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=639",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=637",
"results": [
{
"id": "jvasp-104683",
"created_at": "2022-09-04T14:36:44.373571Z",
"updated_at": "2022-09-04T14:36:44.373600Z",
"structure_string": "Th1 Pb1 I6\n1.0\n7.338751 0.107199 0.000000\n-6.067850 4.129159 0.000000\n-0.000000 -0.000000 10.058991\nTh Pb I\n1 1 6\ndirect\n0.237195 0.762806 0.500000 Th\n0.764285 0.235715 -0.000000 Pb\n0.143330 0.856671 0.797754 I\n0.853632 0.146369 0.677043 I\n0.143330 0.856671 0.202246 I\n0.853632 0.146369 0.322957 I\n0.427019 0.572982 -0.000000 I\n0.575479 0.424521 0.500000 I\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Th",
"Pb",
"I"
],
"chemical_system": "I-Pb-Th",
"density": 6.403376040038904,
"density_atomic": 0.025693785173862595,
"volume": 311.35934023991626,
"volume_molar": 23.43812217331885,
"formula_full": "Th1 Pb1 I6",
"formula_reduced": "ThPbI6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.11862550875,
"spacegroup": 38
},
{
"id": "jvasp-54888",
"created_at": "2022-09-04T14:37:17.659898Z",
"updated_at": "2022-09-04T14:37:17.659928Z",
"structure_string": "In4 Bi2\n1.0\n5.540091 0.000000 0.000000\n-2.770046 4.797861 -0.000000\n-0.000000 0.000000 6.752440\nIn Bi\n4 2\ndirect\n0.333332 0.666667 0.250000 In\n0.666667 0.333333 0.250000 In\n0.333332 0.666667 0.750000 In\n0.666667 0.333333 0.750000 In\n0.000000 0.000000 0.000000 Bi\n0.000000 0.000000 0.500000 Bi\n",
"nsites": 6,
"nelements": 2,
"elements": [
"In",
"Bi"
],
"chemical_system": "Bi-In",
"density": 8.115936962396361,
"density_atomic": 0.03342919790759852,
"volume": 179.48381581228992,
"volume_molar": 18.014613382725397,
"formula_full": "In4 Bi2",
"formula_reduced": "In2Bi",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1186638111111111,
"spacegroup": 191
},
{
"id": "jvasp-22656",
"created_at": "2022-09-04T14:36:51.717609Z",
"updated_at": "2022-09-04T14:36:51.717632Z",
"structure_string": "Hg2 I2 Br2\n1.0\n4.329642 -0.138917 0.000000\n-1.800490 3.939965 -0.000000\n-0.000000 0.000000 13.039319\nHg I Br\n2 2 2\ndirect\n0.844031 0.155968 0.001194 Hg\n0.155968 0.844033 0.501194 Hg\n0.892662 0.107336 0.641693 I\n0.107337 0.892664 0.141693 I\n0.593358 0.406641 0.869113 Br\n0.406641 0.593359 0.369113 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Hg",
"I",
"Br"
],
"chemical_system": "Br-Hg-I",
"density": 6.173253624751837,
"density_atomic": 0.027375804053669926,
"volume": 219.17164472090295,
"volume_molar": 21.99804158516647,
"formula_full": "Hg2 I2 Br2",
"formula_reduced": "HgIBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1186799999999999,
"spacegroup": 36
},
{
"id": "jvasp-14789",
"created_at": "2022-09-04T14:35:46.941760Z",
"updated_at": "2022-09-04T14:35:46.941785Z",
"structure_string": "Nd1 Te1\n1.0\n3.894154 0.000000 2.248290\n1.298051 3.671443 2.248290\n0.000000 0.000000 4.496581\nNd Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.499999 0.500000 0.500000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Nd",
"Te"
],
"chemical_system": "Nd-Te",
"density": 7.02155530222847,
"density_atomic": 0.03110983173958175,
"volume": 64.28835799376421,
"volume_molar": 19.357677053385963,
"formula_full": "Nd1 Te1",
"formula_reduced": "NdTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1187096333333335,
"spacegroup": 225
},
{
"id": "jvasp-96729",
"created_at": "2022-09-04T14:35:52.358025Z",
"updated_at": "2022-09-04T14:35:52.358042Z",
"structure_string": "Ba4 Zn8 As8\n1.0\n4.288795 0.000000 0.000000\n-0.000000 10.085852 0.000000\n0.000000 0.000000 11.010424\nBa Zn As\n4 8 8\ndirect\n0.750001 0.753203 0.174493 Ba\n0.750001 0.253203 0.325507 Ba\n0.250000 0.746797 0.674493 Ba\n0.250000 0.246797 0.825507 Ba\n0.250000 0.550693 0.381538 Zn\n0.750001 0.449307 0.618462 Zn\n0.750001 0.401011 0.050220 Zn\n0.750001 0.949307 0.881537 Zn\n0.750001 0.901011 0.449780 Zn\n0.250000 0.098989 0.550220 Zn\n0.250000 0.598989 0.949780 Zn\n0.250000 0.050693 0.118462 Zn\n0.750001 0.649520 0.461334 As\n0.250000 0.850480 0.961334 As\n0.750001 0.149520 0.038666 As\n0.750001 0.522011 0.839610 As\n0.250000 0.477989 0.160389 As\n0.750001 0.022011 0.660389 As\n0.250000 0.977989 0.339610 As\n0.250000 0.350480 0.538665 As\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"As"
],
"chemical_system": "As-Ba-Zn",
"density": 5.829364179331779,
"density_atomic": 0.041993113252203625,
"volume": 476.2685700363138,
"volume_molar": 14.340781841613,
"formula_full": "Ba4 Zn8 As8",
"formula_reduced": "Ba(ZnAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.118756054,
"spacegroup": 62
},
{
"id": "jvasp-111272",
"created_at": "2022-09-04T14:38:49.447921Z",
"updated_at": "2022-09-04T14:38:49.447957Z",
"structure_string": "In1 Pb1\n1.0\n3.423363 -0.040897 0.705650\n1.659815 2.994345 0.705650\n0.525417 0.305280 5.941522\nIn Pb\n1 1\ndirect\n0.749884 0.749881 0.250020 In\n0.250110 0.250108 0.749979 Pb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"In",
"Pb"
],
"chemical_system": "In-Pb",
"density": 8.941414954250261,
"density_atomic": 0.033443136387824424,
"volume": 59.803003426680284,
"volume_molar": 18.007105225311552,
"formula_full": "In1 Pb1",
"formula_reduced": "InPb",
"formula_anonymous": "AB",
"energy_above_hull": 0.1187919399999999,
"spacegroup": 166
},
{
"id": "jvasp-42010",
"created_at": "2022-09-04T14:37:38.529760Z",
"updated_at": "2022-09-04T14:37:38.529790Z",
"structure_string": "Sm1 Ag3\n1.0\n-0.000000 3.487577 3.487577\n3.487577 0.000000 3.487577\n3.487577 3.487577 0.000000\nSm Ag\n1 3\ndirect\n0.750001 0.750001 0.750001 Sm\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Ag\n0.249999 0.249999 0.249999 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Ag"
],
"chemical_system": "Ag-Sm",
"density": 9.276701725386534,
"density_atomic": 0.04714749042280248,
"volume": 84.84014661500274,
"volume_molar": 12.7729826253646,
"formula_full": "Sm1 Ag3",
"formula_reduced": "SmAg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1188276637499999,
"spacegroup": 225
},
{
"id": "jvasp-35262",
"created_at": "2022-09-04T14:37:56.414177Z",
"updated_at": "2022-09-04T14:37:56.414209Z",
"structure_string": "Na4 Zn6 Se8\n1.0\n2.879108 -5.537092 -0.000000\n5.923907 -0.436827 6.770859\n-3.044802 -5.100263 6.770859\nNa Zn Se\n4 6 8\ndirect\n0.741121 0.623369 0.376631 Na\n0.258879 0.376632 0.623368 Na\n0.758879 0.123369 0.876631 Na\n0.241121 0.876632 0.123368 Na\n0.750000 0.461272 0.038728 Zn\n0.250000 0.538729 0.961271 Zn\n0.750000 0.038729 0.461271 Zn\n0.250000 0.250000 0.250000 Zn\n0.750000 0.750001 0.750000 Zn\n0.250000 0.961272 0.538728 Zn\n0.094599 0.766326 0.506116 Se\n0.594598 0.006116 0.266325 Se\n0.132960 0.266325 0.006116 Se\n0.905402 0.233675 0.493883 Se\n0.367040 0.493884 0.233675 Se\n0.405402 0.993884 0.733675 Se\n0.867040 0.733676 0.993883 Se\n0.632960 0.506117 0.766325 Se\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 4.338755316122247,
"density_atomic": 0.042139381030845684,
"volume": 427.15387743413095,
"volume_molar": 14.29100431160069,
"formula_full": "Na4 Zn6 Se8",
"formula_reduced": "Na2Zn3Se4",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 0.1189785703703705,
"spacegroup": 72
},
{
"id": "jvasp-109388",
"created_at": "2022-09-04T14:38:19.369313Z",
"updated_at": "2022-09-04T14:38:19.369329Z",
"structure_string": "Mg4 Si1 Sn1\n1.0\n4.445436 0.006255 6.678727\n2.024129 3.957884 6.678727\n0.010208 0.006255 8.022917\nMg Si Sn\n4 1 1\ndirect\n0.620936 0.620932 0.620935 Mg\n0.128434 0.128433 0.128434 Mg\n0.871569 0.871563 0.871568 Mg\n0.379067 0.379065 0.379067 Mg\n0.500002 0.499998 0.500001 Si\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Mg",
"Si",
"Sn"
],
"chemical_system": "Mg-Si-Sn",
"density": 2.88012814247923,
"density_atomic": 0.04264779184971732,
"volume": 140.68723701200884,
"volume_molar": 14.120639073696651,
"formula_full": "Mg4 Si1 Sn1",
"formula_reduced": "Mg4SiSn",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.1190938916666664,
"spacegroup": 166
},
{
"id": "jvasp-4252",
"created_at": "2022-09-04T14:36:38.500834Z",
"updated_at": "2022-09-04T14:36:38.500854Z",
"structure_string": "Au4 Cl12\n1.0\n0.000000 6.453787 -0.110920\n11.011806 0.000000 0.000000\n0.000000 -2.708967 -5.867278\nAu Cl\n4 12\ndirect\n0.261255 0.588258 0.960686 Au\n0.238745 0.088258 0.039314 Au\n0.738745 0.411742 0.039314 Au\n0.761255 0.911742 0.960686 Au\n0.105138 0.659545 0.198300 Cl\n0.394862 0.159545 0.801701 Cl\n0.894862 0.340456 0.801701 Cl\n0.605138 0.840456 0.198300 Cl\n0.938923 0.993285 0.733488 Cl\n0.561077 0.493285 0.266513 Cl\n0.061077 0.006715 0.266513 Cl\n0.438923 0.506716 0.733488 Cl\n0.476031 0.826508 0.657598 Cl\n0.023969 0.326508 0.342402 Cl\n0.523969 0.173492 0.342402 Cl\n-0.023969 0.673493 0.657598 Cl\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Au",
"Cl"
],
"chemical_system": "Au-Cl",
"density": 4.793752602487424,
"density_atomic": 0.03806952779608499,
"volume": 420.28364748052945,
"volume_molar": 15.818795526587298,
"formula_full": "Au4 Cl12",
"formula_reduced": "AuCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1193599431249999,
"spacegroup": 14
},
{
"id": "jvasp-15491",
"created_at": "2022-09-04T14:35:51.737569Z",
"updated_at": "2022-09-04T14:35:51.737585Z",
"structure_string": "Ce2 S2 F2\n1.0\n3.936372 0.000000 0.000000\n0.000000 3.936372 -0.000000\n0.000000 0.000000 6.979773\nCe S F\n2 2 2\ndirect\n0.500000 0.000000 0.765221 Ce\n0.000000 0.500000 0.234778 Ce\n0.000000 0.500000 0.648848 S\n0.500000 0.000000 0.351151 S\n0.000000 0.000000 0.000000 F\n0.500000 0.500000 0.000000 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"S",
"F"
],
"chemical_system": "Ce-F-S",
"density": 5.870655936706077,
"density_atomic": 0.055477602437548366,
"volume": 108.15175379567374,
"volume_molar": 10.855084746640191,
"formula_full": "Ce2 S2 F2",
"formula_reduced": "CeSF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1193785941666667,
"spacegroup": 129
},
{
"id": "jvasp-18581",
"created_at": "2022-09-04T14:35:50.082247Z",
"updated_at": "2022-09-04T14:35:50.082282Z",
"structure_string": "Er1 Ag2\n1.0\n3.463009 -0.000000 -1.287460\n-0.478645 3.429770 -1.287460\n-0.018195 -0.020911 5.252185\nEr Ag\n1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.331624 0.331625 0.663250 Ag\n0.668374 0.668375 0.336748 Ag\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Er",
"Ag"
],
"chemical_system": "Ag-Er",
"density": 10.225488941878718,
"density_atomic": 0.048235044417581203,
"volume": 62.19544391891405,
"volume_molar": 12.484990597012882,
"formula_full": "Er1 Ag2",
"formula_reduced": "ErAg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1195581733333334,
"spacegroup": 139
}
]
}