{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=469","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=467","results":[{"id":"jvasp-96071","created_at":"2022-09-04T14:35:58.529860Z","updated_at":"2022-09-04T14:35:58.529884Z","structure_string":"Eu2 Al4 Cl16\n1.0\n6.800734 0.000000 0.000000\n0.000000 6.444818 -0.346929\n0.000000 0.285827 12.999106\nEu Al Cl\n2 4 16\ndirect\n0.175887 0.500000 0.250000 Eu\n0.824112 0.500001 0.750000 Eu\n0.258048 0.665561 0.912429 Al\n0.258048 0.334440 0.587571 Al\n0.741952 0.334440 0.087571 Al\n0.741952 0.665561 0.412429 Al\n0.845572 0.645287 0.128530 Cl\n0.154427 0.354714 0.871470 Cl\n0.154427 0.645287 0.628530 Cl\n0.491510 0.233518 0.178309 Cl\n0.491510 0.766483 0.321692 Cl\n0.508489 0.766483 0.821692 Cl\n0.508489 0.233518 0.678309 Cl\n0.001459 0.840974 0.371338 Cl\n0.998540 0.840975 0.871339 Cl\n0.660984 0.289085 0.926976 Cl\n0.660984 0.710916 0.573024 Cl\n0.339015 0.710916 0.073024 Cl\n0.339015 0.289085 0.426976 Cl\n0.845572 0.354714 0.371470 Cl\n0.001459 0.159026 0.128662 Cl\n0.998540 0.159026 0.628662 Cl\n","nsites":22,"nelements":3,"elements":["Eu","Al","Cl"],"chemical_system":"Al-Cl-Eu","density":2.850253109249881,"density_atomic":0.03856816755995973,"volume":570.4185962633006,"volume_molar":15.614277630996392,"formula_full":"Eu2 Al4 Cl16","formula_reduced":"Eu(AlCl4)2","formula_anonymous":"AB2C8","energy_above_hull":0.4725125581818182,"spacegroup":13},{"id":"jvasp-97836","created_at":"2022-09-04T14:35:52.840832Z","updated_at":"2022-09-04T14:35:52.840848Z","structure_string":"Ho6 Ta2 O14\n1.0\n6.443352 0.030496 -0.000000\n-2.108545 6.088658 -0.000000\n-0.000000 0.000000 7.428855\nHo Ta O\n6 2 14\ndirect\n0.464323 0.000126 0.008520 Ho\n0.535677 -0.000125 0.508520 Ho\n0.000125 0.464323 0.491481 Ho\n-0.000126 0.535678 0.991481 Ho\n0.467540 0.467541 0.750000 Ho\n0.532459 0.532460 0.250000 Ho\n0.998167 0.998169 0.750000 Ta\n0.001832 0.001832 0.250000 Ta\n0.082980 0.329414 0.775097 O\n0.917019 0.670587 0.275097 O\n0.946637 0.689024 0.705749 O\n0.929886 0.070115 0.500000 O\n0.310977 0.053362 0.294251 O\n0.670586 0.917021 0.224904 O\n0.329414 0.082980 0.724904 O\n0.629405 0.370595 0.000000 O\n0.370594 0.629406 0.500000 O\n0.638991 0.361009 0.500000 O\n0.361008 0.638992 0.000000 O\n0.070113 0.929886 0.000000 O\n0.689022 0.946639 0.794252 O\n0.053362 0.310977 0.205749 O\n","nsites":22,"nelements":3,"elements":["Ho","Ta","O"],"chemical_system":"Ho-O-Ta","density":8.961742671745194,"density_atomic":0.07536264169756249,"volume":291.9218263113455,"volume_molar":7.990883313469066,"formula_full":"Ho6 Ta2 O14","formula_reduced":"Ho3TaO7","formula_anonymous":"AB3C7","energy_above_hull":2.721479127272727,"spacegroup":20},{"id":"jvasp-88488","created_at":"2022-09-04T14:36:04.791377Z","updated_at":"2022-09-04T14:36:04.791394Z","structure_string":"K2 V4 Cr2 O14\n1.0\n4.849462 0.000000 0.000000\n0.000000 6.765468 -1.375368\n0.000000 -0.016035 8.118572\nK V Cr O\n2 4 2 14\ndirect\n0.603843 0.750000 0.500000 K\n0.396156 0.250000 0.500000 K\n0.998314 0.877460 0.176700 V\n0.001685 0.122539 0.823299 V\n0.001685 0.377460 0.176701 V\n0.998314 0.622539 0.823299 V\n0.500000 0.500000 -0.000000 Cr\n0.500000 0.000000 0.000000 Cr\n0.326916 0.016249 0.788358 O\n0.673083 0.516249 0.788358 O\n0.290503 0.750000 -0.000000 O\n0.709496 0.250000 -0.000000 O\n0.838908 0.613988 0.115740 O\n0.161091 0.113988 0.115740 O\n0.838908 0.886012 0.884259 O\n0.132561 0.881412 0.361691 O\n0.867438 0.381411 0.361691 O\n0.132561 0.618588 0.638309 O\n0.867438 0.118588 0.638309 O\n0.673083 0.983750 0.211642 O\n0.326916 0.483750 0.211642 O\n0.161091 0.386012 0.884259 O\n","nsites":22,"nelements":4,"elements":["K","V","Cr","O"],"chemical_system":"Cr-K-O-V","density":3.804031746429514,"density_atomic":0.08262777222544868,"volume":266.254304182053,"volume_molar":7.288276807909907,"formula_full":"K2 V4 Cr2 O14","formula_reduced":"KV2CrO7","formula_anonymous":"ABC2D7","energy_above_hull":3.019404390909091,"spacegroup":13},{"id":"jvasp-88858","created_at":"2022-09-04T14:35:52.740239Z","updated_at":"2022-09-04T14:35:52.740269Z","structure_string":"U1 Mo5 O16\n1.0\n4.129986 0.000000 0.000000\n0.000000 7.212286 -0.039755\n0.000000 -0.019240 9.930437\nU Mo O\n1 5 16\ndirect\n0.997469 0.000000 0.000000 U\n0.891995 0.500000 -0.000000 Mo\n0.897638 0.248378 0.319124 Mo\n0.090987 0.749782 0.318957 Mo\n0.090987 0.250219 0.681044 Mo\n0.897638 0.751623 0.680877 Mo\n0.995542 0.296017 0.875572 O\n0.994847 0.500866 0.650444 O\n0.996932 -0.001148 0.247774 O\n0.996932 0.001148 0.752227 O\n0.994847 0.499134 0.349556 O\n0.994038 0.194431 0.499807 O\n0.980247 0.710497 0.878415 O\n0.477845 0.500000 -0.000000 O\n0.497446 0.000000 0.000000 O\n0.483350 0.751645 0.682773 O\n0.483350 0.248357 0.317227 O\n0.505096 0.750164 0.317576 O\n0.505096 0.249836 0.682424 O\n0.994038 0.805570 0.500193 O\n0.980247 0.289505 0.121586 O\n0.995542 0.703984 0.124428 O\n","nsites":22,"nelements":3,"elements":["U","Mo","O"],"chemical_system":"Mo-O-U","density":5.466352552656068,"density_atomic":0.07437679135680679,"volume":295.79119505787355,"volume_molar":8.096800964577866,"formula_full":"U1 Mo5 O16","formula_reduced":"UMo5O16","formula_anonymous":"AB5C16","energy_above_hull":4.194491886363636,"spacegroup":3},{"id":"jvasp-96074","created_at":"2022-09-04T14:36:05.113860Z","updated_at":"2022-09-04T14:36:05.113887Z","structure_string":"Y6 Al4 Ni12\n1.0\n7.298979 -0.000000 -2.580579\n-3.649490 6.321102 -2.580579\n0.000000 0.000000 7.741737\nY Al Ni\n6 4 12\ndirect\n0.293693 -0.000000 0.293693 Y\n0.706307 -0.000000 0.706307 Y\n0.706307 0.706307 -0.000000 Y\n-0.000000 0.706307 0.706307 Y\n0.293693 0.293693 -0.000000 Y\n-0.000000 0.293693 0.293693 Y\n-0.000000 -0.000000 0.500000 Al\n0.500000 0.500000 0.500000 Al\n0.500000 0.000000 -0.000000 Al\n-0.000000 0.500000 -0.000000 Al\n0.333969 0.666985 0.666985 Ni\n0.666985 -0.000000 0.333015 Ni\n0.666985 0.333015 -0.000000 Ni\n-0.000000 0.333015 0.666985 Ni\n0.666031 0.333015 0.333015 Ni\n0.333015 -0.000000 0.666985 Ni\n0.333015 0.333015 0.666031 Ni\n0.333015 0.666031 0.333015 Ni\n0.333015 0.666985 -0.000000 Ni\n0.666985 0.666985 0.333969 Ni\n-0.000000 0.666985 0.333015 Ni\n0.666985 0.333969 0.666985 Ni\n","nsites":22,"nelements":3,"elements":["Y","Al","Ni"],"chemical_system":"Al-Ni-Y","density":6.2560214958781115,"density_atomic":0.0615927159452824,"volume":357.18509343774207,"volume_molar":9.777358682071979,"formula_full":"Y6 Al4 Ni12","formula_reduced":"Y3(AlNi3)2","formula_anonymous":"A2B3C6","energy_above_hull":1.961431486363636,"spacegroup":229},{"id":"jvasp-87325","created_at":"2022-09-04T14:35:48.969859Z","updated_at":"2022-09-04T14:35:48.969880Z","structure_string":"Ca4 Cr2 O16\n1.0\n4.113227 3.811738 -0.647808\n-4.113227 3.811738 0.647808\n-0.243816 0.000000 9.538470\nCa Cr O\n4 2 16\ndirect\n0.563484 0.948862 0.459329 Ca\n0.563482 0.948864 0.959329 Ca\n0.051139 0.436517 0.459329 Ca\n0.051136 0.436518 0.959329 Ca\n0.165773 0.834227 0.157687 Cr\n0.165774 0.834227 0.657687 Cr\n0.630935 0.544923 0.885454 O\n0.630938 0.544920 0.385454 O\n0.455078 0.369065 0.885454 O\n0.455080 0.369063 0.385454 O\n0.795186 0.204814 0.643061 O\n0.795184 0.204816 0.143060 O\n0.348741 0.651259 0.612570 O\n0.187004 0.812997 0.334944 O\n0.187003 0.812998 0.834943 O\n0.833323 0.166678 0.286149 O\n0.894774 0.744833 0.586886 O\n0.894772 0.744834 0.086887 O\n0.255167 0.105226 0.586886 O\n0.255166 0.105229 0.086887 O\n0.348741 0.651260 0.112569 O\n0.833321 0.166679 0.786149 O\n","nsites":22,"nelements":3,"elements":["Ca","Cr","O"],"chemical_system":"Ca-Cr-O","density":2.900252925089758,"density_atomic":0.07385163903903998,"volume":297.8945394613409,"volume_molar":8.154376583052589,"formula_full":"Ca4 Cr2 O16","formula_reduced":"Ca2CrO8","formula_anonymous":"AB2C8","energy_above_hull":2.3810187490909085,"spacegroup":8},{"id":"jvasp-96989","created_at":"2022-09-04T14:35:49.875545Z","updated_at":"2022-09-04T14:35:49.875572Z","structure_string":"Bi4 Ru4 O14\n1.0\n6.348930 -0.000000 3.665556\n2.116310 5.985828 3.665556\n0.000000 -0.000000 7.331113\nBi Ru O\n4 4 14\ndirect\n0.500000 0.500000 0.500000 Bi\n-0.000000 0.500000 0.500000 Bi\n0.500000 0.000000 0.500000 Bi\n0.500000 0.500000 0.000000 Bi\n0.000000 0.000000 0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n0.500000 0.000000 0.000000 Ru\n-0.000000 0.500000 0.000000 Ru\n0.077477 0.672523 0.077478 O\n0.672523 0.077477 0.672523 O\n0.672523 0.077477 0.077478 O\n0.625000 0.625000 0.625000 O\n0.922523 0.327477 0.327478 O\n0.327477 0.922523 0.327478 O\n0.327477 0.327477 0.922523 O\n0.922523 0.922523 0.327478 O\n0.922523 0.327477 0.922523 O\n0.077477 0.672523 0.672523 O\n0.327477 0.922523 0.922523 O\n0.375000 0.375000 0.375000 O\n0.672523 0.672523 0.077478 O\n0.077477 0.077477 0.672523 O\n","nsites":22,"nelements":3,"elements":["Bi","Ru","O"],"chemical_system":"Bi-O-Ru","density":8.72675527410098,"density_atomic":0.07896379183096458,"volume":278.6087077365122,"volume_molar":7.626458431595354,"formula_full":"Bi4 Ru4 O14","formula_reduced":"Bi2Ru2O7","formula_anonymous":"A2B2C7","energy_above_hull":2.925661281818181,"spacegroup":227},{"id":"jvasp-96513","created_at":"2022-09-04T14:35:58.177912Z","updated_at":"2022-09-04T14:35:58.177925Z","structure_string":"Cd6 B4 O12\n1.0\n4.826968 0.000000 0.000000\n0.000000 6.046836 0.000000\n0.000000 0.000000 9.111821\nCd B O\n6 4 12\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.000000 0.689206 Cd\n0.000000 0.500000 0.810794 Cd\n0.500000 0.000000 0.310794 Cd\n0.000000 0.500000 0.189206 Cd\n0.500000 0.500000 0.500000 Cd\n0.033528 0.239860 0.500000 B\n0.533528 0.260140 0.000000 B\n0.966473 0.760141 0.500000 B\n0.466472 0.739860 0.000000 B\n0.678149 0.217904 0.130339 O\n0.821852 0.717904 0.369661 O\n0.178149 0.282096 0.369661 O\n0.821852 0.717904 0.630339 O\n0.242094 0.821320 0.500000 O\n0.757907 0.178680 0.500000 O\n0.257906 0.321320 0.000000 O\n0.678149 0.217904 0.869660 O\n0.178149 0.282096 0.630339 O\n0.321851 0.782097 0.869660 O\n0.321851 0.782097 0.130339 O\n0.742094 0.678681 0.000000 O\n","nsites":22,"nelements":3,"elements":["Cd","B","O"],"chemical_system":"B-Cd-O","density":5.679901962637372,"density_atomic":0.08272083156654106,"volume":265.95477322182245,"volume_molar":7.280077636980425,"formula_full":"Cd6 B4 O12","formula_reduced":"Cd3(BO3)2","formula_anonymous":"A2B3C6","energy_above_hull":1.7802550378787876,"spacegroup":58},{"id":"jvasp-48716","created_at":"2022-09-04T14:35:53.042754Z","updated_at":"2022-09-04T14:35:53.042774Z","structure_string":"Mn2 P2 H4 C2 O12\n1.0\n5.990732 0.000000 -0.010361\n-2.995366 7.488367 0.005180\n-2.069203 0.000000 5.146931\nMn P H C O\n2 2 4 2 12\ndirect\n0.194318 0.388638 0.500000 Mn\n0.805681 0.611363 0.500000 Mn\n0.330296 0.660591 0.000000 P\n0.669704 0.339409 0.000000 P\n0.179182 0.811351 0.180229 H\n0.632167 0.811351 0.819771 H\n0.367832 0.188650 0.180229 H\n0.820818 0.188650 0.819771 H\n0.102520 -0.000000 0.447799 C\n0.897480 -0.000000 0.552201 C\n0.816585 0.216260 -0.009773 O\n0.399674 0.216260 0.009773 O\n0.611226 0.448580 0.749840 O\n0.745973 0.849155 0.590062 O\n0.254027 0.150845 0.409937 O\n0.103181 0.849155 0.409937 O\n0.600326 0.783741 -0.009773 O\n0.183414 0.783741 0.009773 O\n0.162648 0.551420 0.749840 O\n0.837352 0.448580 0.250160 O\n0.388773 0.551420 0.250160 O\n0.896818 0.150845 0.590062 O\n","nsites":22,"nelements":5,"elements":["Mn","P","H","C","O"],"chemical_system":"C-H-Mn-O-P","density":2.820183431781415,"density_atomic":0.09534751866795538,"volume":230.7348980586929,"volume_molar":6.315991065244089,"formula_full":"Mn2 P2 H4 C2 O12","formula_reduced":"MnPH2CO6","formula_anonymous":"ABCD2E6","energy_above_hull":3.472329431034483,"spacegroup":12},{"id":"jvasp-63583","created_at":"2022-09-04T14:36:05.466509Z","updated_at":"2022-09-04T14:36:05.466538Z","structure_string":"Sr2 Cu4 B4 O12\n1.0\n-4.551054 4.551054 3.314955\n4.551054 -4.551054 3.314955\n4.551054 4.551054 -3.314955\nSr Cu B O\n2 4 4 12\ndirect\n0.749999 0.749999 0.000000 Sr\n0.250000 0.250000 0.000000 Sr\n0.614050 0.885948 0.500000 Cu\n0.385949 0.114051 0.500000 Cu\n0.885948 0.385949 0.271897 Cu\n0.114051 0.614050 0.728102 Cu\n0.703973 0.203973 0.907946 B\n0.203973 0.296026 0.500000 B\n0.296026 0.796026 0.092053 B\n0.796026 0.703973 0.500000 B\n0.598030 0.098031 0.696061 O\n0.401969 0.901968 0.303938 O\n0.901968 0.598030 0.500000 O\n0.672006 0.353214 0.025221 O\n0.327993 0.646785 0.974779 O\n0.353214 0.327993 0.681207 O\n0.646785 0.672006 0.318792 O\n0.827992 0.853214 0.681207 O\n0.172007 0.146785 0.318792 O\n0.146785 0.827992 0.974779 O\n0.853214 0.172007 0.025221 O\n0.098031 0.401969 0.500000 O\n","nsites":22,"nelements":4,"elements":["Sr","Cu","B","O"],"chemical_system":"B-Cu-O-Sr","density":4.018718235596185,"density_atomic":0.08010526749190795,"volume":274.6386185180942,"volume_molar":7.517783722035935,"formula_full":"Sr2 Cu4 B4 O12","formula_reduced":"SrCu2(BO3)2","formula_anonymous":"AB2C2D6","energy_above_hull":2.2343248524242423,"spacegroup":140},{"id":"jvasp-91355","created_at":"2022-09-04T14:35:49.570612Z","updated_at":"2022-09-04T14:35:49.570645Z","structure_string":"Tl8 Pb2 I12\n1.0\n4.593668 0.000000 0.000000\n0.000000 9.938296 0.000000\n0.000000 0.000000 19.209729\nTl Pb I\n8 2 12\ndirect\n0.500000 0.893653 0.580136 Tl\n0.500000 0.106347 0.419864 Tl\n0.500000 0.707252 0.795529 Tl\n0.500000 0.292749 0.204471 Tl\n0.500000 0.207251 0.704471 Tl\n0.500000 0.792749 0.295529 Tl\n0.500000 0.606347 0.080136 Tl\n0.500000 0.393653 0.919865 Tl\n0.000000 0.500000 0.500000 Pb\n0.000000 0.000000 0.000000 Pb\n0.000000 0.306101 0.054633 I\n0.000000 0.591154 0.213850 I\n0.000000 0.806101 0.445367 I\n0.500000 0.058993 0.883497 I\n0.500000 0.941008 0.116503 I\n0.500000 0.558993 0.616503 I\n0.500000 0.441007 0.383497 I\n0.000000 0.908847 0.713850 I\n0.000000 0.091153 0.286150 I\n0.000000 0.408847 0.786151 I\n0.000000 0.193899 0.554633 I\n0.000000 0.693900 0.945367 I\n","nsites":22,"nelements":3,"elements":["Tl","Pb","I"],"chemical_system":"I-Pb-Tl","density":6.764048106095185,"density_atomic":0.025085912962060804,"volume":876.9862206439188,"volume_molar":24.00606575135499,"formula_full":"Tl8 Pb2 I12","formula_reduced":"Tl4PbI6","formula_anonymous":"AB4C6","energy_above_hull":0.0,"spacegroup":55},{"id":"jvasp-62736","created_at":"2022-09-04T14:35:53.515646Z","updated_at":"2022-09-04T14:35:53.515662Z","structure_string":"Cd2 B4 H16\n1.0\n6.034284 -0.000000 0.000000\n0.000000 6.034284 0.000000\n0.000000 0.000000 5.789897\nCd B H\n2 4 16\ndirect\n0.000000 0.000000 0.996519 Cd\n0.500000 0.500000 0.496519 Cd\n0.273169 0.273169 0.224078 B\n0.726830 0.726830 0.224078 B\n0.773169 0.226831 0.724079 B\n0.226831 0.773169 0.724079 B\n0.699638 0.699638 0.019249 H\n0.300361 0.300361 0.019249 H\n0.365361 0.634638 0.791090 H\n0.634638 0.365361 0.791090 H\n0.865361 0.865361 0.291090 H\n0.134638 0.134638 0.291090 H\n0.198073 0.447915 0.303663 H\n0.052085 0.698072 0.803663 H\n0.947914 0.301927 0.803663 H\n0.800361 0.199639 0.519249 H\n0.301927 0.947914 0.803663 H\n0.698072 0.052085 0.803663 H\n0.552085 0.801927 0.303663 H\n0.447915 0.198073 0.303663 H\n0.801927 0.552085 0.303663 H\n0.199639 0.800361 0.519249 H\n","nsites":22,"nelements":3,"elements":["Cd","B","H"],"chemical_system":"B-Cd-H","density":2.23841292582964,"density_atomic":0.10435189753632768,"volume":210.8251073473888,"volume_molar":5.77099305540039,"formula_full":"Cd2 B4 H16","formula_reduced":"Cd(BH4)2","formula_anonymous":"AB2C8","energy_above_hull":3.039364083333333,"spacegroup":102}]}