{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume_molar&page=4582","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume_molar&page=4580","results":[{"id":"jvasp-101992","created_at":"2022-09-04T14:36:50.385757Z","updated_at":"2022-09-04T14:36:50.385784Z","structure_string":"H18 C22\n1.0\n5.264865 0.023697 1.038434\n2.128992 5.239798 0.681064\n0.167677 0.059453 11.964686\nH C\n18 22\ndirect\n0.590070 0.853537 0.590729 H\n0.176241 0.054255 0.266168 H\n0.823760 0.945745 0.733831 H\n0.221579 0.871924 0.049655 H\n0.778422 0.128077 0.950345 H\n0.742897 0.611813 0.844474 H\n0.838896 0.226543 0.123023 H\n0.161105 0.773457 0.876977 H\n0.802644 0.712728 0.018431 H\n0.257104 0.388187 0.155526 H\n0.757087 0.890737 0.235554 H\n0.242914 0.109263 0.764446 H\n0.789271 0.407547 0.341211 H\n0.210730 0.592453 0.658789 H\n0.887844 0.945576 0.418384 H\n0.112157 0.054425 0.581616 H\n0.409931 0.146463 0.409271 H\n0.197357 0.287273 0.981569 H\n0.328761 0.319615 0.903203 C\n0.671240 0.680386 0.096796 C\n0.308338 0.589418 0.845110 C\n0.691663 0.410583 0.154889 C\n0.348874 0.769311 0.114422 C\n0.369763 0.500005 0.172125 C\n0.651127 0.230690 0.885578 C\n0.645894 0.779339 0.217144 C\n0.630238 0.499995 0.827874 C\n0.354107 0.220661 0.782856 C\n0.170146 0.553008 0.400543 C\n0.333295 0.490140 0.725089 C\n0.342527 0.601712 0.293915 C\n0.657474 0.398289 0.706085 C\n0.937448 0.749377 0.453672 C\n0.062552 0.250623 0.546328 C\n0.230632 0.302788 0.449175 C\n0.769369 0.697212 0.550825 C\n0.676848 0.130030 0.765539 C\n0.829855 0.446993 0.599456 C\n0.666706 0.509860 0.274911 C\n0.323153 0.869970 0.234461 C\n","nsites":40,"nelements":2,"elements":["H","C"],"chemical_system":"C-H","density":1.4275164956047368,"density_atomic":0.12177571247997343,"volume":328.47272403828623,"volume_molar":4.945272449947989,"formula_full":"H18 C22","formula_reduced":"H9C11","formula_anonymous":"A9B11","energy_above_hull":5.672824,"spacegroup":2},{"id":"jvasp-46547","created_at":"2022-09-04T14:37:29.364741Z","updated_at":"2022-09-04T14:37:29.364761Z","structure_string":"Li4 Cr2 O6\n1.0\n2.551799 4.211753 0.019883\n-2.551799 4.211753 -0.019883\n-1.936092 0.000000 4.569256\nLi Cr O\n4 2 6\ndirect\n0.246146 0.263175 0.491305 Li\n0.572328 0.589764 0.491555 Li\n0.410236 0.427671 0.991556 Li\n0.736824 0.753853 0.991305 Li\n0.900509 0.917532 0.491232 Cr\n0.082468 0.099490 0.991233 Cr\n0.284408 0.861756 0.751838 O\n0.138243 0.715592 0.251838 O\n0.991502 0.508510 0.741265 O\n0.698666 0.155213 0.730605 O\n0.491489 0.008498 0.241265 O\n0.844786 0.301333 0.230604 O\n","nsites":12,"nelements":3,"elements":["Li","Cr","O"],"chemical_system":"Cr-Li-O","density":3.837921795077169,"density_atomic":0.12177690327388811,"volume":98.54085362156756,"volume_molar":4.945224092663629,"formula_full":"Li4 Cr2 O6","formula_reduced":"Li2CrO3","formula_anonymous":"AB2C3","energy_above_hull":2.107339650000001,"spacegroup":15},{"id":"jvasp-36202","created_at":"2022-09-04T14:37:27.989789Z","updated_at":"2022-09-04T14:37:27.989826Z","structure_string":"Al1 B1 N2\n1.0\n2.815854 0.000000 0.000000\n0.000000 2.815854 -0.000000\n0.000000 0.000000 4.142142\nAl B N\n1 1 2\ndirect\n0.499999 0.499999 0.500000 Al\n0.000000 0.000000 0.000000 B\n0.499999 0.000000 0.210236 N\n0.000000 0.499999 0.789764 N\n","nsites":4,"nelements":3,"elements":["Al","B","N"],"chemical_system":"Al-B-N","density":3.32712360702496,"density_atomic":0.12179087249944573,"volume":32.84318371245927,"volume_molar":4.944656883074228,"formula_full":"Al1 B1 N2","formula_reduced":"AlBN2","formula_anonymous":"ABC2","energy_above_hull":3.825547970833333,"spacegroup":115},{"id":"jvasp-28361","created_at":"2022-09-04T14:35:46.477772Z","updated_at":"2022-09-04T14:35:46.477799Z","structure_string":"C6 N2\n1.0\n-1.215427 -2.105251 0.000000\n-1.215427 2.105251 -0.000000\n0.000000 -0.000000 -12.834041\nC N\n6 2\ndirect\n0.006204 0.993799 0.750000 C\n0.993799 0.006204 0.250000 C\n0.666663 0.333340 0.000137 C\n0.333340 0.666663 0.999863 C\n0.333340 0.666663 0.500137 C\n0.666663 0.333340 0.499863 C\n0.672862 0.327141 0.750000 N\n0.327141 0.672862 0.250000 N\n","nsites":8,"nelements":2,"elements":["C","N"],"chemical_system":"C-N","density":2.5302288262037615,"density_atomic":0.12180463281832775,"volume":65.67894680928961,"volume_molar":4.944098283176187,"formula_full":"C6 N2","formula_reduced":"C3N","formula_anonymous":"AB3","energy_above_hull":5.898320812500001,"spacegroup":194},{"id":"jvasp-112697","created_at":"2022-09-04T14:38:43.454267Z","updated_at":"2022-09-04T14:38:43.454330Z","structure_string":"Be4 B2 H6 O10\n1.0\n10.543668 0.000000 0.000000\n-0.000000 3.851505 2.209628\n-0.000000 0.009647 4.453186\nBe B H O\n4 2 6 10\ndirect\n0.800102 0.014490 0.976846 Be\n0.300102 0.985512 0.023154 Be\n0.696829 0.349782 0.311081 Be\n0.196829 0.650220 0.688919 Be\n0.751080 0.683020 0.644066 B\n0.251080 0.316982 0.355934 B\n0.011366 0.768619 0.449771 H\n0.496655 0.747042 0.141964 H\n0.511366 0.231383 0.550229 H\n0.996655 0.252960 0.858037 H\n0.994766 0.872556 0.857370 H\n0.494766 0.127446 0.142631 H\n0.958155 0.007095 -0.029329 O\n0.753109 0.992760 0.334725 O\n0.748680 0.683460 0.952992 O\n0.750749 0.373128 0.644851 O\n0.253109 0.007242 0.665276 O\n0.248680 0.316542 0.047008 O\n0.250749 0.626874 0.355149 O\n0.543288 0.352363 0.310041 O\n0.043288 0.647639 0.689959 O\n0.458155 0.992907 0.029329 O\n","nsites":22,"nelements":4,"elements":["Be","B","H","O"],"chemical_system":"B-Be-H-O","density":2.0567720258165627,"density_atomic":0.12180629834892187,"volume":180.6146340395273,"volume_molar":4.944030679554186,"formula_full":"Be4 B2 H6 O10","formula_reduced":"Be2BH3O5","formula_anonymous":"AB2C3D5","energy_above_hull":2.876399298484848,"spacegroup":4},{"id":"jvasp-33004","created_at":"2022-09-04T14:37:31.800923Z","updated_at":"2022-09-04T14:37:31.800942Z","structure_string":"H20 N4 O4\n1.0\n4.353886 0.000000 0.000000\n0.000000 5.641093 0.000000\n0.000000 0.000000 9.358971\nH N O\n20 4 4\ndirect\n0.741656 0.706045 0.330827 H\n0.257050 0.873294 0.907628 H\n0.959654 0.865951 0.132551 H\n0.582119 0.880620 0.129063 H\n0.453472 0.230409 0.019259 H\n0.258345 0.206046 0.169173 H\n0.540347 0.134048 0.632551 H\n0.917882 0.119380 0.629062 H\n0.241655 0.793954 0.669173 H\n0.046528 0.769591 0.519259 H\n0.242951 0.126706 0.407628 H\n0.757050 0.626705 0.092372 H\n0.082119 0.619380 0.870937 H\n0.417882 0.380620 0.370937 H\n0.742951 0.373294 0.592372 H\n0.040347 0.365951 0.367449 H\n0.546529 0.730408 0.480741 H\n0.953472 0.269591 0.980741 H\n0.459653 0.634048 0.867449 H\n0.758346 0.293954 0.830827 H\n0.763627 0.773498 0.157443 N\n0.736375 0.226502 0.657443 N\n0.263626 0.726501 0.842557 N\n0.236374 0.273498 0.342557 N\n0.232406 0.845846 0.563502 O\n0.732406 0.654153 0.436498 O\n0.767595 0.345846 0.936498 O\n0.267594 0.154154 0.063502 O\n","nsites":28,"nelements":3,"elements":["H","N","O"],"chemical_system":"H-N-O","density":1.0126903050215315,"density_atomic":0.12181187176963207,"volume":229.86265290260857,"volume_molar":4.943804468737612,"formula_full":"H20 N4 O4","formula_reduced":"H5NO","formula_anonymous":"ABC5","energy_above_hull":3.2431981071428573,"spacegroup":19},{"id":"jvasp-103972","created_at":"2022-09-04T14:36:36.991463Z","updated_at":"2022-09-04T14:36:36.991488Z","structure_string":"Cd1 H10 C7 O4\n1.0\n4.105906 0.049216 0.455266\n1.047223 4.051418 0.743044\n0.009757 0.008135 10.890858\nCd H C O\n1 10 7 4\ndirect\n0.759003 0.206795 0.173106 Cd\n0.048885 0.390749 0.616190 H\n0.887023 0.021510 0.719348 H\n0.892716 0.639080 0.812044 H\n0.508975 0.434743 0.752280 H\n0.502419 0.816246 0.657328 H\n0.943751 0.148617 0.911998 H\n0.379181 0.018995 0.863899 H\n0.873687 0.800257 0.449552 H\n0.128224 0.032593 0.485812 H\n0.465946 0.328859 0.550524 H\n0.347632 0.727556 0.348301 C\n0.133433 0.783094 0.469946 C\n0.248296 0.516688 0.583277 C\n0.347649 0.642927 0.693576 C\n0.049675 0.810121 0.776424 C\n0.147348 0.937651 0.888234 C\n0.201873 0.672499 0.002248 C\n0.974242 0.693566 0.093859 O\n0.291597 0.964744 0.254731 O\n0.574185 0.458732 0.344419 O\n0.464687 0.431502 0.000932 O\n","nsites":22,"nelements":4,"elements":["Cd","H","C","O"],"chemical_system":"C-Cd-H-O","density":2.488167740863959,"density_atomic":0.12183862615803842,"volume":180.56671101546667,"volume_molar":4.942718865024467,"formula_full":"Cd1 H10 C7 O4","formula_reduced":"CdH10C7O4","formula_anonymous":"AB4C7D10","energy_above_hull":4.349658806818182,"spacegroup":1},{"id":"jvasp-108188","created_at":"2022-09-04T14:38:09.222598Z","updated_at":"2022-09-04T14:38:09.222614Z","structure_string":"Li2 Mn1 Fe1 O4\n1.0\n2.839899 0.000000 0.000000\n-0.000000 4.617333 1.538218\n-0.000000 0.036574 5.019116\nLi Mn Fe O\n2 1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.000000 Li\n0.500000 -0.000000 0.500001 Mn\n0.000000 0.499999 0.500001 Fe\n0.000000 0.759615 0.728550 O\n0.500000 0.256759 0.725896 O\n0.000000 0.240384 0.271452 O\n0.500000 0.743240 0.274106 O\n","nsites":8,"nelements":4,"elements":["Li","Mn","Fe","O"],"chemical_system":"Fe-Li-Mn-O","density":4.771657397854645,"density_atomic":0.12184963279108654,"volume":65.65469108730224,"volume_molar":4.942272391025645,"formula_full":"Li2 Mn1 Fe1 O4","formula_reduced":"Li2MnFeO4","formula_anonymous":"ABC2D4","energy_above_hull":2.481844592672413,"spacegroup":10},{"id":"jvasp-119588","created_at":"2022-09-04T14:38:51.754848Z","updated_at":"2022-09-04T14:38:51.754871Z","structure_string":"Li8 Mn2 Co4 O14\n1.0\n2.812718 0.101589 -0.278694\n-0.133046 5.675239 0.686121\n0.007166 -0.103930 14.368233\nLi Mn Co O\n8 2 4 14\ndirect\n0.998594 0.495028 0.997142 Li\n0.575117 0.213727 0.150027 Li\n0.153546 0.940293 0.306943 Li\n0.424509 0.783142 0.849061 Li\n0.854246 0.075529 0.708496 Li\n0.277971 0.351143 0.556342 Li\n0.715377 0.641596 0.430859 Li\n0.715354 0.146286 0.430765 Li\n-0.000915 -0.002645 0.998123 Mn\n0.572574 0.713811 0.144950 Mn\n0.856629 0.570083 0.713349 Co\n0.428119 0.284563 0.856198 Co\n0.144923 0.424727 0.289622 Co\n0.284153 0.862645 0.568615 Co\n0.790135 0.625802 0.580015 O\n0.497427 0.231718 0.995260 O\n0.067683 0.951887 0.135653 O\n0.638365 0.668633 0.277042 O\n0.925305 0.512816 0.851070 O\n0.353932 0.799184 0.708448 O\n0.786170 0.083556 0.573129 O\n0.208759 0.400902 0.417470 O\n0.502039 0.760508 0.003553 O\n0.072931 0.483272 0.145204 O\n0.643337 0.206027 0.285953 O\n0.931668 0.048348 0.862793 O\n0.361489 0.339747 0.722624 O\n0.220568 0.887675 0.441295 O\n","nsites":28,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.51796346018511,"density_atomic":0.12186594759071959,"volume":229.76065548709747,"volume_molar":4.9416107444755974,"formula_full":"Li8 Mn2 Co4 O14","formula_reduced":"Li4MnCo2O7","formula_anonymous":"AB2C4D7","energy_above_hull":2.5583631100985222,"spacegroup":8},{"id":"jvasp-88819","created_at":"2022-09-04T14:35:51.786029Z","updated_at":"2022-09-04T14:35:51.786046Z","structure_string":"H16 N8 O12\n1.0\n7.237345 0.000000 -0.000000\n0.000000 7.708542 0.000000\n0.000000 0.000000 5.294557\nH N O\n16 8 12\ndirect\n0.700912 0.506824 0.591172 H\n0.918843 0.693220 0.968955 H\n0.581156 0.193220 0.531045 H\n0.081157 0.306780 0.468955 H\n0.418843 0.806780 0.031045 H\n0.081157 0.306780 0.031045 H\n0.418843 0.806780 0.468955 H\n0.581156 0.193220 0.968955 H\n0.918843 0.693220 0.531045 H\n0.200912 0.993176 0.091172 H\n0.299087 0.493176 0.091172 H\n0.299087 0.493176 0.408828 H\n0.799087 0.006824 0.908829 H\n0.799087 0.006824 0.591172 H\n0.700912 0.506824 0.908829 H\n0.200912 0.993176 0.408828 H\n0.030328 0.823163 0.250000 N\n-0.030328 0.176836 0.750000 N\n0.530328 0.676836 0.750000 N\n0.469672 0.323163 0.250000 N\n0.291001 0.414502 0.250000 N\n0.791001 0.085498 0.750000 N\n0.208998 0.914502 0.250000 N\n0.708998 0.585498 0.750000 N\n0.451746 0.209130 0.471796 O\n0.615437 0.413989 0.250000 O\n0.884562 0.913989 0.250000 O\n0.384562 0.586010 0.750000 O\n0.115437 0.086010 0.750000 O\n0.451746 0.209130 0.028204 O\n0.048253 0.709130 0.471796 O\n0.548253 0.790870 0.528204 O\n0.951746 0.290870 0.971796 O\n0.548253 0.790870 0.971796 O\n0.951746 0.290870 0.528204 O\n0.048253 0.709130 0.028204 O\n","nsites":36,"nelements":3,"elements":["H","N","O"],"chemical_system":"H-N-O","density":1.7999202074839473,"density_atomic":0.1218768872893933,"volume":295.3800412913319,"volume_molar":4.9411671843083695,"formula_full":"H16 N8 O12","formula_reduced":"H4N2O3","formula_anonymous":"A2B3C4","energy_above_hull":3.632685222222222,"spacegroup":62},{"id":"jvasp-112579","created_at":"2022-09-04T14:38:41.685921Z","updated_at":"2022-09-04T14:38:41.685941Z","structure_string":"Na1 V1 H8 N2 F6\n1.0\n5.138185 -0.000000 2.966532\n1.712728 4.844327 2.966532\n-0.000000 -0.000000 5.933065\nNa V H N F\n1 1 8 2 6\ndirect\n0.500000 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 V\n0.961849 0.679384 0.679383 H\n0.679383 0.961850 0.679382 H\n0.679383 0.679384 0.961849 H\n0.038150 0.320616 0.320616 H\n0.320616 0.320616 0.038150 H\n0.679383 0.679384 0.679383 H\n0.320616 0.320616 0.320616 H\n0.320616 0.038150 0.320616 H\n0.250000 0.250000 0.250000 N\n0.749999 0.750000 0.749999 N\n0.234403 0.234403 0.765596 F\n0.765596 0.234403 0.234402 F\n0.234403 0.765598 0.765596 F\n0.234403 0.765598 0.234402 F\n0.765596 0.234403 0.765596 F\n0.765597 0.765598 0.234402 F\n","nsites":18,"nelements":5,"elements":["Na","V","H","N","F"],"chemical_system":"F-H-N-Na-V","density":2.518674954423988,"density_atomic":0.12188498572518065,"volume":147.68020763923604,"volume_molar":4.940838877052816,"formula_full":"Na1 V1 H8 N2 F6","formula_reduced":"NaVH8(NF3)2","formula_anonymous":"ABC2D6E8","energy_above_hull":2.260696188611112,"spacegroup":225},{"id":"jvasp-119584","created_at":"2022-09-04T14:38:35.776583Z","updated_at":"2022-09-04T14:38:35.776613Z","structure_string":"Li6 Mn2 Co2 O10\n1.0\n4.655250 -0.008768 1.599535\n1.528385 4.702429 0.564065\n0.027954 -0.061514 7.495676\nLi Mn Co O\n6 2 2 10\ndirect\n-0.000001 0.500001 0.500001 Li\n0.596267 0.499977 0.307413 Li\n0.199885 0.499987 0.100218 Li\n0.800113 0.500014 0.899784 Li\n0.403731 0.500023 0.692590 Li\n0.500000 0.000000 0.500001 Li\n0.900299 0.000000 0.699418 Mn\n0.099700 0.000000 0.300584 Mn\n0.300483 -0.000001 0.899039 Co\n0.699516 0.000001 0.100962 Co\n0.140482 0.225365 0.712661 O\n0.646923 0.774610 0.712621 O\n0.221022 0.769048 0.499965 O\n0.859516 0.774636 0.287341 O\n0.443069 0.779902 0.101285 O\n0.044409 0.779898 0.898648 O\n0.353075 0.225390 0.287381 O\n0.955589 0.220103 0.101355 O\n0.556929 0.220099 0.898718 O\n0.778976 0.230953 0.500037 O\n","nsites":20,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.3478940264427,"density_atomic":0.12195947000841582,"volume":163.9889054832716,"volume_molar":4.937821359492987,"formula_full":"Li6 Mn2 Co2 O10","formula_reduced":"Li3MnCoO5","formula_anonymous":"ABC3D5","energy_above_hull":2.395329564137931,"spacegroup":12}]}