{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=24","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=22","results":[{"id":"jvasp-25797","created_at":"2022-09-04T14:37:39.326258Z","updated_at":"2022-09-04T14:37:39.326284Z","structure_string":"K2 Na2 Th2 F12\n1.0\n3.160307 -5.473812 -0.000000\n3.160307 5.473812 0.000000\n-0.000000 0.000000 7.862687\nK Na Th F\n2 2 2 12\ndirect\n0.333334 0.666667 0.390371 K\n0.666667 0.333334 0.609629 K\n0.000000 0.000000 0.236524 Na\n0.000000 0.000000 0.763477 Na\n0.666667 0.333334 0.123900 Th\n0.333334 0.666667 0.876100 Th\n0.612683 0.690293 0.098680 F\n0.724147 0.104799 0.326860 F\n0.690293 0.077611 0.901320 F\n0.387318 0.309708 0.901320 F\n0.619349 0.724148 0.673140 F\n0.077611 0.387318 0.098680 F\n0.922390 0.612683 0.901320 F\n0.895202 0.619350 0.326860 F\n0.309708 0.922390 0.098680 F\n0.380652 0.275853 0.326860 F\n0.275854 0.895202 0.673140 F\n0.104799 0.380651 0.673140 F\n","nsites":18,"nelements":4,"elements":["K","Na","Th","F"],"chemical_system":"F-K-Na-Th","density":4.982452471917692,"density_atomic":0.06616866484394475,"volume":272.0320871284321,"volume_molar":9.101197332911125,"formula_full":"K2 Na2 Th2 F12","formula_reduced":"KNaThF6","formula_anonymous":"ABCD6","energy_above_hull":0.0,"spacegroup":147},{"id":"jvasp-100027","created_at":"2022-09-04T14:36:45.192451Z","updated_at":"2022-09-04T14:36:45.192471Z","structure_string":"Ca1 Eu1 H6 Ru1\n1.0\n4.398236 0.000000 2.539323\n1.466079 4.146697 2.539323\n0.000000 0.000000 5.078646\nCa Eu H Ru\n1 1 6 1\ndirect\n0.750001 0.750001 0.749999 Ca\n0.250000 0.250000 0.250000 Eu\n0.756484 0.756484 0.243516 H\n0.243517 0.756484 0.243516 H\n0.756484 0.243517 0.243516 H\n0.243517 0.243517 0.756483 H\n0.756484 0.243517 0.756483 H\n0.243517 0.756484 0.756483 H\n0.000000 0.000000 0.000000 Ru\n","nsites":9,"nelements":4,"elements":["Ca","Eu","H","Ru"],"chemical_system":"Ca-Eu-H-Ru","density":5.363191766682672,"density_atomic":0.09716586828924459,"volume":92.62511783673548,"volume_molar":6.197794416937864,"formula_full":"Ca1 Eu1 H6 Ru1","formula_reduced":"CaEuH6Ru","formula_anonymous":"ABCD6","energy_above_hull":2.6990967688888885,"spacegroup":216},{"id":"jvasp-57367","created_at":"2022-09-04T14:37:44.621084Z","updated_at":"2022-09-04T14:37:44.621106Z","structure_string":"Li2 Mo2 I2 O12\n1.0\n0.000000 5.455142 -0.010305\n5.312516 0.000000 0.000000\n0.000000 -2.634330 -8.572233\nLi Mo I O\n2 2 2 12\ndirect\n0.992366 0.685480 0.582446 Li\n0.007634 0.185480 0.417554 Li\n0.235843 0.386389 0.965417 Mo\n0.764157 0.886389 0.034583 Mo\n0.372094 0.621178 0.337311 I\n0.627905 0.121177 0.662689 I\n0.112265 0.534646 0.416420 O\n0.512358 0.677628 0.045101 O\n0.648006 0.515825 0.495749 O\n0.643852 0.836174 0.785937 O\n0.021699 0.667018 0.047415 O\n0.356147 0.336174 0.214063 O\n0.887735 0.034646 0.583580 O\n0.487641 0.177627 0.954899 O\n0.142797 0.519546 0.781018 O\n0.351994 0.015824 0.504252 O\n0.978300 0.167018 0.952585 O\n0.857202 0.019546 0.218983 O\n","nsites":18,"nelements":4,"elements":["Li","Mo","I","O"],"chemical_system":"I-Li-Mo-O","density":4.352649361734567,"density_atomic":0.07241360739292615,"volume":248.5720660528557,"volume_molar":8.31631094874619,"formula_full":"Li2 Mo2 I2 O12","formula_reduced":"LiMoIO6","formula_anonymous":"ABCD6","energy_above_hull":2.5667436861111117,"spacegroup":4},{"id":"jvasp-29516","created_at":"2022-09-04T14:36:50.786235Z","updated_at":"2022-09-04T14:36:50.786259Z","structure_string":"Cd2 Te2 Mo2 O12\n1.0\n5.316959 0.000000 0.000000\n0.000000 5.316959 -0.000000\n0.000000 0.000000 9.105014\nCd Te Mo O\n2 2 2 12\ndirect\n0.000000 0.000000 0.500000 Cd\n0.500000 0.500000 0.500000 Cd\n0.500000 0.000000 0.762831 Te\n0.000000 0.500000 0.237169 Te\n0.500000 0.000000 0.183130 Mo\n0.000000 0.500000 0.816870 Mo\n0.818296 0.681704 0.932690 O\n0.306112 0.193889 0.625967 O\n0.283116 0.216884 0.284193 O\n0.693889 0.806112 0.625967 O\n0.216884 0.716884 0.715806 O\n0.193889 0.693889 0.374032 O\n0.806112 0.306112 0.374032 O\n0.181704 0.318296 0.932690 O\n0.318296 0.818296 0.067310 O\n0.681704 0.181704 0.067310 O\n0.783116 0.283116 0.715806 O\n0.716884 0.783116 0.284193 O\n","nsites":18,"nelements":4,"elements":["Cd","Te","Mo","O"],"chemical_system":"Cd-Mo-O-Te","density":5.573175466229252,"density_atomic":0.06993027955364166,"volume":257.3992284156776,"volume_molar":8.61163547241446,"formula_full":"Cd2 Te2 Mo2 O12","formula_reduced":"CdTeMoO6","formula_anonymous":"ABCD6","energy_above_hull":2.3751204907407404,"spacegroup":113},{"id":"jvasp-57322","created_at":"2022-09-04T14:37:26.941087Z","updated_at":"2022-09-04T14:37:26.941123Z","structure_string":"Li2 Ca2 Cr2 F12\n1.0\n2.558332 -4.431162 0.000000\n2.558332 4.431162 0.000000\n0.000000 0.000000 9.811685\nLi Ca Cr F\n2 2 2 12\ndirect\n0.333333 0.666667 0.250000 Li\n0.666667 0.333333 0.750000 Li\n0.000000 0.000000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.666667 0.333333 0.250000 Cr\n0.333333 0.666667 0.750000 Cr\n0.363786 0.014030 0.139798 F\n0.014030 0.363786 0.639798 F\n0.650244 0.014030 0.360202 F\n0.636213 0.985969 0.860202 F\n0.985969 0.636213 0.360202 F\n0.349756 0.985969 0.639798 F\n0.014030 0.650244 0.860202 F\n0.636213 0.650243 0.639798 F\n0.985969 0.349756 0.139798 F\n0.650243 0.636213 0.139798 F\n0.363786 0.349756 0.360202 F\n0.349756 0.363786 0.860202 F\n","nsites":18,"nelements":4,"elements":["Li","Ca","Cr","F"],"chemical_system":"Ca-Cr-F-Li","density":3.179961238501137,"density_atomic":0.08091413237236955,"volume":222.4580487023379,"volume_molar":7.442631569335633,"formula_full":"Li2 Ca2 Cr2 F12","formula_reduced":"LiCaCrF6","formula_anonymous":"ABCD6","energy_above_hull":0.1752277238888892,"spacegroup":163},{"id":"jvasp-48083","created_at":"2022-09-04T14:38:27.033895Z","updated_at":"2022-09-04T14:38:27.033915Z","structure_string":"Li2 Sb2 W2 O12\n1.0\n3.725093 2.098589 -5.905679\n-0.007796 4.275552 5.905679\n3.565837 -2.079540 5.893570\nLi Sb W O\n2 2 2 12\ndirect\n0.125000 0.375000 0.375000 Li\n0.624999 0.875000 0.375000 Li\n0.124999 0.875000 0.375000 Sb\n0.125000 0.875000 0.875000 Sb\n0.125000 0.375000 0.875000 W\n0.625000 0.875000 0.875000 W\n0.447079 0.941570 0.945498 O\n0.428076 0.571924 0.928093 O\n0.191570 0.197079 0.804502 O\n0.802915 0.808464 0.189994 O\n0.447084 0.941535 0.560005 O\n0.039509 0.960490 0.539515 O\n0.058464 0.552916 0.560005 O\n0.802920 0.808430 0.804501 O\n0.210490 0.789510 0.210485 O\n0.191536 0.197084 0.189995 O\n0.058430 0.552921 0.945499 O\n0.821924 0.178076 0.821907 O\n","nsites":18,"nelements":4,"elements":["Li","Sb","W","O"],"chemical_system":"Li-O-Sb-W","density":4.95455638438098,"density_atomic":0.06573041382348095,"volume":273.84583411172497,"volume_molar":9.161878664224542,"formula_full":"Li2 Sb2 W2 O12","formula_reduced":"LiSbWO6","formula_anonymous":"ABCD6","energy_above_hull":3.0316307888888883,"spacegroup":74},{"id":"jvasp-109915","created_at":"2022-09-04T14:38:27.184365Z","updated_at":"2022-09-04T14:38:27.184402Z","structure_string":"Ba1 Na1 H6 Ir1\n1.0\n4.769322 -0.000000 2.753569\n1.589774 4.496560 2.753569\n-0.000000 -0.000000 5.507138\nBa Na H Ir\n1 1 6 1\ndirect\n0.749999 0.750000 0.750001 Ba\n0.250000 0.250000 0.250000 Na\n0.782298 0.217702 0.217702 H\n0.217701 0.782298 0.217702 H\n0.782297 0.782298 0.217703 H\n0.217701 0.782298 0.782299 H\n0.782298 0.217702 0.782299 H\n0.217702 0.217702 0.782299 H\n0.000000 0.000000 0.000000 Ir\n","nsites":9,"nelements":4,"elements":["Ba","Na","H","Ir"],"chemical_system":"Ba-H-Ir-Na","density":5.04166366807278,"density_atomic":0.07620430604768712,"volume":118.10356221035569,"volume_molar":7.902625287646431,"formula_full":"Ba1 Na1 H6 Ir1","formula_reduced":"BaNaH6Ir","formula_anonymous":"ABCD6","energy_above_hull":2.4513373411111115,"spacegroup":216},{"id":"jvasp-54553","created_at":"2022-09-04T14:38:33.601582Z","updated_at":"2022-09-04T14:38:33.601600Z","structure_string":"Li2 Nb2 W2 O12\n1.0\n4.734553 -0.000000 -0.000000\n0.000000 4.734553 -0.000000\n-0.000000 0.000000 9.334051\nLi Nb W O\n2 2 2 12\ndirect\n0.500000 0.000000 0.421480 Li\n0.000000 0.500000 0.578519 Li\n0.500000 0.000000 0.091010 Nb\n0.000000 0.500000 0.908989 Nb\n0.000000 0.500000 0.272662 W\n0.500000 0.000000 0.727338 W\n0.304878 0.804877 0.918216 O\n0.804877 0.695122 0.081784 O\n0.195122 0.304878 0.081784 O\n0.714482 0.214483 0.230555 O\n0.285517 0.785517 0.230555 O\n0.701286 0.201287 0.604404 O\n0.298713 0.798713 0.604404 O\n0.695122 0.195122 0.918216 O\n0.798713 0.701286 0.395596 O\n0.214483 0.285517 0.769445 O\n0.785517 0.714482 0.769445 O\n0.201287 0.298713 0.395596 O\n","nsites":18,"nelements":4,"elements":["Li","Nb","W","O"],"chemical_system":"Li-Nb-O-W","density":6.026608824254163,"density_atomic":0.08602890013340288,"volume":209.23201356855483,"volume_molar":7.000136873378151,"formula_full":"Li2 Nb2 W2 O12","formula_reduced":"LiNbWO6","formula_anonymous":"ABCD6","energy_above_hull":3.4731222666666666,"spacegroup":113},{"id":"jvasp-108112","created_at":"2022-09-04T14:35:46.764925Z","updated_at":"2022-09-04T14:35:46.764947Z","structure_string":"K1 Rb1 Mn1 F6\n1.0\n5.064518 -0.000000 2.924001\n1.688173 4.774874 2.924001\n-0.000000 -0.000000 5.848002\nK Rb Mn F\n1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.749999 0.750000 Rb\n0.000000 0.000000 0.000000 Mn\n0.778558 0.778558 0.221442 F\n0.221442 0.778558 0.221442 F\n0.778558 0.221442 0.221442 F\n0.221442 0.221442 0.778558 F\n0.778558 0.221442 0.778558 F\n0.221442 0.778558 0.778558 F\n","nsites":9,"nelements":4,"elements":["K","Rb","Mn","F"],"chemical_system":"F-K-Mn-Rb","density":3.446208999555678,"density_atomic":0.06364070207807804,"volume":141.41893012051136,"volume_molar":9.462718925714702,"formula_full":"K1 Rb1 Mn1 F6","formula_reduced":"KRbMnF6","formula_anonymous":"ABCD6","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-111787","created_at":"2022-09-04T14:38:53.034869Z","updated_at":"2022-09-04T14:38:53.034903Z","structure_string":"Rb2 Sb2 W2 O12\n1.0\n6.395292 -0.026651 -3.573809\n-2.148307 5.919981 -3.743152\n0.068839 0.026651 7.325785\nRb Sb W O\n2 2 2 12\ndirect\n0.659510 0.382327 0.777182 Rb\n0.394855 0.617673 0.277182 Rb\n-0.003731 0.500000 0.496269 Sb\n-0.003731 -0.000000 -0.003731 Sb\n0.515497 0.991197 0.024302 W\n0.033105 0.008803 0.524302 W\n0.316656 0.688792 0.752840 O\n0.934674 0.066754 0.743406 O\n0.317505 0.063209 0.754296 O\n0.916100 0.672183 0.743917 O\n0.064048 0.311207 0.627863 O\n0.064048 0.936184 0.252841 O\n0.676653 0.308733 0.243406 O\n0.316656 0.063816 0.127863 O\n0.691089 0.936791 0.254297 O\n0.071735 0.327817 0.243917 O\n0.676652 0.933246 0.867921 O\n0.934674 0.691267 0.367921 O\n","nsites":18,"nelements":4,"elements":["Rb","Sb","W","O"],"chemical_system":"O-Rb-Sb-W","density":5.7927734335612335,"density_atomic":0.0644605111970347,"volume":279.2407268533736,"volume_molar":9.342372016865154,"formula_full":"Rb2 Sb2 W2 O12","formula_reduced":"RbSbWO6","formula_anonymous":"ABCD6","energy_above_hull":2.8015374555555552,"spacegroup":46},{"id":"jvasp-91431","created_at":"2022-09-04T14:36:12.934292Z","updated_at":"2022-09-04T14:36:12.934315Z","structure_string":"K4 U4 Cr4 O24\n1.0\n6.408733 0.000000 -1.611873\n0.000000 8.353596 0.000000\n0.007423 0.000000 10.428924\nK U Cr O\n4 4 4 24\ndirect\n0.960412 0.732256 0.150911 K\n0.039588 0.232256 0.349089 K\n0.039587 0.267744 0.849089 K\n0.960411 0.767745 0.650910 K\n0.483172 0.023462 0.177743 U\n0.516827 0.523462 0.322257 U\n0.516827 0.976539 0.822257 U\n0.483172 0.476539 0.677742 U\n0.377028 0.643021 0.946642 Cr\n0.622971 0.143021 0.553358 Cr\n0.622971 0.356980 0.053358 Cr\n0.377028 0.856980 0.446642 Cr\n0.533919 0.157570 0.991407 O\n0.134904 0.868177 0.444164 O\n0.865096 0.368177 0.055836 O\n0.201841 0.430210 0.625093 O\n0.798157 0.930211 0.874907 O\n0.798158 0.569790 0.374907 O\n0.201842 0.069790 0.125093 O\n0.533919 0.342430 0.491407 O\n0.466080 0.842431 0.008593 O\n0.466080 0.657570 0.508592 O\n0.764253 0.521486 0.736516 O\n0.408822 0.791557 0.284712 O\n0.235746 0.478515 0.263485 O\n0.764253 0.978515 0.236515 O\n0.591177 0.208443 0.715287 O\n0.408822 0.708444 0.784712 O\n0.134903 0.631823 0.944163 O\n0.591177 0.291557 0.215288 O\n0.450702 0.063656 0.396219 O\n0.549297 0.563656 0.103781 O\n0.549297 0.936345 0.603781 O\n0.450702 0.436345 0.896218 O\n0.235746 0.021486 0.763484 O\n0.865095 0.131823 0.555836 O\n","nsites":36,"nelements":4,"elements":["K","U","Cr","O"],"chemical_system":"Cr-K-O-U","density":5.05658649899564,"density_atomic":0.06446731934713554,"volume":558.4224745898262,"volume_molar":9.341385404242935,"formula_full":"K4 U4 Cr4 O24","formula_reduced":"KUCrO6","formula_anonymous":"ABCD6","energy_above_hull":2.898369155555556,"spacegroup":14},{"id":"jvasp-34490","created_at":"2022-09-04T14:37:19.866707Z","updated_at":"2022-09-04T14:37:19.866733Z","structure_string":"Li2 Ca2 Co2 F12\n1.0\n2.518320 -4.361858 -0.000000\n2.518320 4.361858 -0.000000\n0.000000 -0.000000 9.754874\nLi Ca Co F\n2 2 2 12\ndirect\n0.333333 0.666667 0.750000 Li\n0.666667 0.333333 0.250000 Li\n0.000000 0.000000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.666667 0.333333 0.750000 Co\n0.333333 0.666667 0.250000 Co\n0.371084 0.021583 0.641292 F\n0.978417 0.349501 0.641292 F\n0.371084 0.349501 0.858707 F\n0.628916 0.978417 0.358707 F\n0.978417 0.628916 0.858707 F\n0.628916 0.650499 0.141292 F\n0.021583 0.371084 0.141292 F\n0.349501 0.371084 0.358707 F\n0.021583 0.650499 0.358707 F\n0.650499 0.628916 0.641292 F\n0.349501 0.978417 0.141292 F\n0.650499 0.021583 0.858707 F\n","nsites":18,"nelements":4,"elements":["Li","Ca","Co","F"],"chemical_system":"Ca-Co-F-Li","density":3.4084299938061244,"density_atomic":0.08399209379025284,"volume":214.30588508663746,"volume_molar":7.169890031600642,"formula_full":"Li2 Ca2 Co2 F12","formula_reduced":"LiCaCoF6","formula_anonymous":"ABCD6","energy_above_hull":0.0216747794444444,"spacegroup":163}]}