{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=volume_molar&page=107","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=volume_molar&page=105","results":[{"id":"jvasp-103890","created_at":"2022-09-04T14:36:56.672224Z","updated_at":"2022-09-04T14:36:56.672242Z","structure_string":"Ti1 H24 C13 O4\n1.0\n4.899813 -0.017654 -0.655557\n-0.682333 6.788775 -2.233653\n-0.121746 -0.207251 10.969320\nTi H C O\n1 24 13 4\ndirect\n0.478775 0.587605 0.883875 Ti\n0.962537 0.813497 0.540670 H\n0.310015 0.527589 0.633115 H\n0.202561 0.762161 0.727608 H\n0.488061 0.673376 0.137283 H\n0.137031 0.613612 0.052039 H\n0.861368 0.864953 0.395308 H\n0.023706 0.532134 0.718339 H\n0.511907 0.082737 0.514981 H\n0.865290 0.172020 0.574357 H\n0.877730 0.034492 0.751893 H\n0.524752 0.930410 0.696290 H\n0.346646 0.417383 0.054171 H\n0.004600 0.187318 0.373110 H\n0.698671 0.091082 0.258071 H\n0.415024 0.713032 0.514892 H\n0.419928 0.682878 0.349732 H\n-0.004274 0.510446 0.329872 H\n0.140777 0.992106 0.167859 H\n0.684127 0.418617 0.219913 H\n0.062884 0.119474 0.973633 H\n0.789093 0.244280 0.042467 H\n0.770848 0.479370 0.513026 H\n0.463240 0.367913 0.402920 H\n0.241050 0.244470 0.197974 H\n0.549220 0.682918 0.440529 C\n0.643853 0.476897 0.421119 C\n0.806966 0.407867 0.308867 C\n0.909153 0.118722 0.036400 C\n0.060593 0.134167 0.173953 C\n0.886033 0.196626 0.282443 C\n0.726135 0.928326 0.974475 C\n0.706608 0.051603 0.563883 C\n0.786996 0.850957 0.482206 C\n0.586405 0.243102 0.781058 C\n0.224167 0.607845 0.720604 C\n0.346165 0.569440 0.052315 C\n0.676241 0.052143 0.702554 C\n0.767581 0.393758 0.846741 O\n0.831130 0.768719 0.914003 O\n0.470497 0.906664 0.979853 O\n0.334702 0.273133 0.783342 O\n","nsites":42,"nelements":4,"elements":["Ti","H","C","O"],"chemical_system":"C-H-O-Ti","density":1.3409213086061826,"density_atomic":0.1160731592039553,"volume":361.84075877697666,"volume_molar":5.1882285287146646,"formula_full":"Ti1 H24 C13 O4","formula_reduced":"TiH24C13O4","formula_anonymous":"AB4C13D24","energy_above_hull":4.744183150793651,"spacegroup":1},{"id":"jvasp-115181","created_at":"2022-09-04T14:38:45.074305Z","updated_at":"2022-09-04T14:38:45.074329Z","structure_string":"Li1 B2\n1.0\n3.333457 0.000000 -0.000000\n-1.666728 2.886858 0.000000\n0.000000 0.000000 2.685899\nLi B\n1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.333333 0.666667 0.000000 B\n0.666666 0.333333 0.000000 B\n","nsites":3,"nelements":2,"elements":["Li","B"],"chemical_system":"B-Li","density":1.835029119697417,"density_atomic":0.1160676784091551,"volume":25.846988938854903,"volume_molar":5.188473520398242,"formula_full":"Li1 B2","formula_reduced":"LiB2","formula_anonymous":"AB2","energy_above_hull":3.039405055555556,"spacegroup":191},{"id":"jvasp-44714","created_at":"2022-09-04T14:38:04.714661Z","updated_at":"2022-09-04T14:38:04.714687Z","structure_string":"Li5 Fe3 Ni2 O10\n1.0\n4.993068 0.013853 0.086265\n0.762489 5.023766 0.086759\n2.483239 2.249496 6.948832\nLi Fe Ni O\n5 3 2 10\ndirect\n0.499052 0.804256 0.417024 Li\n0.508880 0.608333 0.783549 Li\n-0.000000 0.500001 0.500000 Li\n0.491121 0.391668 0.216450 Li\n0.500948 0.195745 0.582975 Li\n0.500000 -0.000000 -0.000000 Fe\n0.008263 0.301659 0.894075 Fe\n0.991738 0.698343 0.105924 Fe\n-0.005116 0.104766 0.307532 Ni\n0.005116 0.895235 0.692468 Ni\n0.251922 0.318358 0.042556 O\n0.230652 0.924150 0.857818 O\n0.748079 0.681644 0.957444 O\n0.762186 0.864996 0.548315 O\n0.240002 0.763960 0.227648 O\n0.223917 0.537986 0.669844 O\n0.776084 0.462015 0.330156 O\n0.759999 0.236041 0.772351 O\n0.237814 0.135006 0.451684 O\n0.769348 0.075851 0.142181 O\n","nsites":20,"nelements":4,"elements":["Li","Fe","Ni","O"],"chemical_system":"Fe-Li-Ni-O","density":4.621495930520372,"density_atomic":0.11605542972689575,"volume":172.33144581916116,"volume_molar":5.18902112048651,"formula_full":"Li5 Fe3 Ni2 O10","formula_reduced":"Li5Fe3(NiO5)2","formula_anonymous":"A2B3C5D10","energy_above_hull":2.445424315,"spacegroup":2},{"id":"jvasp-46343","created_at":"2022-09-04T14:38:07.069052Z","updated_at":"2022-09-04T14:38:07.069079Z","structure_string":"Li2 Ti1 V1 O4\n1.0\n5.074940 -0.207803 0.000000\n2.034200 4.654056 0.000000\n-3.554571 -2.223127 2.867219\nLi Ti V O\n2 1 1 4\ndirect\n0.250000 0.750001 0.500000 Li\n0.500000 0.500001 -0.000000 Li\n0.750000 0.250000 0.500000 Ti\n0.000000 0.000000 0.000000 V\n0.503544 0.003544 0.500000 O\n0.248161 0.248162 -0.000000 O\n0.996456 0.496457 0.500000 O\n0.751838 0.751840 -0.000000 O\n","nsites":8,"nelements":4,"elements":["Li","Ti","V","O"],"chemical_system":"Li-O-Ti-V","density":4.256269642375923,"density_atomic":0.11605469709736192,"volume":68.93301348491349,"volume_molar":5.189053877714089,"formula_full":"Li2 Ti1 V1 O4","formula_reduced":"Li2TiVO4","formula_anonymous":"ABC2D4","energy_above_hull":2.465357066666667,"spacegroup":119},{"id":"jvasp-19907","created_at":"2022-09-04T14:36:01.443092Z","updated_at":"2022-09-04T14:36:01.443114Z","structure_string":"Al1 B2\n1.0\n1.504454 -2.605791 -0.000000\n1.504454 2.605791 -0.000000\n-0.000000 0.000000 3.297557\nAl B\n1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.666666 0.333332 0.500000 B\n0.333332 0.666666 0.500000 B\n","nsites":3,"nelements":2,"elements":["Al","B"],"chemical_system":"Al-B","density":3.1215923432504433,"density_atomic":0.11603271511318822,"volume":25.854777224453844,"volume_molar":5.190036925470105,"formula_full":"Al1 B2","formula_reduced":"AlB2","formula_anonymous":"AB2","energy_above_hull":3.134522655555556,"spacegroup":191},{"id":"jvasp-48462","created_at":"2022-09-04T14:35:45.161727Z","updated_at":"2022-09-04T14:35:45.161752Z","structure_string":"Li3 Co1 O1 F3\n1.0\n2.851157 0.000000 -0.000000\n0.000000 2.851157 0.000000\n-0.000000 0.000000 8.481819\nLi Co O F\n3 1 1 3\ndirect\n0.000000 0.000000 0.241789 Li\n0.000000 0.000000 0.758211 Li\n0.500001 0.500001 0.000000 Li\n0.500001 0.500001 0.500000 Co\n0.000000 0.000000 0.500000 O\n0.500001 0.500001 0.234784 F\n0.500001 0.500001 0.765216 F\n0.000000 0.000000 0.000000 F\n","nsites":8,"nelements":4,"elements":["Li","Co","O","F"],"chemical_system":"Co-F-Li-O","density":3.678759006804526,"density_atomic":0.11602690867266623,"volume":68.94952292980163,"volume_molar":5.190296655226413,"formula_full":"Li3 Co1 O1 F3","formula_reduced":"Li3CoOF3","formula_anonymous":"ABC3D3","energy_above_hull":0.7565256559375002,"spacegroup":123},{"id":"jvasp-51411","created_at":"2022-09-04T14:37:14.734499Z","updated_at":"2022-09-04T14:37:14.734520Z","structure_string":"H8 O4\n1.0\n3.578479 2.186428 0.000000\n-3.578479 2.186428 0.000000\n0.000000 0.000000 6.609635\nH O\n8 4\ndirect\n0.840255 0.159746 0.500000 H\n0.159746 0.840255 0.000000 H\n-0.022549 -0.022549 0.250000 H\n0.022549 0.022549 0.750001 H\n0.020173 0.566420 0.229333 H\n0.433581 0.979828 0.770668 H\n0.979828 0.433581 0.729333 H\n0.566420 0.020173 0.270667 H\n0.823836 0.141333 0.316156 O\n0.858668 0.176165 0.683845 O\n0.176165 0.858668 0.816156 O\n0.141333 0.823836 0.183844 O\n","nsites":12,"nelements":2,"elements":["H","O"],"chemical_system":"H-O","density":1.1569350511246843,"density_atomic":0.11602193910599838,"volume":103.42871436614004,"volume_molar":5.190518971156079,"formula_full":"H8 O4","formula_reduced":"H2O","formula_anonymous":"AB2","energy_above_hull":1.9198078333333333,"spacegroup":20},{"id":"jvasp-99351","created_at":"2022-09-04T14:36:37.529918Z","updated_at":"2022-09-04T14:36:37.529949Z","structure_string":"Yb4 Mg4 Fe3 H22\n1.0\n6.576510 -0.000000 0.000000\n0.000000 6.576510 0.000000\n-0.000000 -0.000000 6.576510\nYb Mg Fe H\n4 4 3 22\ndirect\n0.290453 0.290453 0.709547 Yb\n0.290453 0.709547 0.290453 Yb\n0.709547 0.290453 0.290453 Yb\n0.709547 0.709547 0.709547 Yb\n0.786611 0.786611 0.213389 Mg\n0.786611 0.213389 0.786611 Mg\n0.213389 0.786611 0.786611 Mg\n0.213389 0.213389 0.213389 Mg\n0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.240853 0.500000 0.000000 H\n0.626311 0.373689 0.626311 H\n0.626311 0.626311 0.373689 H\n0.260360 0.000000 0.000000 H\n0.000000 0.260360 0.000000 H\n0.000000 0.000000 0.739640 H\n0.739640 0.000000 0.000000 H\n0.000000 0.739640 0.000000 H\n0.000000 0.000000 0.260360 H\n0.240853 0.000000 0.500000 H\n0.759147 0.500000 0.000000 H\n0.000000 0.240853 0.500000 H\n0.500000 0.240853 0.000000 H\n0.000000 0.500000 0.759147 H\n0.373689 0.626311 0.626311 H\n0.500000 0.000000 0.240853 H\n0.000000 0.759147 0.500000 H\n0.759147 0.000000 0.500000 H\n0.500000 0.759147 0.000000 H\n0.000000 0.500000 0.240853 H\n0.500000 0.000000 0.759147 H\n0.373689 0.373689 0.373689 H\n","nsites":33,"nelements":4,"elements":["Yb","Mg","Fe","H"],"chemical_system":"Fe-H-Mg-Yb","density":5.715906498659808,"density_atomic":0.11601856390603356,"volume":284.4372390846654,"volume_molar":5.190669973192814,"formula_full":"Yb4 Mg4 Fe3 H22","formula_reduced":"Yb4Mg4Fe3H22","formula_anonymous":"A3B4C4D22","energy_above_hull":2.3444153181818184,"spacegroup":215},{"id":"jvasp-14794","created_at":"2022-09-04T14:36:02.325539Z","updated_at":"2022-09-04T14:36:02.325564Z","structure_string":"Cr1 C1\n1.0\n2.511190 0.000000 1.449836\n0.837063 2.367573 1.449836\n-0.000000 -0.000000 2.899672\nCr C\n1 1\ndirect\n0.499999 0.499999 0.500001 Cr\n0.000000 0.000000 0.000000 C\n","nsites":2,"nelements":2,"elements":["Cr","C"],"chemical_system":"C-Cr","density":6.165146286864192,"density_atomic":0.11601073247941761,"volume":17.239784261812467,"volume_molar":5.191020374833369,"formula_full":"Cr1 C1","formula_reduced":"CrC","formula_anonymous":"AB","energy_above_hull":3.6492337,"spacegroup":225},{"id":"jvasp-92687","created_at":"2022-09-04T14:36:33.435596Z","updated_at":"2022-09-04T14:36:33.435628Z","structure_string":"V2 N3\n1.0\n-1.409054 -2.440545 0.000009\n-1.409047 2.440542 -0.000000\n0.000005 0.000004 -6.266830\nV N\n2 3\ndirect\n0.333335 0.666666 0.699019 V\n0.666665 0.333330 0.300981 V\n-0.000000 -0.000001 0.500000 N\n0.000005 0.000001 0.893332 N\n-0.000006 -0.000003 0.106668 N\n","nsites":5,"nelements":2,"elements":["V","N"],"chemical_system":"N-V","density":5.544063890355987,"density_atomic":0.11600560773775838,"volume":43.101364645258975,"volume_molar":5.19124969683674,"formula_full":"V2 N3","formula_reduced":"V2N3","formula_anonymous":"A2B3","energy_above_hull":4.96872563,"spacegroup":164},{"id":"jvasp-53350","created_at":"2022-09-04T14:38:27.598965Z","updated_at":"2022-09-04T14:38:27.598994Z","structure_string":"H8 O4\n1.0\n4.205185 -0.104286 0.000000\n-2.192907 3.589653 -0.000000\n0.000000 -0.000000 6.958196\nH O\n8 4\ndirect\n0.008414 0.487165 0.557065 H\n0.512835 -0.008415 0.557065 H\n0.321836 0.678163 0.857499 H\n0.535018 0.464981 0.077580 H\n0.464981 0.535017 0.577580 H\n0.678164 0.321835 0.357499 H\n0.487165 0.008414 0.057065 H\n-0.008416 0.512834 0.057065 H\n0.315675 0.684323 0.002452 O\n0.334526 0.665473 0.618340 O\n0.684324 0.315675 0.502452 O\n0.665474 0.334525 0.118340 O\n","nsites":12,"nelements":2,"elements":["H","O"],"chemical_system":"H-O","density":1.156766549290659,"density_atomic":0.11600504108781878,"volume":103.44378043809056,"volume_molar":5.1912750545392985,"formula_full":"H8 O4","formula_reduced":"H2O","formula_anonymous":"AB2","energy_above_hull":1.9198678333333328,"spacegroup":36},{"id":"jvasp-119424","created_at":"2022-09-04T14:38:33.152830Z","updated_at":"2022-09-04T14:38:33.152857Z","structure_string":"Li5 Ti2 Fe3 O10\n1.0\n4.823547 -0.009402 1.617873\n0.330038 4.704429 1.687098\n0.019949 0.073185 7.630693\nLi Ti Fe O\n5 2 3 10\ndirect\n0.502553 0.783685 0.409874 Li\n0.517458 0.585695 0.789040 Li\n0.998007 0.501480 0.501450 Li\n0.493433 0.219349 0.592938 Li\n0.478646 0.417179 0.213791 Li\n0.005916 0.876117 0.705011 Ti\n0.990096 0.127007 0.297674 Ti\n0.997327 0.696961 0.101094 Fe\n-0.001255 0.306039 0.901851 Fe\n0.497845 0.001354 0.001426 Fe\n0.228104 0.134613 0.451823 O\n0.224523 0.961676 0.858294 O\n0.767889 0.868424 0.551053 O\n0.757932 0.637150 0.956356 O\n0.227263 0.765537 0.242682 O\n0.241753 0.553222 0.661261 O\n0.754272 0.449804 0.341636 O\n0.768762 0.237373 0.760333 O\n0.238232 0.365921 0.046517 O\n0.771420 0.041332 0.144556 O\n","nsites":20,"nelements":4,"elements":["Li","Ti","Fe","O"],"chemical_system":"Fe-Li-O-Ti","density":4.409285094150263,"density_atomic":0.1159615322342129,"volume":172.47098770310373,"volume_molar":5.193222824821598,"formula_full":"Li5 Ti2 Fe3 O10","formula_reduced":"Li5Ti2Fe3O10","formula_anonymous":"A2B3C5D10","energy_above_hull":2.7651009083333333,"spacegroup":2}]}