -0.000000 Cu\n0.500000 -0.000000 -0.000000 Cu\n0.000000 0.000000 0.000000 W\n0.373241 0.373241 0.263857 Se\n0.890616 0.890616 0.263857 Se\n0.109383 0.626758 0.736143 Se\n0.626758 0.109383 0.736143 Se\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Cu",
"W",
"Se"
],
"chemical_system": "Cu-Se-W",
"density": 6.139406927181724,
"density_atomic": 0.041291986396694486,
"volume": 169.52441892115817,
"volume_molar": 14.584284471434598,
"formula_full": "Cu2 W1 Se4",
"formula_reduced": "Cu2WSe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.021684909523809,
"spacegroup": 121
},
{
"id": "jvasp-105541",
"created_at": "2022-09-04T14:38:44.691738Z",
"updated_at": "2022-09-04T14:38:44.691768Z",
"structure_string": "Ce4 Si2 Ge2\n1.0\n3.992195 0.000000 0.000000\n0.000000 5.888667 0.000000\n0.000000 -0.000000 8.240887\nCe Si Ge\n4 2 2\ndirect\n-0.000000 0.130650 0.682292 Ce\n-0.000000 0.869351 0.182292 Ce\n0.500001 0.364251 0.318702 Ce\n0.500001 0.635749 0.818702 Ce\n0.500001 0.883340 0.462850 Si\n0.500001 0.116661 0.962850 Si\n-0.000000 0.617968 0.536156 Ge\n-0.000000 0.382032 0.036156 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ce",
"Si",
"Ge"
],
"chemical_system": "Ce-Ge-Si",
"density": 6.530597530279446,
"density_atomic": 0.041294031578684935,
"volume": 193.7325975245639,
"volume_molar": 14.583562151166891,
"formula_full": "Ce4 Si2 Ge2",
"formula_reduced": "Ce2SiGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8958363875,
"spacegroup": 26
},
{
"id": "jvasp-114916",
"created_at": "2022-09-04T14:38:42.397733Z",
"updated_at": "2022-09-04T14:38:42.397770Z",
"structure_string": "Cu1 Sn1 S3\n1.0\n4.947165 0.000000 0.000000\n0.000000 4.947165 0.000000\n-0.000000 -0.000000 4.947165\nCu Sn S\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Cu\n0.499999 0.499999 0.499999 Sn\n0.499999 0.499999 0.000000 S\n0.499999 0.000000 0.499999 S\n0.000000 0.499999 0.499999 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Cu",
"Sn",
"S"
],
"chemical_system": "Cu-S-Sn",
"density": 3.818815645859912,
"density_atomic": 0.04129531832136736,
"volume": 121.07910056750572,
"volume_molar": 14.583107734234307,
"formula_full": "Cu1 Sn1 S3",
"formula_reduced": "CuSnS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.34169043,
"spacegroup": 221
},
{
"id": "jvasp-100643",
"created_at": "2022-09-04T14:36:36.531491Z",
"updated_at": "2022-09-04T14:36:36.531512Z",
"structure_string": "Sc2 Se3\n1.0\n4.932911 -0.013043 -4.604051\n-0.477109 3.621230 -5.673635\n0.011480 0.013043 6.747650\nSc Se\n2 3\ndirect\n0.662190 0.162190 0.500000 Sc\n0.337810 0.837810 0.499999 Sc\n0.500000 0.500000 0.000000 Se\n0.176829 0.176830 0.000000 Se\n0.823170 0.823171 0.000000 Se\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Sc",
"Se"
],
"chemical_system": "Sc-Se",
"density": 4.481804040706657,
"density_atomic": 0.04129548663555219,
"volume": 121.07860706732515,
"volume_molar": 14.583048295683257,
"formula_full": "Sc2 Se3",
"formula_reduced": "Sc2Se3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.6448941200000002,
"spacegroup": 71
},
{
"id": "jvasp-56242",
"created_at": "2022-09-04T14:36:21.626797Z",
"updated_at": "2022-09-04T14:36:21.626821Z",
"structure_string": "Rb2 Cu2 Cl6\n1.0\n3.443640 -5.964561 -0.000000\n3.443640 5.964561 0.000000\n0.000000 0.000000 5.894679\nRb Cu Cl\n2 2 6\ndirect\n0.666667 0.333333 0.750000 Rb\n0.333333 0.666667 0.250000 Rb\n0.000000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.327959 0.163979 0.250000 Cl\n0.672041 0.836021 0.750000 Cl\n0.163979 0.836021 0.750000 Cl\n0.836021 0.672041 0.250000 Cl\n0.163979 0.327959 0.750000 Cl\n0.836021 0.163979 0.250000 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Cu",
"Cl"
],
"chemical_system": "Cl-Cu-Rb",
"density": 3.502412927974784,
"density_atomic": 0.04129653522065945,
"volume": 242.151065375511,
"volume_molar": 14.582678008752897,
"formula_full": "Rb2 Cu2 Cl6",
"formula_reduced": "RbCuCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0150119999999999,
"spacegroup": 194
},
{
"id": "jvasp-8583",
"created_at": "2022-09-04T14:36:32.516815Z",
"updated_at": "2022-09-04T14:36:32.516841Z",
"structure_string": "Ag1 Br1\n1.0\n3.543282 -0.000000 2.045715\n1.181094 3.340639 2.045715\n0.000000 0.000000 4.091431\nAg Br\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.499999 0.500000 0.499999 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ag",
"Br"
],
"chemical_system": "Ag-Br",
"density": 6.438280527416961,
"density_atomic": 0.04129709467308881,
"volume": 48.429556990199046,
"volume_molar": 14.582480456971028,
"formula_full": "Ag1 Br1",
"formula_reduced": "AgBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-35460",
"created_at": "2022-09-04T14:37:33.359651Z",
"updated_at": "2022-09-04T14:37:33.359667Z",
"structure_string": "Pr1 In5 Rh1\n1.0\n4.706181 -0.000000 -0.000000\n-0.000000 4.706181 0.000000\n-0.000000 0.000000 7.652849\nPr In Rh\n1 5 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.000000 0.500000 0.305333 In\n0.000000 0.500000 0.694667 In\n0.500000 0.000000 0.305333 In\n0.500000 0.000000 0.694667 In\n0.500000 0.500000 0.000000 In\n0.000000 0.000000 0.500000 Rh\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Pr",
"In",
"Rh"
],
"chemical_system": "In-Pr-Rh",
"density": 8.012915846436409,
"density_atomic": 0.04129882003677981,
"volume": 169.4963680261556,
"volume_molar": 14.58187123660389,
"formula_full": "Pr1 In5 Rh1",
"formula_reduced": "PrIn5Rh",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.2833232428571429,
"spacegroup": 123
},
{
"id": "jvasp-10541",
"created_at": "2022-09-04T14:37:07.053768Z",
"updated_at": "2022-09-04T14:37:07.053803Z",
"structure_string": "K4 Ni2 P4\n1.0\n5.597248 -0.000000 -0.000000\n0.000000 5.756614 -2.712121\n-0.000000 0.019025 7.505793\nK Ni P\n4 2 4\ndirect\n0.750000 0.412897 0.825795 K\n0.750000 0.787970 0.575941 K\n0.250000 0.587102 0.174205 K\n0.250000 0.212029 0.424058 K\n0.000000 0.000000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n0.750000 0.275844 0.205536 P\n0.250000 0.070307 0.794463 P\n0.250000 0.724155 0.794463 P\n0.750000 0.929691 0.205536 P\n",
"nsites": 10,
"nelements": 3,
"elements": [
"K",
"Ni",
"P"
],
"chemical_system": "K-Ni-P",
"density": 2.7272244429300385,
"density_atomic": 0.04129937135284628,
"volume": 242.13443624997979,
"volume_molar": 14.581676579406247,
"formula_full": "K4 Ni2 P4",
"formula_reduced": "K2NiP2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.98471988,
"spacegroup": 63
},
{
"id": "jvasp-91749",
"created_at": "2022-09-04T14:37:51.637556Z",
"updated_at": "2022-09-04T14:37:51.637585Z",
"structure_string": "Ba2 Cr2 S4\n1.0\n4.610688 0.000000 0.000000\n0.000000 4.610680 0.000000\n0.000000 0.000000 9.111897\nBa Cr S\n2 2 4\ndirect\n0.750000 0.250000 0.691134 Ba\n0.250000 0.750000 0.308867 Ba\n0.250000 0.750000 0.913993 Cr\n0.750000 0.250000 0.086007 Cr\n0.250000 0.250000 0.999997 S\n0.750000 0.750000 0.000003 S\n0.250000 0.750000 0.651279 S\n0.750000 0.250000 0.348722 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Cr",
"S"
],
"chemical_system": "Ba-Cr-S",
"density": 4.345474265032972,
"density_atomic": 0.041300039655509546,
"volume": 193.70441449280247,
"volume_molar": 14.581440623863006,
"formula_full": "Ba2 Cr2 S4",
"formula_reduced": "BaCrS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7300183425,
"spacegroup": 129
},
{
"id": "jvasp-57459",
"created_at": "2022-09-04T14:38:35.722855Z",
"updated_at": "2022-09-04T14:38:35.722886Z",
"structure_string": "Cd4 Bi4 S8 Cl4\n1.0\n4.015101 0.000000 0.000000\n0.000000 9.493691 0.000000\n0.000000 0.000000 12.703806\nCd Bi S Cl\n4 4 8 4\ndirect\n0.750000 0.496537 0.738300 Cd\n0.250000 0.503462 0.261700 Cd\n0.750000 0.996537 0.761700 Cd\n0.250000 0.003463 0.238300 Cd\n0.250000 0.300467 0.976289 Bi\n0.250000 0.800467 0.523712 Bi\n0.750000 0.199533 0.476289 Bi\n0.750000 0.699533 0.023712 Bi\n0.250000 0.748080 0.167928 S\n0.250000 0.553929 0.889103 S\n0.750000 0.446070 0.110897 S\n0.750000 0.751920 0.667928 S\n0.250000 0.248080 0.332073 S\n0.750000 0.946070 0.389103 S\n0.750000 0.251920 0.832073 S\n0.250000 0.053930 0.610897 S\n0.250000 0.427548 0.604142 Cl\n0.750000 0.572452 0.395858 Cl\n0.750000 0.072452 0.104142 Cl\n0.250000 0.927548 0.895859 Cl\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Cd",
"Bi",
"S",
"Cl"
],
"chemical_system": "Bi-Cd-Cl-S",
"density": 5.774300161084428,
"density_atomic": 0.041301381239047,
"volume": 484.24530608898067,
"volume_molar": 14.580966978185634,
"formula_full": "Cd4 Bi4 S8 Cl4",
"formula_reduced": "CdBiS2Cl",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.4730556235000001,
"spacegroup": 62
},
{
"id": "jvasp-100516",
"created_at": "2022-09-04T14:36:40.997334Z",
"updated_at": "2022-09-04T14:36:40.997355Z",
"structure_string": "Yb1 Ce1 Ag2\n1.0\n4.464097 0.000000 2.577348\n1.488032 4.208791 2.577348\n-0.000000 -0.000000 5.154694\nYb Ce Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Ce\n0.750000 0.750000 0.750000 Ag\n0.250000 0.250000 0.250000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Ce",
"Ag"
],
"chemical_system": "Ag-Ce-Yb",
"density": 9.068230523223512,
"density_atomic": 0.041301528003694174,
"volume": 96.848717065437,
"volume_molar": 14.580915164836894,
"formula_full": "Yb1 Ce1 Ag2",
"formula_reduced": "YbCeAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.13731518,
"spacegroup": 225
},
{
"id": "jvasp-105985",
"created_at": "2022-09-04T14:36:07.261462Z",
"updated_at": "2022-09-04T14:36:07.261489Z",
"structure_string": "Sr1 Zn1 Si1\n1.0\n4.261302 -0.000000 -0.000000\n-2.130651 3.690396 0.000000\n0.000000 0.000000 4.618902\nSr Zn Si\n1 1 1\ndirect\n0.333333 0.666668 0.000000 Sr\n0.000000 0.000000 0.500000 Zn\n0.666667 0.333333 0.500000 Si\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Zn",
"Si"
],
"chemical_system": "Si-Sr-Zn",
"density": 4.140457070513402,
"density_atomic": 0.04130163288635491,
"volume": 72.6363533435776,
"volume_molar": 14.580878137604033,
"formula_full": "Sr1 Zn1 Si1",
"formula_reduced": "SrZnSi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1340717699999997,
"spacegroup": 187
}
]
}