{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=113","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=111","results":[{"id":"jvasp-98076","created_at":"2022-09-04T14:36:05.216715Z","updated_at":"2022-09-04T14:36:05.216749Z","structure_string":"Ba8 Ti4 Pt2 O20\n1.0\n5.816645 0.000000 -0.000000\n-2.908323 6.754937 -0.000000\n0.000000 -0.000000 13.187861\nBa Ti Pt O\n8 4 2 20\ndirect\n0.530601 0.061202 0.140670 Ba\n0.765637 0.531271 0.892407 Ba\n0.265636 0.531271 0.607593 Ba\n0.969401 0.938799 0.640670 Ba\n0.030601 0.061202 0.359330 Ba\n0.734365 0.468729 0.392407 Ba\n0.469400 0.938799 0.859330 Ba\n0.234365 0.468729 0.107593 Ba\n0.136802 0.273604 0.844520 Ti\n0.363199 0.726397 0.344520 Ti\n0.863199 0.726397 0.155480 Ti\n0.636802 0.273604 0.655480 Ti\n0.000000 0.000000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.229585 0.459170 0.347384 O\n0.384511 0.221039 0.537956 O\n0.884511 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7.015172\nNa Sc B O\n6 4 6 18\ndirect\n0.417684 0.082115 0.750175 Na\n0.749906 0.417791 0.082325 Na\n0.917722 0.249942 0.582330 Na\n0.249860 0.582143 0.917976 Na\n0.582083 0.917817 0.250125 Na\n0.082046 0.749990 0.417970 Na\n0.827370 0.827454 0.827637 Sc\n0.172397 0.172479 0.172663 Sc\n0.327367 0.327453 0.327639 Sc\n0.672399 0.672479 0.672661 Sc\n0.249892 0.909649 0.590459 B\n0.090194 0.409647 0.750146 B\n0.909573 0.590285 0.250154 B\n0.590201 0.249972 0.909829 B\n0.749875 0.090284 0.409841 B\n0.409566 0.749960 0.090471 B\n0.570276 0.749936 0.929787 O\n0.929518 0.570357 0.750122 O\n0.749854 0.929603 0.570548 O\n0.429491 0.249997 0.070513 O\n0.070249 0.429575 0.250178 O\n0.249913 0.070329 0.429752 O\n0.844341 0.685007 0.095337 O\n0.684930 0.095151 0.844610 O\n0.814844 0.655564 0.404937 O\n0.404680 0.814920 0.655736 O\n0.655465 0.404768 0.815085 O\n0.155426 0.314927 0.904963 O\n0.904690 0.155522 0.315120 O\n0.184924 0.344368 0.595363 O\n0.595087 0.185012 0.344564 O\n0.344302 0.595165 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8.145011\nPr P Ru\n2 24 8\ndirect\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.000000 Pr\n0.643772 0.500000 0.857239 P\n0.500000 0.857239 0.643772 P\n0.000000 0.642761 0.143777 P\n0.000000 0.357238 0.856223 P\n0.000000 0.642761 0.856223 P\n0.357238 0.856223 0.000000 P\n0.856223 0.000000 0.642761 P\n0.856223 0.000000 0.357238 P\n0.642761 0.143777 0.000000 P\n0.642761 0.856223 0.000000 P\n0.357238 0.143777 0.000000 P\n0.143777 0.000000 0.642761 P\n0.000000 0.357238 0.143777 P\n0.500000 0.142761 0.643772 P\n0.500000 0.857239 0.356228 P\n0.143777 0.000000 0.357238 P\n0.857239 0.356228 0.500000 P\n0.356228 0.500000 0.142761 P\n0.500000 0.142761 0.356228 P\n0.142761 0.643772 0.500000 P\n0.643772 0.500000 0.142761 P\n0.142761 0.356228 0.500000 P\n0.857239 0.643772 0.500000 P\n0.356228 0.500000 0.857239 P\n0.749998 0.749998 0.250002 Ru\n0.250002 0.749998 0.250002 Ru\n0.749998 0.250002 0.250002 Ru\n0.250002 0.250002 0.749998 Ru\n0.749998 0.749998 0.749998 Ru\n0.749998 0.250002 0.749998 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O\n0.141160 0.832905 0.433582 O\n0.250001 0.404153 0.595847 O\n","nsites":34,"nelements":3,"elements":["Na","Fe","O"],"chemical_system":"Fe-Na-O","density":3.8587335833654617,"density_atomic":0.08026252102559789,"volume":423.609918621376,"volume_molar":7.503054580206093,"formula_full":"Na6 Fe10 O18","formula_reduced":"Na3Fe5O9","formula_anonymous":"A3B5C9","energy_above_hull":2.621643294117647,"spacegroup":15},{"id":"jvasp-95470","created_at":"2022-09-04T14:36:33.350894Z","updated_at":"2022-09-04T14:36:33.350919Z","structure_string":"Cr4 Te8 O22\n1.0\n6.857583 0.000000 -1.219963\n0.000000 7.634199 0.000000\n-0.041705 0.000000 9.785019\nCr Te O\n4 8 22\ndirect\n0.318819 0.500451 0.384044 Cr\n0.681180 0.000451 0.115956 Cr\n0.681180 0.499549 0.615956 Cr\n0.318819 0.999550 0.884044 Cr\n0.681146 0.639499 0.915382 Te\n0.318853 0.360501 0.084618 Te\n0.681146 0.860501 0.415382 Te\n0.318853 0.139499 0.584618 Te\n0.850725 0.139883 0.823264 Te\n0.850726 0.360117 0.323264 Te\n0.149274 0.860117 0.176737 Te\n0.149273 0.639883 0.676737 Te\n0.469889 0.134085 0.765701 O\n0.206387 0.882968 0.708158 O\n0.793612 0.382968 0.791842 O\n0.793612 0.117032 0.291842 O\n0.206387 0.617032 0.208158 O\n0.126550 0.187677 0.843306 O\n0.873448 0.687677 0.656694 O\n0.873449 0.812324 0.156694 O\n0.126551 0.312324 0.343306 O\n0.530109 0.634085 0.734299 O\n0.565184 0.637191 0.449071 O\n0.469890 0.365915 0.265701 O\n0.565184 0.862809 0.949071 O\n0.434815 0.362809 0.550929 O\n0.434815 0.137191 0.050929 O\n0.499999 0.000000 0.500000 O\n0.156327 0.851880 0.983297 O\n0.843671 0.351880 0.516703 O\n0.843672 0.148120 0.016703 O\n0.156328 0.648120 0.483297 O\n0.530110 0.865915 0.234299 O\n0.500000 0.500000 0.000000 O\n","nsites":34,"nelements":3,"elements":["Cr","Te","O"],"chemical_system":"Cr-O-Te","density":5.128038896908582,"density_atomic":0.06642202555314541,"volume":511.87839751734174,"volume_molar":9.066481652507843,"formula_full":"Cr4 Te8 O22","formula_reduced":"Cr2Te4O11","formula_anonymous":"A2B4C11","energy_above_hull":2.84655378627451,"spacegroup":14},{"id":"jvasp-99320","created_at":"2022-09-04T14:36:33.584605Z","updated_at":"2022-09-04T14:36:33.584627Z","structure_string":"Ta4 Tl8 S22\n1.0\n7.873638 -0.011283 0.159596\n0.601221 8.470247 2.689875\n-0.022643 0.012141 13.340963\nTa Tl S\n4 8 22\ndirect\n0.879828 0.634648 0.696581 Ta\n0.665435 0.892989 0.809564 Ta\n0.334566 0.107011 0.190436 Ta\n0.120172 0.365353 0.303418 Ta\n0.750064 0.580854 0.417967 Tl\n0.064851 0.762494 0.977738 Tl\n0.502607 0.718158 0.115876 Tl\n0.497393 0.281842 0.884124 Tl\n0.778986 0.032406 0.429297 Tl\n0.221015 0.967594 0.570702 Tl\n0.249937 0.419147 0.582033 Tl\n0.935150 0.237507 0.022262 Tl\n0.728825 0.600608 0.889866 S\n0.591418 0.926191 0.252400 S\n0.408582 0.073810 0.747600 S\n0.962631 0.870293 0.745893 S\n0.037369 0.129708 0.254106 S\n0.989629 0.292910 0.466055 S\n0.471856 0.683164 0.882013 S\n0.728837 0.962179 0.956196 S\n0.271164 0.037822 0.043804 S\n0.363472 0.856158 0.333467 S\n0.636528 0.143843 0.666533 S\n0.396463 0.437779 0.347956 S\n0.603537 0.562221 0.652044 S\n0.113179 0.488119 0.814119 S\n0.886821 0.511882 0.185881 S\n0.042304 0.651244 0.244001 S\n0.957697 0.348756 0.755999 S\n0.391326 0.194797 0.369628 S\n0.608674 0.805203 0.630372 S\n0.010371 0.707090 0.533945 S\n0.528145 0.316836 0.117987 S\n0.271175 0.399392 0.110134 S\n","nsites":34,"nelements":3,"elements":["Ta","Tl","S"],"chemical_system":"S-Ta-Tl","density":5.719860886415762,"density_atomic":0.03821956298139263,"volume":889.5967757808495,"volume_molar":15.756697068807162,"formula_full":"Ta4 Tl8 S22","formula_reduced":"Ta2Tl4S11","formula_anonymous":"A2B4C11","energy_above_hull":2.2984475764705885,"spacegroup":2},{"id":"jvasp-112184","created_at":"2022-09-04T14:38:45.246007Z","updated_at":"2022-09-04T14:38:45.246038Z","structure_string":"Cd1 H18 C11 O4\n1.0\n3.819669 0.064400 0.186068\n0.762545 4.297714 0.307606\n0.176794 0.019628 15.959239\nCd H C O\n1 18 11 4\ndirect\n0.121267 0.085517 0.853915 Cd\n0.715342 0.369603 0.482329 H\n0.507913 0.844469 0.564669 H\n0.648126 0.884868 0.130242 H\n-0.016344 0.898675 0.249246 H\n0.416396 0.877176 0.283955 H\n0.747502 0.890322 0.406166 H\n0.184509 0.860366 0.439142 H\n0.151355 0.341179 0.514965 H\n0.229038 0.878692 0.091322 H\n0.472665 0.369519 0.026937 H\n0.888590 0.355288 0.069093 H\n0.193259 0.388011 0.180239 H\n0.623994 0.373113 0.214674 H\n0.942013 0.393200 0.331250 H\n0.377826 0.364173 0.364272 H\n0.521062 0.298345 0.632489 H\n0.950454 0.285795 0.664513 H\n0.946979 0.825096 0.596108 H\n0.766567 0.687910 0.966566 C\n0.651770 0.517148 0.046035 C\n0.472293 0.727159 0.114998 C\n0.381107 0.536247 0.194759 C\n0.225816 0.732983 0.268425 C\n0.759777 0.682708 0.578035 C\n0.990439 0.720785 0.422896 C\n0.906648 0.510803 0.499396 C\n0.700552 0.448755 0.650760 C\n0.536331 0.571974 0.733386 C\n0.136173 0.534046 0.346742 C\n0.603779 0.965980 0.946079 O\n0.594868 0.387088 0.799611 O\n0.333637 0.839659 0.733817 O\n0.037422 0.562211 0.922152 O\n","nsites":34,"nelements":4,"elements":["Cd","H","C","O"],"chemical_system":"C-Cd-H-O","density":2.0780024958155856,"density_atomic":0.13024698199228865,"volume":261.0425169161539,"volume_molar":4.623631709452234,"formula_full":"Cd1 H18 C11 O4","formula_reduced":"CdH18C11O4","formula_anonymous":"AB4C11D18","energy_above_hull":4.563704227941177,"spacegroup":1}]}