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=-formula_full&page=3483",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=3481",
"results": [
{
"id": "jvasp-95186",
"created_at": "2022-09-04T14:36:17.890047Z",
"updated_at": "2022-09-04T14:36:17.890076Z",
"structure_string": "Cu4 Sb4 Pb4 S12\n1.0\n7.876434 0.000022 0.000043\n0.000032 8.215228 0.000077\n-0.000016 -0.000070 8.761485\nCu Sb Pb S\n4 4 4 12\ndirect\n0.242832 0.277932 0.428813 Cu\n0.742835 0.722069 0.928809 Cu\n0.757166 0.277930 0.428803 Cu\n0.257173 0.722069 0.928813 Cu\n0.499994 0.073093 0.054332 Sb\n-0.000000 0.926906 0.554335 Sb\n0.500004 0.490272 0.664169 Sb\n0.000000 0.509727 0.164169 Sb\n0.499998 0.559320 0.184661 Pb\n0.000000 0.440680 0.684662 Pb\n0.499999 0.926649 0.502453 Pb\n0.999992 0.073353 0.002452 Pb\n0.499998 0.232487 0.298277 S\n0.000003 0.767513 0.798281 S\n0.000003 0.238187 0.288172 S\n0.265185 0.564852 0.484476 S\n0.500002 0.761812 0.788173 S\n0.234815 0.435147 0.984470 S\n0.763232 0.108139 0.644183 S\n0.734818 0.564852 0.484470 S\n0.236762 0.108138 0.644188 S\n0.765182 0.435146 0.984475 S\n0.263230 0.891864 0.144186 S\n0.736759 0.891861 0.144185 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Cu",
"Sb",
"Pb",
"S"
],
"chemical_system": "Cu-Pb-S-Sb",
"density": 5.72565710155903,
"density_atomic": 0.04233350824450684,
"volume": 566.9267914528256,
"volume_molar": 14.225470578100335,
"formula_full": "Cu4 Sb4 Pb4 S12",
"formula_reduced": "CuSbPbS3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.247697895,
"spacegroup": 31
},
{
"id": "jvasp-20464",
"created_at": "2022-09-04T14:38:16.511910Z",
"updated_at": "2022-09-04T14:38:16.511943Z",
"structure_string": "Cu4 Sb2\n1.0\n4.051294 0.000000 0.000000\n0.000000 4.051294 0.000000\n0.000000 0.000000 6.162025\nCu Sb\n4 2\ndirect\n0.499999 0.499999 0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.000000 0.499999 0.264159 Cu\n0.499999 0.000000 0.735840 Cu\n0.000000 0.499999 0.699127 Sb\n0.499999 0.000000 0.300872 Sb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"Sb"
],
"chemical_system": "Cu-Sb",
"density": 8.17164047753317,
"density_atomic": 0.05932534503981229,
"volume": 101.13721202925151,
"volume_molar": 10.151042115235297,
"formula_full": "Cu4 Sb2",
"formula_reduced": "Cu2Sb",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2411956666666668,
"spacegroup": 129
},
{
"id": "jvasp-85835",
"created_at": "2022-09-04T14:36:17.821002Z",
"updated_at": "2022-09-04T14:36:17.821033Z",
"structure_string": "Cu4 S8\n1.0\n0.000174 5.825258 0.000000\n0.000000 0.000000 5.825074\n5.825745 0.000174 0.000000\nCu S\n4 8\ndirect\n-0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.100872 0.600883 0.899132 S\n0.899127 0.399117 0.100868 S\n0.399129 0.100878 0.899143 S\n0.899127 0.100883 0.600868 S\n0.600870 0.600878 0.600858 S\n0.399130 0.399121 0.399143 S\n0.100873 0.899116 0.399132 S\n0.600870 0.899121 0.100857 S\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cu",
"S"
],
"chemical_system": "Cu-S",
"density": 4.2899306772078,
"density_atomic": 0.06070342052785655,
"volume": 197.68243528374566,
"volume_molar": 9.92059542548589,
"formula_full": "Cu4 S8",
"formula_reduced": "CuS2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9326001500000002,
"spacegroup": 205
},
{
"id": "jvasp-86334",
"created_at": "2022-09-04T14:36:03.691258Z",
"updated_at": "2022-09-04T14:36:03.691272Z",
"structure_string": "Cu4 S8\n1.0\n0.000174 5.825258 0.000000\n0.000000 0.000000 5.825074\n5.825745 0.000174 0.000000\nCu S\n4 8\ndirect\n-0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.100872 0.600883 0.899132 S\n0.899127 0.399117 0.100868 S\n0.399129 0.100878 0.899143 S\n0.899127 0.100883 0.600868 S\n0.600870 0.600878 0.600858 S\n0.399130 0.399121 0.399143 S\n0.100873 0.899116 0.399132 S\n0.600870 0.899121 0.100857 S\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cu",
"S"
],
"chemical_system": "Cu-S",
"density": 4.2899306772078,
"density_atomic": 0.06070342052785655,
"volume": 197.68243528374566,
"volume_molar": 9.92059542548589,
"formula_full": "Cu4 S8",
"formula_reduced": "CuS2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9326001500000002,
"spacegroup": 205
},
{
"id": "jvasp-23446",
"created_at": "2022-09-04T14:37:38.792877Z",
"updated_at": "2022-09-04T14:37:38.792902Z",
"structure_string": "Cu4 S4 O16\n1.0\n4.871174 0.000000 0.000000\n0.000000 6.710214 0.000000\n0.000000 0.000000 8.468999\nCu S O\n4 4 16\ndirect\n0.500000 0.500000 0.500000 Cu\n0.000000 0.500000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.953780 0.750000 0.683325 S\n0.453780 0.250000 0.816675 S\n0.046219 0.250000 0.316675 S\n0.546219 0.750000 0.183325 S\n0.067620 0.250000 0.135347 O\n0.567620 0.750000 0.364653 O\n0.241063 0.750000 0.633967 O\n0.741062 0.250000 0.866033 O\n0.758937 0.250000 0.366033 O\n0.258937 0.750000 0.133967 O\n0.684301 0.934426 0.131496 O\n0.315698 0.065574 0.868504 O\n0.315698 0.434426 0.868504 O\n0.815698 0.565573 0.631496 O\n0.432379 0.250000 0.635347 O\n0.815698 0.934426 0.631496 O\n0.684301 0.565573 0.131496 O\n0.184301 0.434426 0.368504 O\n0.184301 0.065574 0.368504 O\n0.932379 0.750000 0.864653 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cu",
"S",
"O"
],
"chemical_system": "Cu-O-S",
"density": 3.8296870096112374,
"density_atomic": 0.08669801344009934,
"volume": 276.8229518497777,
"volume_molar": 6.9461115901585995,
"formula_full": "Cu4 S4 O16",
"formula_reduced": "CuSO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.8718224083333337,
"spacegroup": 62
},
{
"id": "jvasp-90838",
"created_at": "2022-09-04T14:36:17.614195Z",
"updated_at": "2022-09-04T14:36:17.614211Z",
"structure_string": "Cu4 S3 N1\n1.0\n3.950829 -0.000000 -0.000000\n-0.000000 3.950829 -0.000000\n0.000000 0.000000 8.409907\nCu S N\n4 3 1\ndirect\n0.500000 -0.000000 0.818945 Cu\n-0.000000 0.500000 0.818945 Cu\n0.500000 -0.000000 0.181055 Cu\n-0.000000 0.500000 0.181055 Cu\n0.000000 0.000000 0.000000 S\n0.500000 0.500000 0.687870 S\n0.500000 0.500000 0.312130 S\n-0.000000 -0.000000 0.500000 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cu",
"S",
"N"
],
"chemical_system": "Cu-N-S",
"density": 4.609382657710269,
"density_atomic": 0.06094278933784027,
"volume": 131.27065706906663,
"volume_molar": 9.881629681595102,
"formula_full": "Cu4 S3 N1",
"formula_reduced": "Cu4S3N",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.39420188125,
"spacegroup": 123
},
{
"id": "jvasp-5536",
"created_at": "2022-09-04T14:35:58.730500Z",
"updated_at": "2022-09-04T14:35:58.730517Z",
"structure_string": "Cu4 S2 O8\n1.0\n4.215285 -0.000000 1.433680\n2.107642 5.482424 0.716840\n-0.261601 0.000000 7.682853\nCu S O\n4 2 8\ndirect\n0.180163 0.250000 0.639675 Cu\n0.569838 0.250000 0.860324 Cu\n0.819838 0.749999 0.360325 Cu\n0.430163 0.749999 0.139675 Cu\n0.875001 0.250000 0.250000 S\n0.125000 0.749999 0.750000 S\n0.927503 0.405445 0.369484 O\n0.202432 0.094555 0.130516 O\n0.667053 0.405445 0.130515 O\n0.703014 0.094555 0.369484 O\n0.072498 0.594554 0.630515 O\n0.797569 0.905445 0.869484 O\n0.296987 0.905445 0.630515 O\n0.332948 0.594554 0.869484 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Cu",
"S",
"O"
],
"chemical_system": "Cu-O-S",
"density": 4.126313597487102,
"density_atomic": 0.07794806344475837,
"volume": 179.6067712435444,
"volume_molar": 7.725837556269603,
"formula_full": "Cu4 S2 O8",
"formula_reduced": "Cu2SO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.607793557142857,
"spacegroup": 70
},
{
"id": "jvasp-86452",
"created_at": "2022-09-04T14:36:21.816018Z",
"updated_at": "2022-09-04T14:36:21.816043Z",
"structure_string": "Cu4 S2 O10\n1.0\n5.380156 0.025476 -1.789304\n-2.544413 4.965547 -1.008787\n-0.007170 -0.012812 7.257181\nCu S O\n4 2 10\ndirect\n0.143920 0.078652 0.222572 Cu\n0.856082 0.921350 0.777429 Cu\n0.500001 0.000000 0.000000 Cu\n0.000000 0.500000 -0.000000 Cu\n0.722067 0.591430 0.313495 S\n0.277935 0.408572 0.686506 S\n0.420288 0.711908 0.749094 O\n0.962815 0.671196 0.250908 O\n0.579714 0.288094 0.250907 O\n0.037187 0.328806 0.749093 O\n0.868546 0.148879 0.017423 O\n0.131456 0.851123 0.982578 O\n0.472891 0.309949 0.782839 O\n0.527111 0.690053 0.217162 O\n0.844554 0.695548 0.540100 O\n0.155448 0.304454 0.459901 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Cu",
"S",
"O"
],
"chemical_system": "Cu-O-S",
"density": 4.090743262250636,
"density_atomic": 0.082407258074072,
"volume": 194.15765521064122,
"volume_molar": 7.307779558187681,
"formula_full": "Cu4 S2 O10",
"formula_reduced": "Cu2SO5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.7836198,
"spacegroup": 12
},
{
"id": "jvasp-107349",
"created_at": "2022-09-04T14:36:50.786322Z",
"updated_at": "2022-09-04T14:36:50.786344Z",
"structure_string": "Cu4 S2\n1.0\n3.970731 0.000471 0.080270\n-1.907654 3.482465 0.080270\n-0.037544 -0.063382 7.132278\nCu S\n4 2\ndirect\n0.000001 0.500000 0.500000 Cu\n0.500000 -0.000000 0.000000 Cu\n0.018578 0.981422 0.250000 Cu\n0.981424 0.018577 0.750000 Cu\n0.371385 0.628614 0.250000 S\n0.628616 0.371385 0.750000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"S"
],
"chemical_system": "Cu-S",
"density": 5.356896705958581,
"density_atomic": 0.060807855157884234,
"volume": 98.67146250137144,
"volume_molar": 9.903557269638677,
"formula_full": "Cu4 S2",
"formula_reduced": "Cu2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2616336333333334,
"spacegroup": 15
},
{
"id": "jvasp-34294",
"created_at": "2022-09-04T14:37:17.663395Z",
"updated_at": "2022-09-04T14:37:17.663422Z",
"structure_string": "Cu4 S2\n1.0\n2.144037 -3.713581 0.000000\n2.144037 3.713581 -0.000000\n-0.000000 -0.000000 5.375492\nCu S\n4 2\ndirect\n0.000000 0.000000 0.250000 Cu\n0.666668 0.333334 0.250000 Cu\n0.333334 0.666668 0.750000 Cu\n0.000000 0.000000 0.750000 Cu\n0.333334 0.666668 0.250000 S\n0.666668 0.333334 0.750000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"S"
],
"chemical_system": "Cu-S",
"density": 6.174921559790394,
"density_atomic": 0.07009351802534722,
"volume": 85.5999266270282,
"volume_molar": 8.591580119893932,
"formula_full": "Cu4 S2",
"formula_reduced": "Cu2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3229769666666667,
"spacegroup": 194
},
{
"id": "jvasp-42611",
"created_at": "2022-09-04T14:36:05.519038Z",
"updated_at": "2022-09-04T14:36:05.519055Z",
"structure_string": "Cu4 S2\n1.0\n2.143731 -3.713051 0.000000\n2.143731 3.713051 -0.000000\n0.000000 -0.000000 5.379474\nCu S\n4 2\ndirect\n0.000000 0.000000 0.250000 Cu\n0.333333 0.666667 0.749999 Cu\n0.666667 0.333333 0.250000 Cu\n0.000000 0.000000 0.749999 Cu\n0.333333 0.666667 0.250000 S\n0.666667 0.333333 0.749999 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"S"
],
"chemical_system": "Cu-S",
"density": 6.172112399749066,
"density_atomic": 0.0700616303474089,
"volume": 85.63888636687854,
"volume_molar": 8.595490470516458,
"formula_full": "Cu4 S2",
"formula_reduced": "Cu2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3229169666666667,
"spacegroup": 194
},
{
"id": "jvasp-8275",
"created_at": "2022-09-04T14:36:34.579289Z",
"updated_at": "2022-09-04T14:36:34.579307Z",
"structure_string": "Cu4 S2\n1.0\n5.138215 -1.275429 0.000000\n-2.915224 4.419213 -0.000000\n-1.111495 -1.571892 4.931704\nCu S\n4 2\ndirect\n0.250090 0.749999 0.000090 Cu\n0.249999 0.750089 0.500090 Cu\n0.249909 0.250000 0.499910 Cu\n0.749999 0.749909 -0.000090 Cu\n0.624999 0.374999 0.250000 S\n0.874998 0.124999 0.749999 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"S"
],
"chemical_system": "Cu-S",
"density": 5.644331087321345,
"density_atomic": 0.06407061514537131,
"volume": 93.64667385175653,
"volume_molar": 9.399224194018153,
"formula_full": "Cu4 S2",
"formula_reduced": "Cu2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2745069666666667,
"spacegroup": 141
}
]
}