{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-id&page=3528","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-id&page=3526","results":[{"id":"jvasp-119288","created_at":"2022-09-04T14:38:50.310579Z","updated_at":"2022-09-04T14:38:50.310606Z","structure_string":"Li2 Ga2 W4 O16\n1.0\n5.700089 -0.000000 0.000000\n0.000000 4.934866 0.060166\n-0.000000 -0.059608 9.320844\nLi Ga W O\n2 2 4 16\ndirect\n0.341075 0.250000 0.500000 Li\n0.658925 0.750000 0.500000 Li\n0.331656 0.250000 0.000000 Ga\n0.668344 0.750001 0.000000 Ga\n0.181913 0.755090 0.748375 W\n0.181913 0.744911 0.251626 W\n0.818088 0.255090 0.748374 W\n0.818088 0.244910 0.251625 W\n0.380125 0.899963 0.626309 O\n0.380125 0.600038 0.373691 O\n0.898478 0.563117 0.350603 O\n0.619875 0.100038 0.373691 O\n0.617912 0.089845 0.885543 O\n0.617912 0.410154 0.114456 O\n0.382089 0.910155 0.114457 O\n0.882463 0.926088 0.131038 O\n0.101522 0.436884 0.649397 O\n0.882463 0.573912 0.868963 O\n0.898478 0.936884 0.649397 O\n0.117537 0.426088 0.131037 O\n0.117537 0.073912 0.868962 O\n0.382089 0.589846 0.885543 O\n0.619875 0.399962 0.626309 O\n0.101522 0.063116 0.350603 O\n","nsites":24,"nelements":4,"elements":["Li","Ga","W","O"],"chemical_system":"Ga-Li-O-W","density":7.249139951145015,"density_atomic":0.09153035372692521,"volume":262.20809843696685,"volume_molar":6.579391988330626,"formula_full":"Li2 Ga2 W4 O16","formula_reduced":"LiGa(WO4)2","formula_anonymous":"ABC2D8","energy_above_hull":3.4064266937500003,"spacegroup":13},{"id":"jvasp-119286","created_at":"2022-09-04T14:38:48.757877Z","updated_at":"2022-09-04T14:38:48.757902Z","structure_string":"Li7 Mn4 Co1 O12\n1.0\n5.062834 -0.203134 0.018902\n-2.219633 7.106019 -1.428142\n-0.020669 0.006434 5.640185\nLi Mn Co O\n7 4 1 12\ndirect\n0.333333 0.333333 0.833334 Li\n0.493468 0.010848 0.752821 Li\n0.173198 0.655818 0.913847 Li\n0.830789 0.332269 0.586740 Li\n0.835877 0.334399 0.079928 Li\n0.179516 0.664881 0.416510 Li\n0.487150 0.001786 0.250159 Li\n0.001214 0.009239 0.502121 Mn\n0.665451 0.657427 0.164547 Mn\n0.001054 0.008615 0.002275 Mn\n0.665611 0.658052 0.664393 Mn\n0.333333 0.333333 0.333334 Co\n0.062430 0.844739 0.711780 O\n0.604236 0.821927 0.954889 O\n0.377374 0.159136 0.531014 O\n0.289292 0.507530 0.135654 O\n0.768779 0.517702 0.379704 O\n0.897887 0.148965 0.286964 O\n0.057086 0.840605 0.209410 O\n0.609581 0.826062 0.457258 O\n0.376278 0.158777 0.048433 O\n0.290388 0.507890 0.618236 O\n0.756439 0.514019 0.878239 O\n0.910225 0.152648 0.788430 O\n","nsites":24,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.302381345715432,"density_atomic":0.11975174453499757,"volume":200.41461686586098,"volume_molar":5.028854304698687,"formula_full":"Li7 Mn4 Co1 O12","formula_reduced":"Li7Mn4CoO12","formula_anonymous":"AB4C7D12","energy_above_hull":2.785541327729885,"spacegroup":2},{"id":"jvasp-119283","created_at":"2022-09-04T14:38:50.277524Z","updated_at":"2022-09-04T14:38:50.277547Z","structure_string":"Ca2 Cu4 O8\n1.0\n5.110009 0.044981 -3.582303\n-1.358087 4.926441 -3.582303\n-0.033947 -0.044981 6.240508\nCa Cu O\n2 4 8\ndirect\n0.750000 0.250000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.875000 0.625000 0.250000 Cu\n0.374999 0.625000 0.750000 Cu\n0.375000 0.125000 0.750000 Cu\n0.375000 0.625000 0.250000 Cu\n0.021664 0.943329 0.365515 O\n0.056670 0.422186 0.078335 O\n0.343850 0.978335 0.921665 O\n0.172185 0.593851 0.865516 O\n0.406149 0.271665 0.578335 O\n0.693329 0.827814 0.421665 O\n0.577813 0.656149 0.634485 O\n0.728335 0.306671 0.134485 O\n","nsites":14,"nelements":3,"elements":["Ca","Cu","O"],"chemical_system":"Ca-Cu-O","density":4.926216542605069,"density_atomic":0.08983291175252164,"volume":155.84488721203022,"volume_molar":6.703713196551215,"formula_full":"Ca2 Cu4 O8","formula_reduced":"Ca(CuO2)2","formula_anonymous":"AB2C4","energy_above_hull":1.1455850457142855,"spacegroup":88},{"id":"jvasp-119280","created_at":"2022-09-04T14:38:49.284315Z","updated_at":"2022-09-04T14:38:49.284343Z","structure_string":"Li4 Ti4 Co4 O16\n1.0\n5.757545 -0.038602 0.008178\n-0.061819 8.284699 -0.059830\n0.198215 -0.038605 5.754127\nLi Ti Co O\n4 4 4 16\ndirect\n0.501841 0.375000 0.248160 Li\n0.001852 0.875000 0.748148 Li\n0.498130 0.624997 0.751847 Li\n-0.001846 0.125003 0.251871 Li\n0.511387 0.011380 0.011365 Ti\n0.011369 0.511379 0.511367 Ti\n0.238631 0.238623 0.738630 Ti\n0.738634 0.738622 0.238613 Ti\n0.000063 0.499931 0.000074 Co\n0.749927 0.250070 0.749938 Co\n0.500071 -0.000069 0.500063 Co\n0.249938 0.750069 0.249929 Co\n0.727842 0.016113 0.738600 O\n0.227840 0.516112 0.238606 O\n0.271542 0.983263 0.260766 O\n0.771532 0.483265 0.760777 O\n0.489234 0.766737 0.478460 O\n-0.010777 0.266736 0.978470 O\n-0.007238 0.740530 0.479336 O\n0.002808 0.263903 0.516239 O\n0.270664 0.009471 0.757238 O\n0.770652 0.509469 0.257250 O\n0.733779 0.986097 0.247182 O\n0.233760 0.486098 0.747192 O\n0.011401 0.733887 0.022159 O\n0.502818 0.763904 0.016221 O\n0.492749 0.240533 0.979349 O\n0.511394 0.233888 0.522162 O\n","nsites":28,"nelements":4,"elements":["Li","Ti","Co","O"],"chemical_system":"Co-Li-O-Ti","density":4.301907523415384,"density_atomic":0.10202997525680459,"volume":274.4291560350312,"volume_molar":5.9023250224677195,"formula_full":"Li4 Ti4 Co4 O16","formula_reduced":"LiTiCoO4","formula_anonymous":"ABCD4","energy_above_hull":2.508386176190476,"spacegroup":24},{"id":"jvasp-119279","created_at":"2022-09-04T14:38:50.519522Z","updated_at":"2022-09-04T14:38:50.519553Z","structure_string":"Li4 Fe6 Te2 O16\n1.0\n5.866439 -0.093361 -0.014109\n2.806306 4.996156 -1.610272\n-0.055061 0.105373 10.127893\nLi Fe Te O\n4 6 2 16\ndirect\n0.292636 0.404785 0.570654 Li\n0.795741 0.396512 0.071112 Li\n0.207293 0.595270 0.929347 Li\n0.704338 0.603423 0.428886 Li\n0.250054 0.999963 0.250000 Fe\n0.749951 0.000039 0.749997 Fe\n0.495778 -0.003839 0.002135 Fe\n0.750051 0.999957 0.249998 Fe\n0.249945 0.000061 0.750008 Fe\n0.004238 0.003818 0.497867 Fe\n0.749945 0.500036 0.749990 Te\n0.250048 0.499969 0.250006 Te\n0.095749 0.263577 0.635759 O\n0.356161 0.758671 0.366449 O\n0.857741 0.756153 0.865298 O\n0.896406 0.749754 0.359136 O\n0.404150 0.736495 0.864230 O\n0.603694 0.250174 0.140872 O\n0.143923 0.241275 0.133564 O\n0.595824 0.805390 0.145925 O\n0.352425 0.252249 0.365372 O\n0.868818 0.244246 0.862483 O\n0.904278 0.194531 0.354068 O\n0.424579 0.188334 0.859388 O\n0.631079 0.755836 0.637505 O\n0.075325 0.811745 0.640621 O\n0.642162 0.243911 0.634691 O\n0.147677 0.747674 0.134635 O\n","nsites":28,"nelements":4,"elements":["Li","Fe","Te","O"],"chemical_system":"Fe-Li-O-Te","density":4.830150444102335,"density_atomic":0.09318500542313939,"volume":300.47752718214826,"volume_molar":6.462564156812939,"formula_full":"Li4 Fe6 Te2 O16","formula_reduced":"Li2Fe3TeO8","formula_anonymous":"AB2C3D8","energy_above_hull":2.706953733333333,"spacegroup":2},{"id":"jvasp-119277","created_at":"2022-09-04T14:38:48.685386Z","updated_at":"2022-09-04T14:38:48.685402Z","structure_string":"Li8 Fe4 O12\n1.0\n4.896672 -0.069112 0.865263\n-2.404183 8.129993 0.171452\n-0.039525 -0.121182 4.892809\nLi Fe O\n8 4 12\ndirect\n0.000001 0.500001 0.000003 Li\n0.999999 -0.000001 0.499997 Li\n0.500001 0.750001 0.750000 Li\n0.500000 0.249999 0.250000 Li\n0.000069 0.169504 0.008435 Li\n0.000075 0.669505 0.508437 Li\n-0.000071 0.830497 0.991562 Li\n-0.000070 0.330494 0.491564 Li\n0.500010 0.583416 0.250276 Fe\n0.499991 0.916583 0.249722 Fe\n0.500010 0.083419 0.750276 Fe\n0.499992 0.416582 0.749724 Fe\n0.723566 0.466611 0.390884 O\n0.727894 0.609791 0.890354 O\n0.727892 0.109790 0.390354 O\n0.272109 0.390210 0.109645 O\n0.272107 0.890209 0.609645 O\n0.723617 0.287952 0.854780 O\n0.723618 0.787952 0.354781 O\n0.276436 0.533390 0.609116 O\n0.276434 0.033389 0.109116 O\n0.276383 0.712048 0.145218 O\n0.276384 0.212049 0.645219 O\n0.723566 0.966610 0.890883 O\n","nsites":24,"nelements":3,"elements":["Li","Fe","O"],"chemical_system":"Fe-Li-O","density":4.01820445790464,"density_atomic":0.12332886853277099,"volume":194.6016393852078,"volume_molar":4.8829936021020055,"formula_full":"Li8 Fe4 O12","formula_reduced":"Li2FeO3","formula_anonymous":"AB2C3","energy_above_hull":1.902226,"spacegroup":12},{"id":"jvasp-119275","created_at":"2022-09-04T14:38:50.501475Z","updated_at":"2022-09-04T14:38:50.501501Z","structure_string":"Li8 Cr4 O12\n1.0\n2.824267 -0.005050 0.540134\n1.319998 9.478141 0.836691\n0.017203 0.016607 7.566880\nLi Cr O\n8 4 12\ndirect\n0.333299 0.000001 0.333327 Li\n0.333353 0.500001 0.833335 Li\n0.333328 0.249995 0.083323 Li\n0.333268 0.750000 0.583347 Li\n0.993583 0.756211 0.257046 Li\n0.993494 0.256219 0.757028 Li\n0.673272 0.243788 0.409618 Li\n0.673327 0.743784 0.909640 Li\n-0.009804 0.002807 0.016663 Cr\n0.676341 0.997194 0.649999 Cr\n-0.009721 0.502811 0.516668 Cr\n0.676474 0.497190 0.149997 Cr\n0.843109 0.118393 0.195262 O\n0.502893 0.885291 0.108728 O\n0.502958 0.385295 0.608726 O\n0.163787 0.614705 0.057941 O\n0.163656 0.114709 0.557936 O\n0.159903 0.393122 0.287094 O\n0.159798 0.893125 0.787095 O\n0.506829 0.606878 0.379572 O\n0.506734 0.106876 0.879569 O\n0.823435 0.881606 0.471403 O\n0.823528 0.381607 0.971400 O\n0.843164 0.618395 0.695267 O\n","nsites":24,"nelements":3,"elements":["Li","Cr","O"],"chemical_system":"Cr-Li-O","density":3.73539286257681,"density_atomic":0.11852366973695509,"volume":202.49119904289395,"volume_molar":5.080960430406186,"formula_full":"Li8 Cr4 O12","formula_reduced":"Li2CrO3","formula_anonymous":"AB2C3","energy_above_hull":2.103882983333334,"spacegroup":12},{"id":"jvasp-119274","created_at":"2022-09-04T14:38:48.677267Z","updated_at":"2022-09-04T14:38:48.677302Z","structure_string":"Li8 V4 O8 F4\n1.0\n2.885564 -0.000048 -0.000004\n0.000150 8.915062 4.068829\n0.000013 -0.008249 8.119698\nLi V O F\n8 4 8 4\ndirect\n-0.000002 0.333577 0.833243 Li\n-0.000001 0.333586 0.333226 Li\n0.499997 0.499747 0.000102 Li\n0.499997 0.499734 0.500123 Li\n0.999996 0.645448 0.677268 Li\n0.999997 0.645439 0.177279 Li\n0.500000 0.187875 0.156082 Li\n0.499999 0.187878 0.656073 Li\n0.000001 0.014262 0.992894 V\n0.499999 0.819075 0.840444 V\n0.000001 0.014262 0.492892 V\n0.499999 0.819073 0.340445 V\n0.500001 0.162953 0.918544 O\n0.500000 0.162954 0.418540 O\n-0.000001 0.670384 0.914791 O\n-0.000001 0.670381 0.414792 O\n0.499999 0.844333 0.577825 O\n0.500001 0.844331 0.077827 O\n0.000001 0.989007 0.755512 O\n0.000001 0.989002 0.255517 O\n0.999998 0.338253 0.080861 F\n0.499996 0.495094 0.752435 F\n0.499997 0.495090 0.252435 F\n-0.000000 0.338254 0.580862 F\n","nsites":24,"nelements":4,"elements":["Li","V","O","F"],"chemical_system":"F-Li-O-V","density":3.681281336353893,"density_atomic":0.11484575959134005,"volume":208.97593507500926,"volume_molar":5.243677068643028,"formula_full":"Li8 V4 O8 F4","formula_reduced":"Li2VO2F","formula_anonymous":"ABC2D2","energy_above_hull":1.4809819137500004,"spacegroup":59},{"id":"jvasp-119273","created_at":"2022-09-04T14:38:47.019479Z","updated_at":"2022-09-04T14:38:47.019509Z","structure_string":"Li4 Ni6 Sn2 O16\n1.0\n5.810193 0.042623 -0.011131\n-0.044806 5.952090 0.210269\n0.015788 -0.004513 8.315877\nLi Ni Sn O\n4 6 2 16\ndirect\n0.000026 0.238422 0.119194 Li\n0.500020 0.738425 0.619192 Li\n-0.000020 0.761577 0.880808 Li\n0.499973 0.261576 0.380807 Li\n0.250000 0.750000 0.250002 Ni\n-0.000003 0.499999 0.500000 Ni\n0.749997 0.250000 0.750001 Ni\n0.750000 0.749999 0.250001 Ni\n0.500002 0.000002 -0.000000 Ni\n0.250001 0.250002 0.750001 Ni\n-0.000000 -0.000005 0.500001 Sn\n0.500000 0.500002 -0.000001 Sn\n0.000015 0.966410 0.251791 O\n0.731339 0.764906 0.016730 O\n0.231334 0.264902 0.516731 O\n0.499985 0.533591 0.248209 O\n-0.000012 0.033592 0.748211 O\n0.500010 0.466408 0.751790 O\n0.268666 0.235097 0.983270 O\n0.500073 0.029455 0.764758 O\n0.731347 0.235202 0.983304 O\n0.231343 0.735199 0.483306 O\n0.499937 0.970551 0.235243 O\n-0.000076 0.470545 0.735245 O\n0.768650 0.264795 0.516697 O\n0.000064 0.529451 0.264756 O\n0.768660 0.735094 0.483269 O\n0.268658 0.764805 0.016693 O\n","nsites":28,"nelements":4,"elements":["Li","Ni","Sn","O"],"chemical_system":"Li-Ni-O-Sn","density":5.042288147325939,"density_atomic":0.09735445462756794,"volume":287.60882187789707,"volume_molar":6.185788604165941,"formula_full":"Li4 Ni6 Sn2 O16","formula_reduced":"Li2Ni3SnO8","formula_anonymous":"AB2C3D8","energy_above_hull":2.035069778571429,"spacegroup":166},{"id":"jvasp-119272","created_at":"2022-09-04T14:38:48.638921Z","updated_at":"2022-09-04T14:38:48.638938Z","structure_string":"Li6 Co8 O16\n1.0\n5.652301 0.000035 0.000027\n-2.826189 4.667936 -1.635938\n-0.000047 0.009073 9.790443\nLi Co O\n6 8 16\ndirect\n0.249959 0.000000 0.750010 Li\n0.750069 -0.000019 0.249978 Li\n0.500001 -0.000040 -0.000007 Li\n0.000040 0.000039 0.500007 Li\n0.749957 -0.000002 0.749990 Li\n0.250087 0.000017 0.250021 Li\n0.500000 0.500010 0.500001 Co\n0.499991 0.499990 -0.000001 Co\n0.249998 0.500000 0.250000 Co\n0.249994 0.500000 0.750000 Co\n-0.000009 0.499995 0.000000 Co\n-0.000003 0.500006 0.500000 Co\n0.749991 0.499999 0.750000 Co\n0.749996 0.499999 0.250000 Co\n0.891634 0.288181 0.132183 O\n0.644093 0.288195 0.379732 O\n0.144083 0.288185 0.879729 O\n0.608357 0.711818 0.367817 O\n0.108348 0.711808 0.867819 O\n0.391638 0.288189 0.632182 O\n0.355899 0.711815 0.620271 O\n0.640690 0.281397 0.880233 O\n0.896539 0.288191 0.632180 O\n0.396537 0.288181 0.132183 O\n0.859294 0.718602 0.619766 O\n0.359292 0.718589 0.119764 O\n0.140702 0.281411 0.380236 O\n0.603449 0.711810 0.867818 O\n0.855899 0.711804 0.120268 O\n0.103454 0.711819 0.367817 O\n","nsites":30,"nelements":3,"elements":["Li","Co","O"],"chemical_system":"Co-Li-O","density":4.9423994657118735,"density_atomic":0.11609835951380792,"volume":258.40158401576736,"volume_molar":5.187102371833057,"formula_full":"Li6 Co8 O16","formula_reduced":"Li3(CoO2)4","formula_anonymous":"A3B4C8","energy_above_hull":2.7517127733333333,"spacegroup":166},{"id":"jvasp-119271","created_at":"2022-09-04T14:38:29.064809Z","updated_at":"2022-09-04T14:38:29.064841Z","structure_string":"Na2 Ni4 O6\n1.0\n4.569964 -0.008224 -2.367153\n1.661550 4.869954 0.998653\n0.056012 -0.007612 5.146674\nNa Ni O\n2 4 6\ndirect\n0.831597 0.499984 0.168448 Na\n0.168396 0.500016 0.831557 Na\n0.499999 0.500000 0.499999 Ni\n0.665075 0.000041 0.334945 Ni\n0.000001 -0.000000 -0.000000 Ni\n0.334925 -0.000040 0.665052 Ni\n0.315674 0.257843 0.315582 O\n0.684329 0.742157 0.684412 O\n0.915387 0.197398 0.610068 O\n0.609999 0.197537 0.915071 O\n0.084607 0.802612 0.389924 O\n0.390006 0.802454 0.084932 O\n","nsites":12,"nelements":3,"elements":["Na","Ni","O"],"chemical_system":"Na-Ni-O","density":5.424868149401018,"density_atomic":0.10405635447769705,"volume":115.32212578686891,"volume_molar":5.787383951924586,"formula_full":"Na2 Ni4 O6","formula_reduced":"NaNi2O3","formula_anonymous":"AB2C3","energy_above_hull":1.3963157166666669,"spacegroup":12},{"id":"jvasp-119270","created_at":"2022-09-04T14:38:28.992180Z","updated_at":"2022-09-04T14:38:28.992201Z","structure_string":"V4 O1 F11\n1.0\n5.005103 -0.005829 0.003849\n0.008593 7.222434 -0.545052\n-0.004270 -0.115755 5.355803\nV O F\n4 1 11\ndirect\n0.509144 0.487603 0.500071 V\n0.509143 0.012391 0.499936 V\n0.001547 0.500784 0.999872 V\n0.001533 -0.000779 0.000133 V\n0.593972 0.250004 0.500018 O\n0.868965 0.250005 0.000022 F\n0.818394 0.563269 0.315688 F\n0.818367 0.936728 0.684331 F\n0.686604 0.933288 0.183637 F\n0.686604 0.566719 0.816368 F\n0.385332 0.749993 0.499989 F\n0.314997 0.436730 0.182431 F\n0.314952 0.063274 0.817537 F\n0.179604 0.058514 0.316937 F\n0.179564 0.441472 0.683037 F\n0.131271 0.750005 -0.000007 F\n","nsites":16,"nelements":3,"elements":["V","O","F"],"chemical_system":"F-O-V","density":3.6833072685157218,"density_atomic":0.0827764686649481,"volume":193.29164747004046,"volume_molar":7.275184429980509,"formula_full":"V4 O1 F11","formula_reduced":"V4OF11","formula_anonymous":"AB4C11","energy_above_hull":1.23385271296875,"spacegroup":3}]}