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=created_at&page=3563",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=created_at&page=3561",
"results": [
{
"id": "jvasp-12762",
"created_at": "2022-09-04T14:38:13.209152Z",
"updated_at": "2022-09-04T14:38:13.209185Z",
"structure_string": "Pa2 Cl10\n1.0\n6.786320 -0.047537 -1.103565\n-2.564879 6.283135 -1.103565\n-0.040652 -0.060048 8.447630\nPa Cl\n2 10\ndirect\n0.073153 0.926848 0.250001 Pa\n0.926847 0.073152 0.750000 Pa\n0.147295 0.884341 0.938929 Cl\n0.115659 0.852706 0.561072 Cl\n0.704456 0.295544 0.750000 Cl\n0.295545 0.704456 0.250001 Cl\n0.599685 0.737652 0.655667 Cl\n0.262348 0.400315 0.844334 Cl\n0.400315 0.262348 0.344334 Cl\n0.737652 0.599685 0.155667 Cl\n0.884341 0.147294 0.438929 Cl\n0.852705 0.115659 0.061072 Cl\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Pa",
"Cl"
],
"chemical_system": "Cl-Pa",
"density": 3.78487470485961,
"density_atomic": 0.033494488044460966,
"volume": 358.2679031866695,
"volume_molar": 17.97949785650147,
"formula_full": "Pa2 Cl10",
"formula_reduced": "PaCl5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.6643755729166666,
"spacegroup": 15
},
{
"id": "jvasp-53185",
"created_at": "2022-09-04T14:38:13.212340Z",
"updated_at": "2022-09-04T14:38:13.212361Z",
"structure_string": "Y3 U2 O10\n1.0\n5.343926 0.002075 0.001090\n2.668055 5.890657 -0.016245\n2.669300 0.152540 6.050642\nY U O\n3 2 10\ndirect\n0.002274 0.997489 0.995897 Y\n0.399779 0.798987 0.399364 Y\n0.797315 0.600485 0.802830 Y\n0.200996 0.400612 0.195369 U\n0.598600 0.197361 0.603357 U\n0.453635 0.914438 0.691251 O\n0.860876 0.683549 0.107567 O\n0.938729 0.914402 0.691201 O\n0.255709 0.483517 0.503327 O\n0.345990 0.683558 0.107430 O\n0.634320 0.298927 0.899401 O\n0.754941 0.483475 0.503451 O\n0.044593 0.114488 0.295312 O\n0.165250 0.299044 0.899328 O\n0.543849 0.114467 0.295365 O\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Y",
"U",
"O"
],
"chemical_system": "O-U-Y",
"density": 7.87199392121895,
"density_atomic": 0.07876805036898979,
"volume": 190.43254123635583,
"volume_molar": 7.6454104573989285,
"formula_full": "Y3 U2 O10",
"formula_reduced": "Y3U2O10",
"formula_anonymous": "A2B3C10",
"energy_above_hull": 3.45818489,
"spacegroup": 12
},
{
"id": "jvasp-17182",
"created_at": "2022-09-04T14:38:13.214382Z",
"updated_at": "2022-09-04T14:38:13.214408Z",
"structure_string": "Hg1 Te1\n1.0\n3.813669 0.000000 0.000000\n-0.000000 3.813669 0.000000\n0.000000 0.000000 3.813669\nHg Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hg",
"Te"
],
"chemical_system": "Hg-Te",
"density": 9.825291670485901,
"density_atomic": 0.03605794781569779,
"volume": 55.4662736277327,
"volume_molar": 16.70128536094411,
"formula_full": "Hg1 Te1",
"formula_reduced": "HgTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.15325,
"spacegroup": 221
},
{
"id": "jvasp-36806",
"created_at": "2022-09-04T14:38:13.218951Z",
"updated_at": "2022-09-04T14:38:13.218965Z",
"structure_string": "Ag2 As2 O4\n1.0\n2.551539 3.145221 1.959806\n-0.030194 0.044610 -5.196979\n-5.608525 3.204289 2.159485\nAg As O\n2 2 4\ndirect\n0.366661 0.768135 0.168154 Ag\n0.598526 0.231863 0.831845 Ag\n0.263647 0.671868 0.667567 As\n0.591778 0.328131 0.332431 As\n0.201971 0.446749 0.821830 O\n0.755221 0.553250 0.178169 O\n0.824982 0.581022 0.598681 O\n0.243958 0.418976 0.401318 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ag",
"As",
"O"
],
"chemical_system": "Ag-As-O",
"density": 5.28719825233319,
"density_atomic": 0.05929598146750764,
"volume": 134.91639402888967,
"volume_molar": 10.156068945919964,
"formula_full": "Ag2 As2 O4",
"formula_reduced": "AgAsO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5017940025,
"spacegroup": 5
},
{
"id": "jvasp-43697",
"created_at": "2022-09-04T14:38:13.220727Z",
"updated_at": "2022-09-04T14:38:13.220746Z",
"structure_string": "V4 O4 F12\n1.0\n5.633924 0.077047 0.010981\n2.438971 6.899327 0.605030\n2.501046 1.638218 6.707326\nV O F\n4 4 12\ndirect\n0.246927 0.223347 0.223304 V\n0.811879 0.723631 0.723669 V\n0.566786 0.469724 0.469736 V\n0.052269 0.973701 0.973691 V\n0.135641 0.119428 0.119403 O\n0.347552 0.876175 0.876157 O\n0.866265 0.369140 0.369119 O\n0.113797 0.633747 0.633771 O\n0.734963 0.548637 0.971170 F\n0.382699 0.381252 0.381228 F\n0.866264 0.876942 0.876954 F\n0.587577 0.136976 0.136904 F\n0.498156 0.302357 0.721672 F\n0.225459 0.475933 0.055821 F\n0.653213 0.617559 0.617650 F\n0.735053 0.971115 0.548655 F\n0.225377 0.055864 0.475891 F\n0.975899 0.800643 0.222152 F\n0.498244 0.721685 0.302428 F\n-0.024026 0.222154 0.800633 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.242973306259856,
"density_atomic": 0.07878915112391292,
"volume": 253.84205458116548,
"volume_molar": 7.643362917476907,
"formula_full": "V4 O4 F12",
"formula_reduced": "VOF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.8039637094999998,
"spacegroup": 8
},
{
"id": "jvasp-98944",
"created_at": "2022-09-04T14:38:13.224458Z",
"updated_at": "2022-09-04T14:38:13.224487Z",
"structure_string": "Mo4 H24 N4 O12 F8\n1.0\n4.277241 6.830653 -1.817842\n-4.277241 6.830653 1.817842\n0.009967 0.000000 7.891781\nMo H N O F\n4 24 4 12 8\ndirect\n0.984886 0.716570 0.739157 Mo\n0.716571 0.984885 0.760843 Mo\n0.015114 0.283429 0.260843 Mo\n0.283429 0.015114 0.239157 Mo\n0.666754 0.751749 0.327416 H\n0.751749 0.666754 0.172584 H\n0.248251 0.333245 0.827416 H\n0.806579 0.076629 0.368703 H\n0.076629 0.806578 0.131297 H\n0.193421 0.923370 0.631297 H\n0.923371 0.193421 0.868703 H\n0.757969 0.133367 0.145248 H\n0.133367 0.757969 0.354752 H\n0.242031 0.866632 0.854752 H\n0.866632 0.242031 0.645248 H\n0.333245 0.248250 0.672584 H\n0.885669 0.706843 0.338702 H\n0.706843 0.885669 0.161298 H\n0.630739 0.528290 0.865647 H\n0.369261 0.471709 0.134353 H\n0.471709 0.369261 0.365647 H\n0.577922 0.407698 0.733353 H\n0.528291 0.630738 0.634353 H\n0.422078 0.592301 0.266647 H\n0.592301 0.422078 0.233353 H\n0.114331 0.293156 0.661298 H\n0.293157 0.114330 0.838702 H\n0.407699 0.577921 0.766647 H\n0.535498 0.535497 0.750000 N\n0.464502 0.464502 0.250000 N\n0.246535 0.246534 0.750000 N\n0.753465 0.753465 0.250000 N\n0.158093 0.811701 0.243478 O\n0.197834 0.048874 0.446096 O\n0.811701 0.158093 0.256522 O\n0.841907 0.188298 0.756522 O\n0.188299 0.841906 0.743478 O\n0.048874 0.197833 0.053904 O\n0.568874 0.888247 0.767485 O\n0.951126 0.802166 0.946096 O\n0.431126 0.111752 0.232515 O\n0.111752 0.431126 0.267485 O\n0.888248 0.568873 0.732515 O\n0.802166 0.951125 0.553904 O\n0.762198 0.491401 0.086613 F\n0.089309 0.662146 0.532530 F\n0.662146 0.089309 0.967470 F\n0.910690 0.337853 0.467470 F\n0.337854 0.910690 0.032530 F\n0.237802 0.508599 0.913387 F\n0.508599 0.237801 0.586613 F\n0.491401 0.762198 0.413387 F\n",
"nsites": 52,
"nelements": 5,
"elements": [
"Mo",
"H",
"N",
"O",
"F"
],
"chemical_system": "F-H-Mo-N-O",
"density": 2.9078602926521535,
"density_atomic": 0.11270399951382278,
"volume": 461.3855783673619,
"volume_molar": 5.3433248030043545,
"formula_full": "Mo4 H24 N4 O12 F8",
"formula_reduced": "MoH6NO3F2",
"formula_anonymous": "ABC2D3E6",
"energy_above_hull": 3.060632324230769,
"spacegroup": 15
},
{
"id": "jvasp-18016",
"created_at": "2022-09-04T14:38:13.224844Z",
"updated_at": "2022-09-04T14:38:13.224862Z",
"structure_string": "Mn2 V1 Ga1\n1.0\n3.553486 -0.000000 2.051607\n1.184495 3.350259 2.051607\n-0.000000 -0.000000 4.103212\nMn V Ga\n2 1 1\ndirect\n0.250001 0.250000 0.250000 Mn\n0.750002 0.750000 0.750000 Mn\n0.500001 0.500000 0.500000 V\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"V",
"Ga"
],
"chemical_system": "Ga-Mn-V",
"density": 7.836814198370917,
"density_atomic": 0.08188475309942705,
"volume": 48.84914283301403,
"volume_molar": 7.354410353643892,
"formula_full": "Mn2 V1 Ga1",
"formula_reduced": "Mn2VGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.043920251939655,
"spacegroup": 225
},
{
"id": "jvasp-53186",
"created_at": "2022-09-04T14:38:13.228821Z",
"updated_at": "2022-09-04T14:38:13.228854Z",
"structure_string": "Lu1 Cu1 Se2\n1.0\n2.014756 -3.489659 -0.000000\n2.014756 3.489659 0.000000\n-0.000000 0.000000 6.391292\nLu Cu Se\n1 1 2\ndirect\n0.000000 0.000000 0.798853 Lu\n0.666668 0.333334 0.188738 Cu\n0.333334 0.666668 0.063119 Se\n0.666668 0.333334 0.568489 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Cu",
"Se"
],
"chemical_system": "Cu-Lu-Se",
"density": 7.324783494545687,
"density_atomic": 0.0445077753425397,
"volume": 89.87193741352593,
"volume_molar": 13.530536436954087,
"formula_full": "Lu1 Cu1 Se2",
"formula_reduced": "LuCuSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6160257333333333,
"spacegroup": 156
},
{
"id": "jvasp-16517",
"created_at": "2022-09-04T14:38:13.232100Z",
"updated_at": "2022-09-04T14:38:13.232126Z",
"structure_string": "Tm2 Ga4 Pd2\n1.0\n4.397400 0.000000 0.000000\n-2.198700 5.019518 -0.000000\n0.000000 -0.000000 6.555270\nTm Ga Pd\n2 4 2\ndirect\n0.089374 0.178749 0.750000 Tm\n0.910626 0.821252 0.250000 Tm\n0.373881 0.747763 0.948267 Ga\n0.626119 0.252238 0.051733 Ga\n0.626119 0.252238 0.448267 Ga\n0.373881 0.747763 0.551733 Ga\n0.800579 0.601158 0.750000 Pd\n0.199421 0.398842 0.250000 Pd\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tm",
"Ga",
"Pd"
],
"chemical_system": "Ga-Pd-Tm",
"density": 9.520713325230744,
"density_atomic": 0.05528934115048879,
"volume": 144.69335017440835,
"volume_molar": 10.892046522328222,
"formula_full": "Tm2 Ga4 Pd2",
"formula_reduced": "TmGa2Pd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3379936500000001,
"spacegroup": 63
},
{
"id": "jvasp-32134",
"created_at": "2022-09-04T14:38:13.234083Z",
"updated_at": "2022-09-04T14:38:13.234099Z",
"structure_string": "Sn2 Cl2\n1.0\n1.736838 -3.008289 -0.000000\n1.736838 3.008289 0.000000\n0.000000 -0.000000 10.149696\nSn Cl\n2 2\ndirect\n0.000000 0.000000 0.313493 Sn\n0.333335 0.666667 0.813493 Sn\n0.000000 0.000000 0.061508 Cl\n0.333335 0.666667 0.561507 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sn",
"Cl"
],
"chemical_system": "Cl-Sn",
"density": 4.827222841406537,
"density_atomic": 0.03771360889562783,
"volume": 106.0625094530193,
"volume_molar": 15.968084032122823,
"formula_full": "Sn2 Cl2",
"formula_reduced": "SnCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.007585425,
"spacegroup": 186
},
{
"id": "jvasp-17890",
"created_at": "2022-09-04T14:38:13.236402Z",
"updated_at": "2022-09-04T14:38:13.236418Z",
"structure_string": "Tb3 Pb1 C1\n1.0\n5.668313 0.000000 -0.000000\n-0.000000 5.668313 -0.000000\n0.000000 0.000000 5.668313\nTb Pb C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Tb\n0.500000 0.500000 0.000000 Tb\n0.500000 0.000000 0.500000 Tb\n0.500000 0.500000 0.500000 Pb\n0.000000 0.000000 0.000000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tb",
"Pb",
"C"
],
"chemical_system": "C-Pb-Tb",
"density": 6.345832406831818,
"density_atomic": 0.02745418357929749,
"volume": 182.12160582223157,
"volume_molar": 21.93523891397428,
"formula_full": "Tb3 Pb1 C1",
"formula_reduced": "Tb3PbC",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.5705312040000003,
"spacegroup": 221
},
{
"id": "jvasp-18158",
"created_at": "2022-09-04T14:38:13.238334Z",
"updated_at": "2022-09-04T14:38:13.238352Z",
"structure_string": "Pu4 Pd4\n1.0\n4.792238 -0.000000 0.000000\n-0.000000 4.793126 0.000000\n0.000000 0.000000 6.780208\nPu Pd\n4 4\ndirect\n0.750000 0.999875 0.124996 Pu\n0.250000 0.000126 0.875004 Pu\n0.250000 0.500126 0.624996 Pu\n0.750000 0.499875 0.375004 Pu\n0.750000 0.999884 0.625013 Pd\n0.250000 0.000116 0.374987 Pd\n0.250000 0.500117 0.125013 Pd\n0.750000 0.499884 0.874987 Pd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pu",
"Pd"
],
"chemical_system": "Pd-Pu",
"density": 14.945062398551618,
"density_atomic": 0.05136765564874356,
"volume": 155.7400254881143,
"volume_molar": 11.723604443192649,
"formula_full": "Pu4 Pd4",
"formula_reduced": "PuPd",
"formula_anonymous": "AB",
"energy_above_hull": 2.96789285,
"spacegroup": 227
}
]
}