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=updated_at&page=3574",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=3572",
"results": [
{
"id": "jvasp-31727",
"created_at": "2022-09-04T14:38:13.640859Z",
"updated_at": "2022-09-04T14:38:13.640886Z",
"structure_string": "Nb1 W3 Se8\n1.0\n1.852060 2.816648 13.090757\n-1.512185 3.012727 -13.090747\n-1.851443 -2.816643 13.090668\nNb W Se\n1 3 8\ndirect\n0.049453 0.674483 0.375029 Nb\n0.458445 0.333438 0.124964 W\n0.534081 0.659106 0.875025 W\n0.958474 0.333438 0.624993 W\n0.640565 0.328967 0.311595 Se\n0.228048 0.666669 0.561342 Se\n0.355443 0.666776 0.688587 Se\n0.767379 0.329024 0.438452 Se\n0.146369 0.337293 0.809064 Se\n0.728198 0.666806 0.061354 Se\n0.855319 0.666639 0.188600 Se\n0.278234 0.337358 0.940984 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nb",
"W",
"Se"
],
"chemical_system": "Nb-Se-W",
"density": 8.227523711448821,
"density_atomic": 0.04659232806002107,
"volume": 257.5531315915656,
"volume_molar": 12.925176763526755,
"formula_full": "Nb1 W3 Se8",
"formula_reduced": "NbW3Se8",
"formula_anonymous": "AB3C8",
"energy_above_hull": 4.056627194444444,
"spacegroup": 44
},
{
"id": "jvasp-33220",
"created_at": "2022-09-04T14:38:13.642067Z",
"updated_at": "2022-09-04T14:38:13.642093Z",
"structure_string": "Ga4 Se6\n1.0\n4.370479 -0.000000 -2.498488\n-2.846257 9.421937 -4.978813\n1.524930 -1.910171 7.739256\nGa Se\n4 6\ndirect\n0.375630 0.597105 0.751277 Ga\n0.375646 0.097105 0.751277 Ga\n0.004667 0.471926 0.000864 Ga\n-0.003803 0.971926 0.000864 Ga\n0.902362 0.887407 0.186942 Se\n0.198501 0.830748 0.718532 Se\n0.284579 0.387407 0.186942 Se\n0.520029 0.330748 0.718532 Se\n0.902181 0.242617 0.186988 Se\n0.284807 0.742617 0.186988 Se\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Ga",
"Se"
],
"chemical_system": "Ga-Se",
"density": 4.173832435532062,
"density_atomic": 0.03339578775332286,
"volume": 299.4389614003043,
"volume_molar": 18.032635745808392,
"formula_full": "Ga4 Se6",
"formula_reduced": "Ga2Se3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.6722275711111111,
"spacegroup": 46
},
{
"id": "jvasp-18064",
"created_at": "2022-09-04T14:38:13.646458Z",
"updated_at": "2022-09-04T14:38:13.646483Z",
"structure_string": "Sm3 In3 Ir3\n1.0\n3.782473 -6.551434 -0.000000\n3.782473 6.551434 0.000000\n0.000000 0.000000 4.026893\nSm In Ir\n3 3 3\ndirect\n0.592476 0.592476 0.000000 Sm\n0.407523 -0.000000 0.000000 Sm\n-0.000000 0.407523 0.000000 Sm\n-0.000000 0.745282 0.500000 In\n0.254717 0.254717 0.500000 In\n0.745282 -0.000000 0.500000 In\n0.000000 0.000000 0.000000 Ir\n0.666667 0.333333 0.500000 Ir\n0.333333 0.666667 0.500000 Ir\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Sm",
"In",
"Ir"
],
"chemical_system": "In-Ir-Sm",
"density": 11.416933528019612,
"density_atomic": 0.045095189569447115,
"volume": 199.57782827678096,
"volume_molar": 13.35428638286537,
"formula_full": "Sm3 In3 Ir3",
"formula_reduced": "SmInIr",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4323566483333323,
"spacegroup": 189
},
{
"id": "jvasp-9447",
"created_at": "2022-09-04T14:38:13.646764Z",
"updated_at": "2022-09-04T14:38:13.646791Z",
"structure_string": "Ag4 Sb4 S8\n1.0\n4.445811 0.000000 0.000000\n-2.222906 6.376712 -0.950614\n0.000000 0.015961 13.358544\nAg Sb S\n4 4 8\ndirect\n0.500000 0.000000 0.000000 Ag\n0.023479 -0.000000 0.750000 Ag\n0.500000 -0.000000 0.500000 Ag\n-0.023479 -0.000000 0.250000 Ag\n0.287353 0.507037 0.625439 Sb\n0.780315 0.492962 0.874560 Sb\n0.712646 0.492962 0.374561 Sb\n0.219684 0.507038 0.125440 Sb\n0.282283 0.218567 0.917635 S\n0.063716 0.781432 0.582365 S\n0.717715 0.781432 0.082365 S\n0.936282 0.218568 0.417635 S\n0.501813 0.284244 0.198671 S\n0.782430 0.284244 0.698670 S\n0.498185 0.715756 0.801329 S\n0.217569 0.715756 0.301330 S\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ag",
"Sb",
"S"
],
"chemical_system": "Ag-S-Sb",
"density": 5.151275936334067,
"density_atomic": 0.04224114770981711,
"volume": 378.77758696129126,
"volume_molar": 14.256574658837728,
"formula_full": "Ag4 Sb4 S8",
"formula_reduced": "AgSbS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2175883399999998,
"spacegroup": 15
},
{
"id": "jvasp-53137",
"created_at": "2022-09-04T14:38:13.651247Z",
"updated_at": "2022-09-04T14:38:13.651257Z",
"structure_string": "Na1 Ho2 F7\n1.0\n4.176940 -0.354821 -0.044592\n-1.227836 -4.023758 0.412177\n-0.174903 1.032681 -8.718924\nNa Ho F\n1 2 7\ndirect\n0.077489 0.208072 0.008716 Na\n0.334196 0.753917 0.680870 Ho\n0.586083 0.180566 0.335538 Ho\n0.269541 0.669603 0.907041 F\n0.412485 0.235015 0.606909 F\n0.954291 0.472505 0.509887 F\n0.870447 0.941531 0.750625 F\n0.052156 0.032075 0.259167 F\n0.498087 0.701031 0.409211 F\n0.611889 0.311019 0.115365 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"Ho",
"F"
],
"chemical_system": "F-Ho-Na",
"density": 5.426371342099685,
"density_atomic": 0.06726169876493447,
"volume": 148.67302169913822,
"volume_molar": 8.953298638867446,
"formula_full": "Na1 Ho2 F7",
"formula_reduced": "NaHo2F7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 0.1096676414166671,
"spacegroup": 1
},
{
"id": "jvasp-59112",
"created_at": "2022-09-04T14:38:13.656412Z",
"updated_at": "2022-09-04T14:38:13.656436Z",
"structure_string": "As1 S24 I3\n1.0\n12.590150 -0.035666 -6.975802\n-11.834119 4.297297 -6.975802\n-0.006327 -0.035666 14.393528\nAs S I\n1 24 3\ndirect\n0.295155 0.295155 0.295155 As\n0.176752 0.452669 0.452669 S\n0.638626 0.386382 0.774386 S\n0.386382 0.774386 0.638627 S\n0.386382 0.638626 0.774386 S\n0.638626 0.774386 0.386382 S\n0.774385 0.386382 0.638626 S\n0.637907 0.445461 0.099742 S\n0.445461 0.099741 0.637907 S\n0.099742 0.637907 0.445462 S\n0.099742 0.445461 0.637907 S\n0.445462 0.637907 0.099742 S\n0.637906 0.099741 0.445461 S\n0.761751 0.274437 0.895715 S\n0.274438 0.895716 0.761753 S\n0.274437 0.761752 0.895716 S\n0.761752 0.895716 0.274438 S\n0.895715 0.274437 0.761752 S\n0.010269 0.616432 0.616432 S\n0.616432 0.616432 0.010269 S\n0.616431 0.010268 0.616431 S\n0.774386 0.638626 0.386382 S\n0.452669 0.176752 0.452669 S\n0.452669 0.452669 0.176753 S\n0.895716 0.761752 0.274438 S\n0.954513 0.954513 0.116467 I\n0.116467 0.954513 0.954513 I\n0.954511 0.116466 0.954512 I\n",
"nsites": 28,
"nelements": 3,
"elements": [
"As",
"S",
"I"
],
"chemical_system": "As-I-S",
"density": 2.654602681857701,
"density_atomic": 0.036534506330650474,
"volume": 766.3987504467665,
"volume_molar": 16.48343269099479,
"formula_full": "As1 S24 I3",
"formula_reduced": "As(S8I)3",
"formula_anonymous": "AB3C24",
"energy_above_hull": 2.1441307348214287,
"spacegroup": 160
},
{
"id": "jvasp-43011",
"created_at": "2022-09-04T14:38:13.656957Z",
"updated_at": "2022-09-04T14:38:13.656980Z",
"structure_string": "Li2 Ti1 V3 O8\n1.0\n5.905459 0.042153 0.029807\n2.989236 5.093202 0.029807\n2.989236 1.725836 4.791981\nLi Ti V O\n2 1 3 8\ndirect\n0.125842 0.125842 0.125842 Li\n0.874159 0.874157 0.874159 Li\n0.500001 0.500000 0.500000 Ti\n0.000000 0.500000 0.500000 V\n0.500000 0.000000 0.500000 V\n0.500000 0.499999 0.000001 V\n0.260900 0.260900 0.260900 O\n0.260883 0.260883 0.718848 O\n0.260883 0.718847 0.260883 O\n0.718848 0.260882 0.260883 O\n0.281153 0.739118 0.739118 O\n0.739118 0.281152 0.739118 O\n0.739119 0.739117 0.281153 O\n0.739101 0.739100 0.739101 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Ti",
"V",
"O"
],
"chemical_system": "Li-O-Ti-V",
"density": 3.9799706508109947,
"density_atomic": 0.0979515083642773,
"volume": 142.92786536716335,
"volume_molar": 6.148083741195619,
"formula_full": "Li2 Ti1 V3 O8",
"formula_reduced": "Li2TiV3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.1270613523809527,
"spacegroup": 166
},
{
"id": "jvasp-12551",
"created_at": "2022-09-04T14:38:13.661966Z",
"updated_at": "2022-09-04T14:38:13.661975Z",
"structure_string": "Y1 H3 C3 O6\n1.0\n5.559706 -0.001939 -2.657770\n-4.215818 3.624529 -2.657770\n-0.000719 -0.001939 6.162311\nY H C O\n1 3 3 6\ndirect\n0.004774 0.004774 0.004774 Y\n0.362804 0.362804 0.846795 H\n0.362804 0.846796 0.362804 H\n0.846796 0.362804 0.362804 H\n0.149623 0.611170 0.611170 C\n0.611170 0.149623 0.611170 C\n0.611170 0.611170 0.149623 C\n0.342414 0.594687 0.594687 O\n0.890431 0.283914 0.890430 O\n0.890431 0.890430 0.283914 O\n0.283914 0.890430 0.890430 O\n0.594687 0.342414 0.594687 O\n0.594687 0.594687 0.342414 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Y",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Y",
"density": 2.99740722201945,
"density_atomic": 0.1047787212940862,
"volume": 124.07099303600425,
"volume_molar": 5.747484494583056,
"formula_full": "Y1 H3 C3 O6",
"formula_reduced": "YH3(CO2)3",
"formula_anonymous": "AB3C3D6",
"energy_above_hull": 3.964215111538461,
"spacegroup": 160
},
{
"id": "jvasp-20607",
"created_at": "2022-09-04T14:38:13.666819Z",
"updated_at": "2022-09-04T14:38:13.666829Z",
"structure_string": "Li2 Pt1\n1.0\n2.077293 -3.597977 -0.000000\n2.077293 3.597977 0.000000\n-0.000000 -0.000000 2.682574\nLi Pt\n2 1\ndirect\n0.333332 0.666666 0.499999 Li\n0.666666 0.333332 0.499999 Li\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Pt"
],
"chemical_system": "Li-Pt",
"density": 8.65340200589299,
"density_atomic": 0.07481409169486337,
"volume": 40.09939748030084,
"volume_molar": 8.049473867252033,
"formula_full": "Li2 Pt1",
"formula_reduced": "Li2Pt",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9857438000000004,
"spacegroup": 191
},
{
"id": "jvasp-17620",
"created_at": "2022-09-04T14:38:13.666954Z",
"updated_at": "2022-09-04T14:38:13.666974Z",
"structure_string": "Np1 Si2 Au2\n1.0\n3.983663 0.000000 -1.528881\n-0.586765 3.940213 -1.528881\n0.011626 0.013485 5.984663\nNp Si Au\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Np\n0.611378 0.611379 0.222759 Si\n0.388621 0.388621 0.777241 Si\n0.750000 0.250000 0.500000 Au\n0.249999 0.750000 0.500000 Au\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Np",
"Si",
"Au"
],
"chemical_system": "Au-Np-Si",
"density": 12.124697305057119,
"density_atomic": 0.053133600738611494,
"volume": 94.10241223058247,
"volume_molar": 11.333959446162265,
"formula_full": "Np1 Si2 Au2",
"formula_reduced": "Np(SiAu)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.984152467999999,
"spacegroup": 139
},
{
"id": "jvasp-20465",
"created_at": "2022-09-04T14:38:13.667349Z",
"updated_at": "2022-09-04T14:38:13.667374Z",
"structure_string": "Sr1 Ga4\n1.0\n4.200398 0.000000 -1.608315\n-0.615817 4.155010 -1.608315\n-0.029057 -0.033681 6.213312\nSr Ga\n1 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.618313 0.618313 0.236626 Ga\n0.249999 0.750000 0.500000 Ga\n0.750000 0.250000 0.500001 Ga\n0.381686 0.381687 0.763375 Ga\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Sr",
"Ga"
],
"chemical_system": "Ga-Sr",
"density": 5.636090828260874,
"density_atomic": 0.04630316649340454,
"volume": 107.98397558214953,
"volume_molar": 13.005894015602147,
"formula_full": "Sr1 Ga4",
"formula_reduced": "SrGa4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-18367",
"created_at": "2022-09-04T14:38:13.668878Z",
"updated_at": "2022-09-04T14:38:13.668903Z",
"structure_string": "Rb2 Cr1 Cl4\n1.0\n4.705873 0.000000 -1.458901\n-0.452284 4.684088 -1.458901\n-0.057135 -0.062917 8.134856\nRb Cr Cl\n2 1 4\ndirect\n0.739390 0.739389 0.478780 Rb\n0.260611 0.260610 0.521221 Rb\n0.000000 0.000000 0.000000 Cr\n0.894272 0.394271 0.788543 Cl\n0.394272 0.894271 0.788543 Cl\n0.105730 0.605729 0.211458 Cl\n0.605729 0.105729 0.211458 Cl\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Rb",
"Cr",
"Cl"
],
"chemical_system": "Cl-Cr-Rb",
"density": 3.394057444305375,
"density_atomic": 0.039226569722622756,
"volume": 178.4504750096198,
"volume_molar": 15.352198274239898,
"formula_full": "Rb2 Cr1 Cl4",
"formula_reduced": "Rb2CrCl4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.3660662385714288,
"spacegroup": 139
}
]
}