{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-id&page=492","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-id&page=490","results":[{"id":"jvasp-87262","created_at":"2022-09-04T14:36:15.645038Z","updated_at":"2022-09-04T14:36:15.645059Z","structure_string":"Li3 Al1 Mo2 As2 O14\n1.0\n5.088432 -0.078471 -1.081414\n-1.669379 5.173451 -0.572711\n0.046023 0.002218 9.478133\nLi Al Mo As O\n3 1 2 2 14\ndirect\n0.183795 0.384005 0.818398 Li\n0.816204 0.615996 0.181602 Li\n-0.000000 0.500000 0.500000 Li\n0.500000 0.000000 0.000000 Al\n0.497018 0.837241 0.354634 Mo\n0.502981 0.162760 0.645366 Mo\n0.155295 0.226582 0.176752 As\n0.844704 0.773418 0.823249 As\n0.720210 0.667833 0.410477 O\n0.441232 0.136959 0.823474 O\n0.844995 0.497366 0.709295 O\n0.279789 0.332167 0.589523 O\n0.867494 0.026037 0.729807 O\n0.155004 0.502634 0.290705 O\n0.446046 0.296244 0.108451 O\n0.558767 0.863042 0.176526 O\n0.322035 0.835253 0.538909 O\n0.677964 0.164747 0.461092 O\n0.124582 0.805012 0.963379 O\n0.553953 0.703757 0.891549 O\n0.875417 0.194989 0.036621 O\n0.132505 0.973963 0.270193 O\n","nsites":22,"nelements":5,"elements":["Li","Al","Mo","As","O"],"chemical_system":"Al-As-Li-Mo-O","density":4.099063966562173,"density_atomic":0.08851767991964382,"volume":248.5379194300117,"volume_molar":6.803319704568497,"formula_full":"Li3 Al1 Mo2 As2 O14","formula_reduced":"Li3AlMo2(AsO7)2","formula_anonymous":"AB2C2D3E14","energy_above_hull":3.030784868181818,"spacegroup":2},{"id":"jvasp-87261","created_at":"2022-09-04T14:36:08.245478Z","updated_at":"2022-09-04T14:36:08.245504Z","structure_string":"K4 Ni2 N8 O24\n1.0\n6.402048 -0.000000 -2.684890\n-0.535850 8.949843 -1.277720\n0.046639 -0.016358 9.086412\nK Ni N O\n4 2 8 24\ndirect\n0.101093 0.282940 0.520401 K\n0.419308 0.782940 0.520401 K\n0.432302 0.352258 0.120209 K\n0.687907 0.852258 0.120209 K\n0.038042 0.676947 0.760599 Ni\n0.722557 0.176947 0.760599 Ni\n0.137403 0.712119 0.122469 N\n0.480354 0.081038 0.873889 N\n0.393535 0.581038 0.873888 N\n0.871884 0.599523 0.406936 N\n0.985067 0.212119 0.122469 N\n0.535053 0.099523 0.406936 N\n0.002127 0.974704 0.666043 N\n0.663917 0.474704 0.666043 N\n0.928371 0.882519 0.727300 O\n0.731006 0.609101 0.672696 O\n0.127397 0.941850 0.600840 O\n0.358652 0.714521 0.839078 O\n0.229029 0.494259 0.832153 O\n0.015398 0.736875 0.981003 O\n0.471776 0.986583 0.300167 O\n0.158155 0.250575 0.236636 O\n0.473444 0.441850 0.600840 O\n0.603125 0.994259 0.832153 O\n0.078481 0.750575 0.236636 O\n0.798930 0.382519 0.727300 O\n0.480427 0.214521 0.839078 O\n0.941691 0.109102 0.672696 O\n0.308287 0.653537 0.145470 O\n0.965606 0.236875 0.981003 O\n0.837184 0.153537 0.145470 O\n0.765137 0.711634 0.392583 O\n0.375922 0.043577 0.947398 O\n0.037557 0.596062 0.538488 O\n0.500932 0.096062 0.538488 O\n0.627447 0.211634 0.392583 O\n0.828391 0.486583 0.300167 O\n0.571476 0.543577 0.947398 O\n","nsites":38,"nelements":4,"elements":["K","Ni","N","O"],"chemical_system":"K-N-Ni-O","density":2.450801842128444,"density_atomic":0.07285409347858277,"volume":521.5904582104371,"volume_molar":8.266029364253026,"formula_full":"K4 Ni2 N8 O24","formula_reduced":"K2Ni(NO3)4","formula_anonymous":"AB2C4D12","energy_above_hull":3.1946628105263155,"spacegroup":9},{"id":"jvasp-8726","created_at":"2022-09-04T14:36:36.865932Z","updated_at":"2022-09-04T14:36:36.865958Z","structure_string":"Li5 Sn2\n1.0\n4.435401 0.006473 5.554294\n1.950134 3.983693 5.554294\n0.010358 0.006473 7.107944\nLi Sn\n5 2\ndirect\n0.500000 0.499999 0.500000 Li\n0.355297 0.355296 0.355297 Li\n0.644703 0.644702 0.644703 Li\n0.214563 0.214563 0.214563 Li\n0.785437 0.785435 0.785437 Li\n0.074184 0.074184 0.074184 Sn\n0.925816 0.925814 0.925815 Sn\n","nsites":7,"nelements":2,"elements":["Li","Sn"],"chemical_system":"Li-Sn","density":3.6096705546305543,"density_atomic":0.05591754131118878,"volume":125.18433099631547,"volume_molar":10.769680888660613,"formula_full":"Li5 Sn2","formula_reduced":"Li5Sn2","formula_anonymous":"A2B5","energy_above_hull":0.6398333428571429,"spacegroup":166},{"id":"jvasp-87256","created_at":"2022-09-04T14:36:04.789647Z","updated_at":"2022-09-04T14:36:04.789674Z","structure_string":"Mn8 F32\n1.0\n5.538455 -0.000356 1.908685\n2.769717 9.006001 0.954118\n-0.165760 0.000092 9.469126\nMn F\n8 32\ndirect\n0.610545 0.242503 0.500649 Mn\n0.111204 -0.000656 0.242501 Mn\n0.353048 0.500663 0.257488 Mn\n0.353711 0.257487 -0.000667 Mn\n0.389455 0.757496 0.499351 Mn\n0.888795 0.000655 0.757499 Mn\n0.646952 0.499337 0.742512 Mn\n0.646289 0.742512 0.000667 Mn\n0.923007 0.890911 0.336802 F\n0.150736 0.609090 0.163165 F\n0.259833 0.163147 0.890913 F\n0.686082 0.663166 0.390942 F\n0.076993 0.109088 0.663198 F\n0.849264 0.390910 0.836835 F\n0.146452 0.407434 0.362906 F\n0.509387 0.137053 0.407427 F\n0.916813 0.092571 0.137063 F\n0.313919 0.336834 0.609058 F\n0.053893 0.362939 0.092532 F\n0.490613 0.862947 0.592573 F\n0.083187 0.907428 0.862937 F\n0.740167 0.836852 0.109087 F\n0.605886 0.388529 0.352738 F\n0.394115 0.611470 0.647262 F\n0.494428 0.352757 0.111448 F\n0.347149 0.111479 0.147263 F\n0.853548 0.592566 0.637094 F\n0.041367 0.852754 0.611457 F\n0.505572 0.647242 0.888552 F\n0.652851 0.888520 0.852737 F\n0.607835 0.594251 0.144760 F\n0.752607 0.355262 0.594222 F\n0.702085 0.144726 0.905788 F\n0.346831 0.905757 0.355254 F\n0.392165 0.405748 0.855240 F\n0.247393 0.644737 0.405778 F\n0.297915 0.855273 0.094212 F\n0.653169 0.094242 0.644746 F\n0.958633 0.147245 0.388543 F\n0.946107 0.637061 0.907469 F\n","nsites":40,"nelements":2,"elements":["Mn","F"],"chemical_system":"F-Mn","density":3.6604335608973866,"density_atomic":0.08417997039204185,"volume":475.1724170691974,"volume_molar":7.153887952150334,"formula_full":"Mn8 F32","formula_reduced":"MnF4","formula_anonymous":"AB4","energy_above_hull":0.311973674275862,"spacegroup":88},{"id":"jvasp-8725","created_at":"2022-09-04T14:37:02.887571Z","updated_at":"2022-09-04T14:37:02.887599Z","structure_string":"Li1 Pt7\n1.0\n4.816679 0.000000 2.780911\n1.605560 4.541209 2.780911\n0.000000 -0.000000 5.561822\nLi Pt\n1 7\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pt\n0.500000 0.000000 -0.000000 Pt\n0.000000 0.000000 0.500000 Pt\n0.500000 0.500000 -0.000000 Pt\n-0.000000 0.500000 0.500000 Pt\n-0.000000 0.500000 -0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n","nsites":8,"nelements":2,"elements":["Li","Pt"],"chemical_system":"Li-Pt","density":18.734165257884587,"density_atomic":0.06575877390893499,"volume":121.65676949936255,"volume_molar":9.15792737915045,"formula_full":"Li1 Pt7","formula_reduced":"LiPt7","formula_anonymous":"AB7","energy_above_hull":2.742928725,"spacegroup":225},{"id":"jvasp-87243","created_at":"2022-09-04T14:35:59.234541Z","updated_at":"2022-09-04T14:35:59.234560Z","structure_string":"Sr10 B6 Br2 O18\n1.0\n7.578758 0.000000 0.000000\n0.000000 8.217208 -2.901227\n-0.000000 0.033918 8.714269\nSr B Br O\n10 6 2 18\ndirect\n0.500000 0.757410 0.757409 Sr\n0.571114 0.266508 0.006657 Sr\n0.750000 0.363055 0.636945 Sr\n0.750000 0.635891 0.364109 Sr\n0.071114 0.733492 0.993343 Sr\n0.000000 0.242591 0.242590 Sr\n0.928886 0.993343 0.733492 Sr\n0.250000 0.636945 0.363055 Sr\n0.250000 0.364110 0.635891 Sr\n0.428886 0.006657 0.266508 Sr\n0.500000 0.372059 0.372059 B\n0.000000 0.627942 0.627941 B\n0.472277 0.593395 0.016180 B\n0.527724 0.016181 0.593395 B\n0.972277 0.406606 0.983820 B\n0.027723 0.983820 0.406605 B\n0.750000 0.938279 0.061721 Br\n0.250000 0.061722 0.938279 Br\n0.838990 0.694348 0.691486 O\n0.013425 0.516504 0.138191 O\n0.384490 0.735972 0.029409 O\n0.338990 0.305653 0.308514 O\n0.884490 0.264028 0.970591 O\n0.661011 0.308514 0.305652 O\n0.014026 0.442687 0.844475 O\n0.115511 0.970591 0.264028 O\n0.500000 0.510578 0.510578 O\n0.514026 0.557314 0.155524 O\n0.485974 0.155525 0.557314 O\n0.513425 0.483496 0.861809 O\n0.486575 0.861810 0.483496 O\n0.986576 0.138191 0.516504 O\n0.161011 0.691486 0.694348 O\n0.000000 0.489423 0.489422 O\n0.985974 0.844476 0.442686 O\n0.615511 0.029410 0.735972 O\n","nsites":36,"nelements":4,"elements":["Sr","B","Br","O"],"chemical_system":"B-Br-O-Sr","density":4.243838801148533,"density_atomic":0.06624495535309238,"volume":543.4376068051721,"volume_molar":9.090716006828558,"formula_full":"Sr10 B6 Br2 O18","formula_reduced":"Sr5B3BrO9","formula_anonymous":"AB3C5D9","energy_above_hull":2.082214161388889,"spacegroup":20},{"id":"jvasp-87241","created_at":"2022-09-04T14:35:54.819664Z","updated_at":"2022-09-04T14:35:54.819674Z","structure_string":"La4 Ga4 Se8 O4\n1.0\n5.975884 0.000000 0.000000\n0.000000 5.981657 0.000000\n0.000000 0.000000 12.333999\nLa Ga Se O\n4 4 8 4\ndirect\n0.754210 0.497416 0.095872 La\n0.254210 0.002584 0.095872 La\n0.254210 0.502584 0.904128 La\n0.754210 0.997417 0.904128 La\n0.658485 0.077206 0.397922 Ga\n0.158485 0.922795 0.602078 Ga\n0.658485 0.577206 0.602078 Ga\n0.158485 0.422795 0.397922 Ga\n0.255319 0.006748 0.781401 Se\n0.755319 0.493252 0.781401 Se\n0.750341 0.979021 0.587373 Se\n0.250342 0.520980 0.587373 Se\n0.250342 0.020980 0.412627 Se\n0.255319 0.506749 0.218599 Se\n0.755319 0.993252 0.218599 Se\n0.750341 0.479020 0.412627 Se\n0.500942 0.749394 0.001407 O\n0.000942 0.250607 0.998593 O\n0.000942 0.750607 0.001407 O\n0.500942 0.249394 0.998593 O\n","nsites":20,"nelements":4,"elements":["La","Ga","Se","O"],"chemical_system":"Ga-La-O-Se","density":5.763247935110381,"density_atomic":0.04536306830307027,"volume":440.8872844839368,"volume_molar":13.275426432282156,"formula_full":"La4 Ga4 Se8 O4","formula_reduced":"LaGaSe2O","formula_anonymous":"ABCD2","energy_above_hull":1.0227935116666669,"spacegroup":29},{"id":"jvasp-87240","created_at":"2022-09-04T14:35:51.489589Z","updated_at":"2022-09-04T14:35:51.489617Z","structure_string":"Rb6 Mg6 F18\n1.0\n6.854623 0.000000 -0.000000\n-3.427312 5.936278 0.000000\n-0.000000 -0.000000 14.191360\nRb Mg F\n6 6 18\ndirect\n0.333333 0.666667 0.139453 Rb\n0.333333 0.666667 0.360547 Rb\n0.666667 0.333333 0.860547 Rb\n0.666667 0.333333 0.639453 Rb\n0.000000 0.000000 0.250000 Rb\n0.000000 0.000000 0.750000 Rb\n0.000000 0.000000 0.000000 Mg\n0.333333 0.666667 0.842112 Mg\n0.000000 0.000000 0.500000 Mg\n0.666667 0.333333 0.157888 Mg\n0.333333 0.666667 0.657888 Mg\n0.666667 0.333333 0.342112 Mg\n0.543732 0.087465 0.250000 F\n0.912534 0.456267 0.250000 F\n0.456267 0.543733 0.750000 F\n0.087466 0.543733 0.750000 F\n0.865498 0.134502 0.915096 F\n0.134502 0.269005 0.084904 F\n0.269005 0.134502 0.584904 F\n0.134502 0.269005 0.415096 F\n0.730995 0.865498 0.415096 F\n0.456268 0.912535 0.750000 F\n0.865498 0.134502 0.584904 F\n0.134502 0.865498 0.084904 F\n0.269005 0.134502 0.915096 F\n0.865498 0.730995 0.915096 F\n0.730995 0.865498 0.084904 F\n0.543733 0.456267 0.250000 F\n0.134502 0.865498 0.415096 F\n0.865498 0.730995 0.584904 F\n","nsites":30,"nelements":3,"elements":["Rb","Mg","F"],"chemical_system":"F-Mg-Rb","density":2.8773405829189023,"density_atomic":0.051951660430401225,"volume":577.4598877391128,"volume_molar":11.591815757395784,"formula_full":"Rb6 Mg6 F18","formula_reduced":"RbMgF3","formula_anonymous":"ABC3","energy_above_hull":0.127516,"spacegroup":194},{"id":"jvasp-8724","created_at":"2022-09-04T14:37:04.334235Z","updated_at":"2022-09-04T14:37:04.334261Z","structure_string":"Mg6 Ir2\n1.0\n2.283124 -3.954487 -0.000000\n2.283124 3.954487 -0.000000\n0.000000 0.000000 8.246349\nMg Ir\n6 2\ndirect\n0.000000 0.000000 0.250000 Mg\n0.000000 0.000000 0.750000 Mg\n0.333332 0.666666 0.577715 Mg\n0.666666 0.333332 0.077715 Mg\n0.666666 0.333332 0.422286 Mg\n0.333332 0.666666 0.922286 Mg\n0.333332 0.666666 0.250000 Ir\n0.666666 0.333332 0.750000 Ir\n","nsites":8,"nelements":2,"elements":["Mg","Ir"],"chemical_system":"Ir-Mg","density":5.91329959456454,"density_atomic":0.053725272734826274,"volume":148.90571220523873,"volume_molar":11.20913948584997,"formula_full":"Mg6 Ir2","formula_reduced":"Mg3Ir","formula_anonymous":"AB3","energy_above_hull":0.4169895624999999,"spacegroup":194},{"id":"jvasp-87239","created_at":"2022-09-04T14:35:43.996132Z","updated_at":"2022-09-04T14:35:43.996150Z","structure_string":"Na16 Ca8 P8 O32 F8\n1.0\n7.111886 0.000000 0.000000\n0.000000 9.770519 -4.256343\n0.000000 0.006739 13.351551\nNa Ca P O F\n16 8 8 32 8\ndirect\n0.745957 0.177437 0.090764 Na\n0.254043 0.822563 0.909237 Na\n0.976777 0.453994 0.164569 Na\n0.023223 0.546006 0.835431 Na\n0.226209 0.910887 0.588221 Na\n0.980451 0.761676 0.330197 Na\n0.480451 0.738325 0.669804 Na\n0.523224 0.953994 0.164569 Na\n0.273791 0.410887 0.588221 Na\n0.245957 0.322563 0.909237 Na\n0.754044 0.677437 0.090764 Na\n0.519550 0.261675 0.330197 Na\n0.773792 0.089113 0.411779 Na\n0.019549 0.238325 0.669803 Na\n0.726209 0.589113 0.411779 Na\n0.476777 0.046006 0.835431 Na\n0.493025 0.550060 0.827343 Ca\n0.012426 0.697567 0.668799 Ca\n0.006976 0.050060 0.827343 Ca\n0.487575 0.197567 0.668799 Ca\n0.993025 0.949941 0.172657 Ca\n0.506976 0.449941 0.172657 Ca\n0.987575 0.302433 0.331201 Ca\n0.512426 0.802433 0.331202 Ca\n0.258337 0.059188 0.413681 P\n0.744759 0.355157 0.915888 P\n0.758337 0.440812 0.586319 P\n0.755242 0.855157 0.915889 P\n0.255242 0.644844 0.084112 P\n0.241664 0.559188 0.413681 P\n0.741664 0.940812 0.586320 P\n0.244758 0.144844 0.084112 P\n0.248757 0.997896 0.083966 O\n0.923915 0.276328 0.858112 O\n0.722575 0.585165 0.585559 O\n0.900879 0.903698 0.650276 O\n0.235147 0.132633 0.964492 O\n0.099121 0.096302 0.349724 O\n0.433081 0.720639 0.147452 O\n0.251243 0.497896 0.083966 O\n0.264853 0.632633 0.964493 O\n0.277426 0.414835 0.414441 O\n0.735148 0.367367 0.035508 O\n0.748757 0.502104 0.916034 O\n0.751244 0.002104 0.916034 O\n0.423915 0.223672 0.141888 O\n0.266407 0.169200 0.532056 O\n0.599121 0.403698 0.650276 O\n0.076085 0.723672 0.141888 O\n0.764853 0.867367 0.035508 O\n0.733594 0.830800 0.467944 O\n0.549454 0.950995 0.644843 O\n0.450546 0.049005 0.355157 O\n0.777426 0.085165 0.585559 O\n0.049454 0.549005 0.355157 O\n0.233594 0.669200 0.532056 O\n0.576086 0.776328 0.858112 O\n0.950547 0.450995 0.644843 O\n0.400879 0.596302 0.349724 O\n0.066919 0.220639 0.147452 O\n0.766407 0.330800 0.467944 O\n0.222574 0.914835 0.414441 O\n0.566919 0.279361 0.852549 O\n0.933081 0.779361 0.852549 O\n0.730076 0.380095 0.264592 F\n0.771614 0.119792 0.240675 F\n0.230077 0.119905 0.735408 F\n0.269924 0.619905 0.735408 F\n0.271614 0.380208 0.759325 F\n0.769925 0.880095 0.264593 F\n0.728387 0.619792 0.240675 F\n0.228386 0.880208 0.759325 F\n","nsites":72,"nelements":5,"elements":["Na","Ca","P","O","F"],"chemical_system":"Ca-F-Na-O-P","density":2.863510268422096,"density_atomic":0.07758948617191673,"volume":927.9607786094629,"volume_molar":7.761542261868588,"formula_full":"Na16 Ca8 P8 O32 F8","formula_reduced":"Na2CaPO4F","formula_anonymous":"ABCD2E4","energy_above_hull":1.0800086891666665,"spacegroup":14},{"id":"jvasp-87236","created_at":"2022-09-04T14:36:21.242778Z","updated_at":"2022-09-04T14:36:21.242801Z","structure_string":"Sm8 I12 O2\n1.0\n9.892100 -0.000000 0.000000\n-4.946051 8.566810 -0.000000\n0.000000 -0.000000 8.241827\nSm I O\n8 12 2\ndirect\n0.201938 0.798062 0.070871 Sm\n0.798062 0.596126 0.570871 Sm\n0.596126 0.798062 0.070871 Sm\n0.666667 0.333333 0.254927 Sm\n0.403874 0.201938 0.570871 Sm\n0.333333 0.666667 0.754927 Sm\n0.798062 0.201938 0.570871 Sm\n0.201938 0.403874 0.070871 Sm\n0.733252 0.866626 0.698569 I\n0.472011 0.527989 0.385610 I\n0.527989 0.472011 0.885610 I\n0.527989 0.055978 0.885610 I\n0.944022 0.472011 0.885610 I\n0.866626 0.733252 0.198569 I\n0.133374 0.266748 0.698569 I\n0.055978 0.527989 0.385610 I\n0.866626 0.133374 0.198569 I\n0.133374 0.866626 0.698569 I\n0.472011 0.944022 0.385610 I\n0.266748 0.133374 0.198569 I\n0.666667 0.333333 0.547836 O\n0.333333 0.666667 0.047836 O\n","nsites":22,"nelements":3,"elements":["Sm","I","O"],"chemical_system":"I-O-Sm","density":6.556470298170225,"density_atomic":0.03149862191981438,"volume":698.4432543114142,"volume_molar":19.118743592435514,"formula_full":"Sm8 I12 O2","formula_reduced":"Sm4I6O","formula_anonymous":"AB4C6","energy_above_hull":0.59301515,"spacegroup":186},{"id":"jvasp-8723","created_at":"2022-09-04T14:37:02.340705Z","updated_at":"2022-09-04T14:37:02.340732Z","structure_string":"Y1 Hg2\n1.0\n2.461463 -4.263380 0.000000\n2.461463 4.263380 -0.000000\n0.000000 0.000000 3.434151\nY Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.333332 0.666666 0.500000 Hg\n0.666666 0.333332 0.500000 Hg\n","nsites":3,"nelements":2,"elements":["Y","Hg"],"chemical_system":"Hg-Y","density":11.290795008832506,"density_atomic":0.04162215060422107,"volume":72.07700602802964,"volume_molar":14.468595862005435,"formula_full":"Y1 Hg2","formula_reduced":"YHg2","formula_anonymous":"AB2","energy_above_hull":0.2996206055555555,"spacegroup":191}]}