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=-spacegroup&page=3603",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=3601",
"results": [
{
"id": "jvasp-96923",
"created_at": "2022-09-04T14:36:13.077885Z",
"updated_at": "2022-09-04T14:36:13.077909Z",
"structure_string": "Rb8 Mn4 O16\n1.0\n6.016144 -0.000000 0.000000\n0.000000 7.988886 0.000000\n0.000000 0.000000 10.644667\nRb Mn O\n8 4 16\ndirect\n0.250000 0.482711 0.694164 Rb\n0.250000 0.982711 0.805836 Rb\n0.749999 0.017289 0.194164 Rb\n0.749999 0.517290 0.305836 Rb\n0.749999 0.834332 0.591135 Rb\n0.250000 0.165669 0.408865 Rb\n0.749999 0.334331 0.908865 Rb\n0.250000 0.665669 0.091135 Rb\n0.749999 0.764766 0.920735 Mn\n0.749999 0.264766 0.579265 Mn\n0.250000 0.235235 0.079265 Mn\n0.250000 0.735235 0.420735 Mn\n0.975000 0.688596 0.850803 O\n0.524999 0.688596 0.850803 O\n0.025000 0.311405 0.149197 O\n0.025000 0.811405 0.350803 O\n0.524999 0.188596 0.649198 O\n0.475000 0.311405 0.149197 O\n0.250000 0.528045 0.412169 O\n0.250000 0.798074 0.569849 O\n0.250000 0.028045 0.087831 O\n0.749999 0.971956 0.912170 O\n0.250000 0.298074 0.930151 O\n0.749999 0.701927 0.069849 O\n0.475000 0.811405 0.350803 O\n0.749999 0.201927 0.430151 O\n0.749999 0.471956 0.587831 O\n0.975000 0.188596 0.649198 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Rb",
"Mn",
"O"
],
"chemical_system": "Mn-O-Rb",
"density": 3.763376754750756,
"density_atomic": 0.054729503060909575,
"volume": 511.607057144996,
"volume_molar": 11.003463256916179,
"formula_full": "Rb8 Mn4 O16",
"formula_reduced": "Rb2MnO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.6866473201970442,
"spacegroup": 62
},
{
"id": "jvasp-87881",
"created_at": "2022-09-04T14:36:13.299866Z",
"updated_at": "2022-09-04T14:36:13.299900Z",
"structure_string": "Y8 Hf4 S20\n1.0\n7.245971 -0.000000 0.000000\n-0.000000 7.732003 0.000000\n0.000000 0.000000 11.523752\nY Hf S\n8 4 20\ndirect\n0.023938 0.997506 0.178399 Y\n0.523937 0.002493 0.321601 Y\n0.976062 0.497506 0.821601 Y\n0.476062 0.502493 0.678398 Y\n0.523937 0.497506 0.321601 Y\n0.023938 0.502493 0.178399 Y\n0.476062 0.997506 0.678398 Y\n0.976062 0.002493 0.821601 Y\n0.075713 0.750000 0.494174 Hf\n0.924287 0.250000 0.505826 Hf\n0.424287 0.750000 0.994174 Hf\n0.575713 0.250000 0.005826 Hf\n0.338257 0.463551 0.907174 S\n0.838257 0.536449 0.592826 S\n0.661743 0.963550 0.092826 S\n0.161743 0.036449 0.407174 S\n0.311724 0.750000 0.207484 S\n0.338257 0.036449 0.907174 S\n0.838257 0.963550 0.592826 S\n0.667112 0.750000 0.819004 S\n0.167112 0.250000 0.680996 S\n0.332888 0.250000 0.180996 S\n0.832888 0.750000 0.319004 S\n0.447790 0.750000 0.496681 S\n0.947790 0.250000 0.003318 S\n0.552209 0.250000 0.503318 S\n0.052209 0.750000 0.996681 S\n0.188276 0.750000 0.707484 S\n0.688276 0.250000 0.792516 S\n0.811724 0.250000 0.292516 S\n0.161743 0.463551 0.407174 S\n0.661743 0.536449 0.092826 S\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Y",
"Hf",
"S"
],
"chemical_system": "Hf-S-Y",
"density": 5.3150019400938175,
"density_atomic": 0.04956412796160822,
"volume": 645.628225816599,
"volume_molar": 12.150200170301954,
"formula_full": "Y8 Hf4 S20",
"formula_reduced": "Y2HfS5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.7650167375,
"spacegroup": 62
},
{
"id": "jvasp-86768",
"created_at": "2022-09-04T14:36:13.342502Z",
"updated_at": "2022-09-04T14:36:13.342535Z",
"structure_string": "Zr4 Te4\n1.0\n3.813825 0.000000 0.000000\n0.000000 7.009754 0.000000\n0.000000 0.000000 7.452252\nZr Te\n4 4\ndirect\n0.749999 0.311702 0.991642 Zr\n0.749999 0.188298 0.491642 Zr\n0.250000 0.688297 0.008357 Zr\n0.250000 0.811702 0.508357 Zr\n0.250000 0.425841 0.708375 Te\n0.749999 0.574159 0.291624 Te\n0.250000 0.074159 0.208375 Te\n0.749999 0.925841 0.791624 Te\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Te"
],
"chemical_system": "Te-Zr",
"density": 7.295464871337074,
"density_atomic": 0.040154933992624126,
"volume": 199.22831902723294,
"volume_molar": 14.997262257002287,
"formula_full": "Zr4 Te4",
"formula_reduced": "ZrTe",
"formula_anonymous": "AB",
"energy_above_hull": 1.2936311333333332,
"spacegroup": 62
},
{
"id": "jvasp-43660",
"created_at": "2022-09-04T14:36:13.421364Z",
"updated_at": "2022-09-04T14:36:13.421386Z",
"structure_string": "Na4 Ni4 P4 O16\n1.0\n4.957976 -0.000000 0.000000\n-0.000000 6.137619 0.000000\n0.000000 0.000000 10.117489\nNa Ni P O\n4 4 4 16\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.500000 0.000000 Na\n0.500000 0.000000 0.500000 Na\n0.500000 0.500000 0.500000 Na\n0.511602 0.250000 0.219841 Ni\n0.011601 0.750000 0.280159 Ni\n0.988400 0.250000 0.719841 Ni\n0.488399 0.750000 0.780159 Ni\n0.439958 0.250000 0.892300 P\n0.939958 0.750000 0.607700 P\n0.060043 0.250000 0.392300 P\n0.560043 0.750000 0.107700 P\n0.303934 0.050931 0.820554 O\n0.303934 0.449069 0.820554 O\n0.803935 0.550931 0.679446 O\n0.803935 0.949069 0.679446 O\n0.249338 0.750000 0.613287 O\n0.159855 0.250000 0.537776 O\n0.840146 0.750000 0.462224 O\n0.250663 0.750000 0.113287 O\n0.196066 0.050931 0.320554 O\n0.196066 0.449069 0.320554 O\n0.696067 0.550931 0.179446 O\n0.696067 0.949069 0.179446 O\n0.749338 0.250000 0.886713 O\n0.340146 0.250000 0.037776 O\n0.750663 0.250000 0.386713 O\n0.659855 0.750000 0.962224 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Na",
"Ni",
"P",
"O"
],
"chemical_system": "Na-Ni-O-P",
"density": 3.811156509665747,
"density_atomic": 0.09094544340787679,
"volume": 307.87688696424476,
"volume_molar": 6.621706964461754,
"formula_full": "Na4 Ni4 P4 O16",
"formula_reduced": "NaNiPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.8412258428571429,
"spacegroup": 62
},
{
"id": "jvasp-97798",
"created_at": "2022-09-04T14:36:13.548373Z",
"updated_at": "2022-09-04T14:36:13.548397Z",
"structure_string": "Sm4 Ge4 Ru4\n1.0\n4.515923 -0.000000 0.000000\n-0.000000 7.210849 0.000000\n0.000000 0.000000 7.179220\nSm Ge Ru\n4 4 4\ndirect\n0.250000 0.188450 0.979425 Sm\n0.750000 0.811550 0.020575 Sm\n0.750000 0.688450 0.520575 Sm\n0.250000 0.311550 0.479425 Sm\n0.250000 0.893724 0.302255 Ge\n0.750000 0.106276 0.697745 Ge\n0.750000 0.393724 0.197745 Ge\n0.250000 0.606276 0.802255 Ge\n0.250000 0.566096 0.152927 Ru\n0.750000 0.433904 0.847073 Ru\n0.750000 0.066096 0.347073 Ru\n0.250000 0.933904 0.652927 Ru\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sm",
"Ge",
"Ru"
],
"chemical_system": "Ge-Ru-Sm",
"density": 9.207415171591098,
"density_atomic": 0.05132997520743319,
"volume": 233.78152729483995,
"volume_molar": 11.732210537144237,
"formula_full": "Sm4 Ge4 Ru4",
"formula_reduced": "SmGeRu",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7937517749999998,
"spacegroup": 62
},
{
"id": "jvasp-96748",
"created_at": "2022-09-04T14:36:13.588877Z",
"updated_at": "2022-09-04T14:36:13.588907Z",
"structure_string": "Ba4 Cr4 O16\n1.0\n5.548128 0.000000 0.000000\n-0.000000 7.369234 0.000000\n0.000000 0.000000 9.173283\nBa Cr O\n4 4 16\ndirect\n0.250000 0.156059 0.183551 Ba\n0.750000 0.656059 0.316449 Ba\n0.250000 0.343941 0.683551 Ba\n0.750000 0.843940 0.816449 Ba\n0.250000 0.805596 0.557932 Cr\n0.750000 0.194403 0.442068 Cr\n0.750000 0.305596 0.942068 Cr\n0.250000 0.694403 0.057932 Cr\n0.250000 0.533547 0.183776 O\n0.750000 0.466453 0.816223 O\n0.750000 0.033547 0.316224 O\n0.250000 0.966453 0.683776 O\n0.507053 0.175998 0.918670 O\n0.750000 0.113808 0.610078 O\n0.250000 0.886192 0.389922 O\n0.007053 0.675997 0.581330 O\n0.507053 0.324002 0.418670 O\n0.992948 0.175998 0.918670 O\n0.492947 0.824002 0.081330 O\n0.992948 0.324002 0.418670 O\n0.492947 0.675997 0.581330 O\n0.007053 0.824002 0.081330 O\n0.750000 0.386192 0.110078 O\n0.250000 0.613808 0.889921 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ba",
"Cr",
"O"
],
"chemical_system": "Ba-Cr-O",
"density": 4.486277743954665,
"density_atomic": 0.06399081339634714,
"volume": 375.05383548336044,
"volume_molar": 9.41094579107783,
"formula_full": "Ba4 Cr4 O16",
"formula_reduced": "BaCrO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.1887212283333333,
"spacegroup": 62
},
{
"id": "jvasp-14116",
"created_at": "2022-09-04T14:36:13.859281Z",
"updated_at": "2022-09-04T14:36:13.859307Z",
"structure_string": "Y4 F12\n1.0\n4.402399 0.000000 0.000000\n-0.000000 6.407153 0.000000\n0.000000 0.000000 6.900399\nY F\n4 12\ndirect\n0.938406 0.631208 0.750000 Y\n0.438406 0.868791 0.250000 Y\n0.561594 0.131208 0.750000 Y\n0.061594 0.368791 0.250000 Y\n0.379269 0.165479 0.437008 F\n0.879269 0.334521 0.562992 F\n0.120732 0.665479 0.062992 F\n0.620732 0.834520 0.937008 F\n0.588570 0.522426 0.250000 F\n0.088569 0.977574 0.750000 F\n0.911431 0.022426 0.250000 F\n0.411431 0.477574 0.750000 F\n0.379269 0.165479 0.062992 F\n0.879269 0.334521 0.937008 F\n0.120732 0.665479 0.437008 F\n0.620732 0.834520 0.562992 F\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Y",
"F"
],
"chemical_system": "F-Y",
"density": 4.978962268797482,
"density_atomic": 0.08220368437074525,
"volume": 194.63847785506437,
"volume_molar": 7.325876943470878,
"formula_full": "Y4 F12",
"formula_reduced": "YF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-42760",
"created_at": "2022-09-04T14:36:13.872635Z",
"updated_at": "2022-09-04T14:36:13.872662Z",
"structure_string": "Na8 V4 O12\n1.0\n5.297762 -0.000000 0.000000\n0.000000 6.075508 0.000000\n0.000000 0.000000 9.209523\nNa V O\n8 4 12\ndirect\n0.763906 0.391319 0.418871 Na\n0.763906 0.391319 0.081129 Na\n0.736093 0.891319 0.581129 Na\n0.736093 0.891319 0.918871 Na\n0.263906 0.108681 0.081129 Na\n0.263906 0.108681 0.418871 Na\n0.236093 0.608681 0.581129 Na\n0.236093 0.608681 0.918871 Na\n0.277685 0.146650 0.750000 V\n0.222315 0.646650 0.250000 V\n0.777685 0.353351 0.750000 V\n0.722314 0.853351 0.250000 V\n0.004713 0.210954 0.614764 O\n0.995287 0.789047 0.114765 O\n0.995287 0.789047 0.385235 O\n0.867788 0.625404 0.750000 O\n0.632212 0.125404 0.250000 O\n0.504713 0.289047 0.885235 O\n0.504713 0.289047 0.614764 O\n0.495287 0.710954 0.114765 O\n0.495287 0.710954 0.385235 O\n0.367788 0.874596 0.750000 O\n0.132212 0.374596 0.250000 O\n0.004713 0.210954 0.885235 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Na",
"V",
"O"
],
"chemical_system": "Na-O-V",
"density": 3.247304052332348,
"density_atomic": 0.08096532507928675,
"volume": 296.42319074860217,
"volume_molar": 7.4379257467350515,
"formula_full": "Na8 V4 O12",
"formula_reduced": "Na2VO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.5013037833333334,
"spacegroup": 62
},
{
"id": "jvasp-91375",
"created_at": "2022-09-04T14:36:13.992489Z",
"updated_at": "2022-09-04T14:36:13.992498Z",
"structure_string": "Tl8 Se4 O16\n1.0\n5.940854 0.000000 0.000000\n0.000000 7.997920 0.000000\n0.000000 0.000000 11.178520\nTl Se O\n8 4 16\ndirect\n0.750000 0.027411 0.282699 Tl\n0.750000 0.527411 0.217301 Tl\n0.250000 0.472589 0.782699 Tl\n0.750000 0.823406 0.907212 Tl\n0.250000 0.176594 0.092788 Tl\n0.750000 0.323406 0.592788 Tl\n0.250000 0.676594 0.407212 Tl\n0.250000 0.972589 0.717301 Tl\n0.750000 0.774738 0.571140 Se\n0.250000 0.225262 0.428860 Se\n0.750000 0.274738 0.928860 Se\n0.250000 0.725262 0.071140 Se\n0.016883 0.819229 0.123963 O\n0.516883 0.180771 0.876037 O\n0.250000 0.523377 0.110376 O\n0.016883 0.319229 0.376037 O\n0.516883 0.680771 0.623963 O\n0.483116 0.819229 0.123963 O\n0.983116 0.180771 0.876037 O\n0.750000 0.750945 0.421266 O\n0.250000 0.249055 0.578734 O\n0.750000 0.250945 0.078734 O\n0.250000 0.749055 0.921266 O\n0.750000 0.976623 0.610376 O\n0.250000 0.023377 0.389624 O\n0.750000 0.476623 0.889624 O\n0.983116 0.680771 0.623963 O\n0.483116 0.319229 0.376037 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Tl",
"Se",
"O"
],
"chemical_system": "O-Se-Tl",
"density": 6.8995517915676565,
"density_atomic": 0.05271664802606555,
"volume": 531.1415093417074,
"volume_molar": 11.423603331195062,
"formula_full": "Tl8 Se4 O16",
"formula_reduced": "Tl2SeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.4636603666666663,
"spacegroup": 62
},
{
"id": "jvasp-90863",
"created_at": "2022-09-04T14:36:14.067273Z",
"updated_at": "2022-09-04T14:36:14.067297Z",
"structure_string": "Nd4 Pt4\n1.0\n0.000000 4.599138 -0.000000\n0.000000 0.000000 5.740956\n7.352319 0.000000 0.000000\nNd Pt\n4 4\ndirect\n0.250000 0.358191 0.683140 Nd\n0.250000 0.141810 0.183140 Nd\n0.750000 0.641810 0.316860 Nd\n0.750000 0.858191 0.816860 Nd\n0.250000 0.843018 0.545188 Pt\n0.250000 0.656983 0.045188 Pt\n0.750000 0.156983 0.454812 Pt\n0.750000 0.343018 0.954812 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nd",
"Pt"
],
"chemical_system": "Nd-Pt",
"density": 11.610240746317992,
"density_atomic": 0.041210225008385296,
"volume": 194.12657898306043,
"volume_molar": 14.613219798665595,
"formula_full": "Nd4 Pt4",
"formula_reduced": "NdPt",
"formula_anonymous": "AB",
"energy_above_hull": 0.80727145,
"spacegroup": 62
},
{
"id": "jvasp-98746",
"created_at": "2022-09-04T14:36:14.257866Z",
"updated_at": "2022-09-04T14:36:14.257885Z",
"structure_string": "Ho4 B28 Mo12\n1.0\n3.098765 -0.000000 0.000000\n-0.000000 11.025176 0.000000\n0.000000 0.000000 12.906663\nHo B Mo\n4 28 12\ndirect\n0.750001 0.949629 0.308291 Ho\n0.250000 0.050372 0.691709 Ho\n0.750001 0.449629 0.191709 Ho\n0.250000 0.550372 0.808291 Ho\n0.250000 0.314760 0.067191 B\n0.750001 0.185240 0.567191 B\n0.250000 0.814761 0.432809 B\n0.750001 0.567945 0.383921 B\n0.250000 0.432055 0.616079 B\n0.750001 0.067945 0.116079 B\n0.250000 0.932055 0.883921 B\n0.750001 0.537394 0.981655 B\n0.750001 0.037393 0.518345 B\n0.750001 0.685240 0.932808 B\n0.250000 0.962607 0.481655 B\n0.750001 0.751127 0.173580 B\n0.250000 0.248873 0.826420 B\n0.750001 0.251127 0.326420 B\n0.250000 0.748873 0.673580 B\n0.750001 0.731145 0.418266 B\n0.250000 0.268855 0.581734 B\n0.250000 0.462607 0.018345 B\n0.250000 0.835232 0.167623 B\n0.250000 0.335232 0.332376 B\n0.750001 0.231145 0.081734 B\n0.750001 0.164768 0.832376 B\n0.750001 0.510016 0.638319 B\n0.250000 0.489985 0.361681 B\n0.250000 0.768855 0.918266 B\n0.250000 0.989985 0.138319 B\n0.750001 0.664768 0.667623 B\n0.750001 0.010016 0.861681 B\n0.250000 0.617543 0.526955 Mo\n0.750001 0.382458 0.473045 Mo\n0.250000 0.117543 0.973045 Mo\n0.250000 0.660021 0.064834 Mo\n0.750001 0.339979 0.935166 Mo\n0.250000 0.160021 0.435166 Mo\n0.750001 0.839979 0.564834 Mo\n0.250000 0.685142 0.297527 Mo\n0.750001 0.314858 0.702473 Mo\n0.250000 0.185142 0.202473 Mo\n0.750001 0.814858 0.797527 Mo\n0.750001 0.882458 0.026955 Mo\n",
"nsites": 44,
"nelements": 3,
"elements": [
"Ho",
"B",
"Mo"
],
"chemical_system": "B-Ho-Mo",
"density": 7.959874271260049,
"density_atomic": 0.09978483254990585,
"volume": 440.94877824236545,
"volume_molar": 6.035126387558069,
"formula_full": "Ho4 B28 Mo12",
"formula_reduced": "HoB7Mo3",
"formula_anonymous": "AB3C7",
"energy_above_hull": 5.528161031818181,
"spacegroup": 62
},
{
"id": "jvasp-98352",
"created_at": "2022-09-04T14:36:14.344061Z",
"updated_at": "2022-09-04T14:36:14.344078Z",
"structure_string": "Ba8 P8 O28\n1.0\n9.354704 -0.000000 0.000000\n0.000000 5.640821 0.000000\n0.000000 0.000000 13.869698\nBa P O\n8 8 28\ndirect\n0.363884 0.250000 0.083124 Ba\n0.863884 0.250000 0.416876 Ba\n0.636115 0.750000 0.916876 Ba\n0.136116 0.750000 0.583124 Ba\n0.340778 0.250000 0.754247 Ba\n0.840778 0.250000 0.745753 Ba\n0.659221 0.750000 0.245753 Ba\n0.159222 0.750000 0.254247 Ba\n0.545459 0.750000 0.683368 P\n0.454541 0.250000 0.316632 P\n0.954541 0.250000 0.183368 P\n0.045459 0.750000 0.816632 P\n0.280895 0.750000 0.957863 P\n0.219105 0.250000 0.457863 P\n0.719105 0.250000 0.042137 P\n0.780894 0.750000 0.542137 P\n0.614810 0.750000 0.575162 O\n0.904873 0.025021 0.235879 O\n0.404874 0.474979 0.264121 O\n0.095126 0.525021 0.764121 O\n0.595126 0.974979 0.735879 O\n0.595126 0.525021 0.735879 O\n0.904873 0.474979 0.235879 O\n0.404874 0.025021 0.264121 O\n0.115662 0.250000 0.167334 O\n0.615662 0.250000 0.332666 O\n0.114810 0.750000 0.924838 O\n0.095126 0.974979 0.764121 O\n0.385190 0.250000 0.424838 O\n0.854663 0.526081 0.581214 O\n0.777112 0.750000 0.431554 O\n0.277112 0.750000 0.068446 O\n0.222888 0.250000 0.568446 O\n0.722887 0.250000 0.931554 O\n0.145337 0.026081 0.418787 O\n0.645337 0.473919 0.081214 O\n0.884338 0.750000 0.832666 O\n0.354663 0.973919 0.918787 O\n0.854663 0.973919 0.581214 O\n0.354663 0.526081 0.918787 O\n0.145337 0.473919 0.418787 O\n0.645337 0.026081 0.081214 O\n0.885190 0.250000 0.075162 O\n0.384338 0.750000 0.667334 O\n",
"nsites": 44,
"nelements": 3,
"elements": [
"Ba",
"P",
"O"
],
"chemical_system": "Ba-O-P",
"density": 4.071237085043991,
"density_atomic": 0.06011921525000834,
"volume": 731.8791474077649,
"volume_molar": 10.016998284087158,
"formula_full": "Ba8 P8 O28",
"formula_reduced": "Ba2P2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.191717949090909,
"spacegroup": 62
}
]
}