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=nsites&page=223",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=221",
"results": [
{
"id": "jvasp-120954",
"created_at": "2022-09-04T14:38:54.609421Z",
"updated_at": "2022-09-04T14:38:54.609450Z",
"structure_string": "Ca1 Ta1 O1\n1.0\n6.604132 0.000000 0.000000\n0.000000 6.604132 0.000000\n0.000000 0.000000 4.762595\nCa Ta O\n1 1 1\ndirect\n0.328522 0.000761 0.000000 Ca\n-0.008779 -0.089377 0.000000 Ta\n0.001452 0.305825 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Ta",
"O"
],
"chemical_system": "Ca-O-Ta",
"density": 1.8948228956978652,
"density_atomic": 0.01444262425987646,
"volume": 207.7184828753318,
"volume_molar": 41.696998077629914,
"formula_full": "Ca1 Ta1 O1",
"formula_reduced": "CaTaO",
"formula_anonymous": "ABC",
"energy_above_hull": 3.407284373333333,
"spacegroup": 6
},
{
"id": "jvasp-120989",
"created_at": "2022-09-04T14:38:54.620408Z",
"updated_at": "2022-09-04T14:38:54.620441Z",
"structure_string": "Na1 Al1 As1\n1.0\n4.013128 0.018025 0.000000\n-0.403173 6.581283 0.000000\n0.000000 0.000000 2.847230\nNa Al As\n1 1 1\ndirect\n-0.046933 0.379895 0.000000 Na\n-0.102196 -0.172715 0.000000 Al\n0.421156 0.064846 0.000000 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Al",
"As"
],
"chemical_system": "Al-As-Na",
"density": 2.757092044375912,
"density_atomic": 0.039882800393755455,
"volume": 75.22039501693861,
"volume_molar": 15.099593560493563,
"formula_full": "Na1 Al1 As1",
"formula_reduced": "NaAlAs",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9364411833333334,
"spacegroup": 6
},
{
"id": "jvasp-121068",
"created_at": "2022-09-04T14:38:54.668317Z",
"updated_at": "2022-09-04T14:38:54.668346Z",
"structure_string": "Ge1 O2\n1.0\n3.416495 0.000000 0.000000\n0.000000 2.850407 0.000000\n0.000000 0.000000 3.910614\nGe O\n1 2\ndirect\n0.466659 0.000000 0.000000 Ge\n-0.033330 0.000000 0.687102 O\n-0.033330 0.000000 0.312896 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"O"
],
"chemical_system": "Ge-O",
"density": 4.562566757354002,
"density_atomic": 0.0787750411391697,
"volume": 38.08312831852392,
"volume_molar": 7.644731977176439,
"formula_full": "Ge1 O2",
"formula_reduced": "GeO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5633976499999998,
"spacegroup": 47
},
{
"id": "jvasp-121188",
"created_at": "2022-09-04T14:38:54.675128Z",
"updated_at": "2022-09-04T14:38:54.675154Z",
"structure_string": "Li1 Sb1 Te1\n1.0\n5.576542 1.063139 0.000000\n1.058042 5.451201 0.000000\n0.000000 0.000000 3.124365\nLi Sb Te\n1 1 1\ndirect\n-0.075803 -0.076098 0.000000 Li\n0.424081 -0.075940 0.000000 Sb\n-0.076251 0.424066 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Sb",
"Te"
],
"chemical_system": "Li-Sb-Te",
"density": 4.653240316903134,
"density_atomic": 0.03280026397265128,
"volume": 91.46267854738569,
"volume_molar": 18.36003748329963,
"formula_full": "Li1 Sb1 Te1",
"formula_reduced": "LiSbTe",
"formula_anonymous": "ABC",
"energy_above_hull": null,
"spacegroup": 10
},
{
"id": "jvasp-121189",
"created_at": "2022-09-04T14:38:54.686130Z",
"updated_at": "2022-09-04T14:38:54.686155Z",
"structure_string": "Li1 Sb1 Te1\n1.0\n3.134214 -0.000000 0.000000\n0.000000 3.134214 0.000000\n0.000000 -0.000000 9.110166\nLi Sb Te\n1 1 1\ndirect\n-0.000000 0.000000 0.327096 Li\n-0.000000 0.000000 0.621811 Sb\n-0.000000 0.000000 0.036113 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Sb",
"Te"
],
"chemical_system": "Li-Sb-Te",
"density": 4.755714943633898,
"density_atomic": 0.03352259821252672,
"volume": 89.4918699612896,
"volume_molar": 17.964421259416724,
"formula_full": "Li1 Sb1 Te1",
"formula_reduced": "LiSbTe",
"formula_anonymous": "ABC",
"energy_above_hull": null,
"spacegroup": 99
},
{
"id": "jvasp-123647",
"created_at": "2022-09-04T14:38:54.691124Z",
"updated_at": "2022-09-04T14:38:54.691148Z",
"structure_string": "Bi1 Se2\n1.0\n2.105397 -3.647909 -0.281014\n2.106485 3.648537 -0.000000\n-0.347144 0.200424 5.595064\nBi Se\n1 2\ndirect\n0.000001 0.333294 0.166667 Bi\n0.724098 0.695403 0.474318 Se\n0.275905 -0.028694 0.859015 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Bi",
"Se"
],
"chemical_system": "Bi-Se",
"density": 7.125881114945888,
"density_atomic": 0.0350883175336356,
"volume": 85.49854227476725,
"volume_molar": 17.162808545115297,
"formula_full": "Bi1 Se2",
"formula_reduced": "BiSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.0150070111111114,
"spacegroup": 12
},
{
"id": "jvasp-121307",
"created_at": "2022-09-04T14:38:54.815668Z",
"updated_at": "2022-09-04T14:38:54.815695Z",
"structure_string": "Li1 Au1 O1\n1.0\n2.784885 -0.000000 -0.000000\n-0.000000 2.784885 0.000000\n0.000000 0.000000 6.289403\nLi Au O\n1 1 1\ndirect\n0.000000 0.000000 0.395736 Li\n0.000000 0.000000 -0.007923 Au\n0.000000 0.000000 0.664679 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Au",
"O"
],
"chemical_system": "Au-Li-O",
"density": 7.486246700694707,
"density_atomic": 0.061503141464219244,
"volume": 48.77799618976071,
"volume_molar": 9.791598634849422,
"formula_full": "Li1 Au1 O1",
"formula_reduced": "LiAuO",
"formula_anonymous": "ABC",
"energy_above_hull": null,
"spacegroup": 99
},
{
"id": "jvasp-120979",
"created_at": "2022-09-04T14:38:54.840999Z",
"updated_at": "2022-09-04T14:38:54.841028Z",
"structure_string": "Y1 Cl1 O1\n1.0\n4.450021 -0.000000 -0.000000\n-2.225010 3.853831 0.000000\n0.000000 -0.000000 4.423491\nY Cl O\n1 1 1\ndirect\n0.666667 0.333333 0.000000 Y\n0.000000 0.000000 0.000000 Cl\n0.333333 0.666667 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"Cl",
"O"
],
"chemical_system": "Cl-O-Y",
"density": 3.0723250927839465,
"density_atomic": 0.03954589240522492,
"volume": 75.86122900601507,
"volume_molar": 15.228233310027255,
"formula_full": "Y1 Cl1 O1",
"formula_reduced": "YClO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0730676725000003,
"spacegroup": 187
},
{
"id": "jvasp-123668",
"created_at": "2022-09-04T14:38:55.114156Z",
"updated_at": "2022-09-04T14:38:55.114189Z",
"structure_string": "Hf1 Se2\n1.0\n1.877209 -3.260221 0.016550\n1.884831 3.264622 0.000000\n-0.023701 0.013684 6.218069\nHf Se\n1 2\ndirect\n0.000000 0.333342 0.166667 Hf\n0.666622 0.666640 0.420260 Se\n0.333379 0.000018 0.913073 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hf",
"Se"
],
"chemical_system": "Hf-Se",
"density": 7.319642250296289,
"density_atomic": 0.039309101357891105,
"volume": 76.3182035805498,
"volume_molar": 15.319965483746898,
"formula_full": "Hf1 Se2",
"formula_reduced": "HfSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.980276577777777,
"spacegroup": 164
},
{
"id": "jvasp-121298",
"created_at": "2022-09-04T14:38:54.698857Z",
"updated_at": "2022-09-04T14:38:54.698881Z",
"structure_string": "Au1 O1 F1\n1.0\n2.660966 -0.000000 0.000000\n-0.000000 2.660966 -0.000000\n-0.000000 0.000000 6.943147\nAu O F\n1 1 1\ndirect\n0.000000 0.000000 0.331431 Au\n0.000000 0.000000 -0.039382 O\n0.000000 0.000000 0.756475 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Au",
"O",
"F"
],
"chemical_system": "Au-F-O",
"density": 7.834934539272462,
"density_atomic": 0.061021972740506025,
"volume": 49.16261905784992,
"volume_molar": 9.868807069887694,
"formula_full": "Au1 O1 F1",
"formula_reduced": "AuOF",
"formula_anonymous": "ABC",
"energy_above_hull": null,
"spacegroup": 99
},
{
"id": "jvasp-123652",
"created_at": "2022-09-04T14:38:54.720289Z",
"updated_at": "2022-09-04T14:38:54.720316Z",
"structure_string": "Ce1 Se2\n1.0\n2.137848 -3.701927 -0.017026\n2.137040 3.701460 -0.000000\n0.017271 -0.009972 5.958141\nCe Se\n1 2\ndirect\n-0.000000 0.333328 0.166667 Ce\n0.667142 0.666906 0.413856 Se\n0.332859 -0.000235 0.919476 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ce",
"Se"
],
"chemical_system": "Ce-Se",
"density": 5.248983044598615,
"density_atomic": 0.03181841933761358,
"volume": 94.28501045787662,
"volume_molar": 18.926586817846836,
"formula_full": "Ce1 Se2",
"formula_reduced": "CeSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9345707444444444,
"spacegroup": 164
},
{
"id": "jvasp-120845",
"created_at": "2022-09-04T14:38:54.728162Z",
"updated_at": "2022-09-04T14:38:54.728192Z",
"structure_string": "B2 Se1\n1.0\n4.893383 -0.318061 -0.756559\n1.359637 -3.736193 -0.003996\n2.336231 0.483470 -2.612279\nB Se\n2 1\ndirect\n0.901096 0.560135 0.520626 B\n0.456719 0.450272 0.059954 B\n0.877663 0.914005 0.001138 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"Se"
],
"chemical_system": "B-Se",
"density": 4.223974951156359,
"density_atomic": 0.07587054860124574,
"volume": 39.541034766562134,
"volume_molar": 7.9373892386763645,
"formula_full": "B2 Se1",
"formula_reduced": "B2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 3.2161695111111106,
"spacegroup": 1
}
]
}