{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=chemical_system&page=3461","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=chemical_system&page=3459","results":[{"id":"jvasp-12467","created_at":"2022-09-04T14:37:28.047623Z","updated_at":"2022-09-04T14:37:28.047649Z","structure_string":"Li2 I2 O6\n1.0\n2.728011 -4.725054 0.000000\n2.728011 4.725054 0.000000\n0.000000 0.000000 5.103750\nLi I O\n2 2 6\ndirect\n0.000000 0.000000 0.074205 Li\n0.000000 0.000000 0.574205 Li\n0.333333 0.666667 0.507868 I\n0.666667 0.333333 0.007868 I\n0.082222 0.742650 0.336209 O\n0.917778 0.257350 0.836209 O\n0.339571 0.082222 0.836209 O\n0.257350 0.339571 0.336209 O\n0.742650 0.660428 0.836209 O\n0.660428 0.917778 0.336209 O\n","nsites":10,"nelements":3,"elements":["Li","I","O"],"chemical_system":"I-Li-O","density":4.589918762673705,"density_atomic":0.07600247200064282,"volume":131.57466772811574,"volume_molar":7.923611695089424,"formula_full":"Li2 I2 O6","formula_reduced":"LiIO3","formula_anonymous":"ABC3","energy_above_hull":1.4053033549999998,"spacegroup":173},{"id":"jvasp-118558","created_at":"2022-09-04T14:38:51.821698Z","updated_at":"2022-09-04T14:38:51.821715Z","structure_string":"Li1 P1 I1\n1.0\n3.570780 0.000000 0.000000\n0.000000 3.570780 0.000000\n-0.000000 0.000000 7.588200\nLi P I\n1 1 1\ndirect\n0.000000 0.000000 0.688122 Li\n0.000000 0.000000 0.001606 P\n0.000000 0.000000 0.330859 I\n","nsites":3,"nelements":3,"elements":["Li","P","I"],"chemical_system":"I-Li-P","density":2.828733458997403,"density_atomic":0.03100675363265433,"volume":96.75311500010088,"volume_molar":19.422029249969164,"formula_full":"Li1 P1 I1","formula_reduced":"LiPI","formula_anonymous":"ABC","energy_above_hull":1.1413605916666667,"spacegroup":99},{"id":"jvasp-102424","created_at":"2022-09-04T14:36:49.908619Z","updated_at":"2022-09-04T14:36:49.908641Z","structure_string":"Rb2 Li1 Pr1 I6\n1.0\n7.358026 -0.000000 4.248158\n2.452675 6.937213 4.248158\n-0.000000 -0.000000 8.496316\nRb Li Pr I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.742080 0.257920 0.257921 I\n0.257921 0.257920 0.742080 I\n0.257921 0.742079 0.742080 I\n0.257921 0.742079 0.257921 I\n0.742080 0.257920 0.742080 I\n0.742080 0.742079 0.257921 I\n","nsites":10,"nelements":4,"elements":["Rb","Li","Pr","I"],"chemical_system":"I-Li-Pr-Rb","density":4.136001781358911,"density_atomic":0.023058072270599517,"volume":433.6875989737713,"volume_molar":26.117277668864826,"formula_full":"Rb2 Li1 Pr1 I6","formula_reduced":"Rb2LiPrI6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-37998","created_at":"2022-09-04T14:38:02.311321Z","updated_at":"2022-09-04T14:38:02.311347Z","structure_string":"Li6 P1 S5 I1\n1.0\n5.115172 5.115172 0.000000\n5.115172 -0.000000 -5.115172\n-0.000000 5.115172 -5.115172\nLi P S I\n6 1 5 1\ndirect\n0.023528 0.476472 0.023528 Li\n0.476472 0.023528 0.476472 Li\n0.023528 0.476472 0.476472 Li\n0.476472 0.023528 0.023528 Li\n0.023528 0.023528 0.476472 Li\n0.476472 0.476472 0.023528 Li\n0.500000 0.500000 0.500000 P\n0.616329 0.616329 0.151010 S\n0.616329 0.151010 0.616329 S\n0.151010 0.616329 0.616329 S\n0.616329 0.616329 0.616329 S\n0.250000 0.250000 0.250000 S\n0.000000 0.000000 0.000000 I\n","nsites":13,"nelements":4,"elements":["Li","P","S","I"],"chemical_system":"I-Li-P-S","density":2.2323328850740527,"density_atomic":0.048566033122060925,"volume":267.6767931061432,"volume_molar":12.399902509773785,"formula_full":"Li6 P1 S5 I1","formula_reduced":"Li6PS5I","formula_anonymous":"ABC5D6","energy_above_hull":1.4508278288461538,"spacegroup":216},{"id":"jvasp-108602","created_at":"2022-09-04T14:38:18.680705Z","updated_at":"2022-09-04T14:38:18.680725Z","structure_string":"Rb2 Li1 Sb1 I6\n1.0\n7.254870 -0.000000 4.188601\n2.418290 6.839957 4.188601\n-0.000000 -0.000000 8.377202\nRb Li Sb I\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Sb\n0.745834 0.254166 0.254166 I\n0.254166 0.254166 0.745834 I\n0.254166 0.745834 0.745834 I\n0.254166 0.745834 0.254166 I\n0.745834 0.254166 0.745834 I\n0.745834 0.745834 0.254166 I\n","nsites":10,"nelements":4,"elements":["Rb","Li","Sb","I"],"chemical_system":"I-Li-Rb-Sb","density":4.238463485641501,"density_atomic":0.024055700389213418,"volume":415.70188513338826,"volume_molar":25.03415266470616,"formula_full":"Rb2 Li1 Sb1 I6","formula_reduced":"Rb2LiSbI6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-110384","created_at":"2022-09-04T14:38:39.355958Z","updated_at":"2022-09-04T14:38:39.355984Z","structure_string":"Rb2 Li1 Ta1 I6\n1.0\n7.039604 -0.000000 4.064318\n2.346535 6.637002 4.064318\n-0.000000 0.000000 8.128635\nRb Li Ta I\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500001 Li\n0.000000 0.000000 0.000000 Ta\n0.753658 0.246341 0.246342 I\n0.246341 0.246341 0.753659 I\n0.246341 0.753658 0.753660 I\n0.246341 0.753658 0.246342 I\n0.753658 0.246341 0.753660 I\n0.753658 0.753658 0.246343 I\n","nsites":10,"nelements":4,"elements":["Rb","Li","Ta","I"],"chemical_system":"I-Li-Rb-Ta","density":4.898089914790601,"density_atomic":0.026330687527163714,"volume":379.78499382834684,"volume_molar":22.87118691370036,"formula_full":"Rb2 Li1 Ta1 I6","formula_reduced":"Rb2LiTaI6","formula_anonymous":"ABC2D6","energy_above_hull":0.3391606849999999,"spacegroup":225},{"id":"jvasp-102093","created_at":"2022-09-04T14:36:38.612198Z","updated_at":"2022-09-04T14:36:38.612227Z","structure_string":"Rb2 Li1 Y1 I6\n1.0\n7.226104 -0.000000 4.171993\n2.408702 6.812836 4.171993\n-0.000000 -0.000000 8.343985\nRb Li Y I\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Y\n0.746506 0.253494 0.253494 I\n0.253493 0.253494 0.746507 I\n0.253493 0.746507 0.746506 I\n0.253493 0.746507 0.253493 I\n0.746506 0.253494 0.746507 I\n0.746506 0.746507 0.253493 I\n","nsites":10,"nelements":4,"elements":["Rb","Li","Y","I"],"chemical_system":"I-Li-Rb-Y","density":4.156472920282219,"density_atomic":0.024344134730197396,"volume":410.77656325963466,"volume_molar":24.737542848585644,"formula_full":"Rb2 Li1 Y1 I6","formula_reduced":"Rb2LiYI6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-118559","created_at":"2022-09-04T14:38:51.573622Z","updated_at":"2022-09-04T14:38:51.573633Z","structure_string":"Li1 S1 I1\n1.0\n5.061686 0.000000 -0.000000\n-2.530843 4.383549 0.000000\n-0.000000 -0.000000 3.974746\nLi S I\n1 1 1\ndirect\n0.333334 0.666667 0.000000 Li\n0.666667 0.333333 0.000000 S\n0.000000 0.000000 0.000000 I\n","nsites":3,"nelements":3,"elements":["Li","S","I"],"chemical_system":"I-Li-S","density":3.123866344899575,"density_atomic":0.03401659253496136,"volume":88.19225490962033,"volume_molar":17.70353910025116,"formula_full":"Li1 S1 I1","formula_reduced":"LiSI","formula_anonymous":"ABC","energy_above_hull":0.6384954250000001,"spacegroup":187},{"id":"jvasp-34911","created_at":"2022-09-04T14:37:07.866974Z","updated_at":"2022-09-04T14:37:07.866999Z","structure_string":"Li2 Sc2 I6\n1.0\n3.663264 -6.344959 -0.000000\n3.663264 6.344959 0.000000\n-0.000000 0.000000 6.649839\nLi Sc I\n2 2 6\ndirect\n0.666667 0.333332 0.500000 Li\n0.666667 0.333332 0.000000 Li\n0.000000 0.000000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.003500 0.337354 0.250000 I\n0.662645 0.666145 0.250000 I\n0.333854 -0.003500 0.250000 I\n0.003500 0.666145 0.750000 I\n0.662645 -0.003501 0.750000 I\n0.333854 0.337354 0.750000 I\n","nsites":10,"nelements":3,"elements":["Li","Sc","I"],"chemical_system":"I-Li-Sc","density":4.647696988848821,"density_atomic":0.03234907266769768,"volume":309.12787215645744,"volume_molar":18.61611558965471,"formula_full":"Li2 Sc2 I6","formula_reduced":"LiScI3","formula_anonymous":"ABC3","energy_above_hull":0.2595608149999999,"spacegroup":188},{"id":"jvasp-85235","created_at":"2022-09-04T14:37:10.293965Z","updated_at":"2022-09-04T14:37:10.293977Z","structure_string":"Li4 U2 I12\n1.0\n7.364740 -0.000000 0.000000\n-3.682370 6.378052 -0.000000\n0.000000 0.000000 13.816631\nLi U I\n4 2 12\ndirect\n0.666667 0.333333 0.250000 Li\n0.333333 0.666667 0.750000 Li\n0.000000 0.000000 0.250000 Li\n0.000000 0.000000 0.750000 Li\n0.666667 0.333333 0.750000 U\n0.333333 0.666667 0.250000 U\n-0.001804 0.331415 0.124762 I\n0.001803 0.668584 0.875238 I\n0.668584 0.666781 0.124762 I\n0.331415 0.333219 0.875238 I\n-0.001804 0.666781 0.375238 I\n0.666781 0.668584 0.624762 I\n0.666781 -0.001804 0.875238 I\n0.668585 0.001804 0.375238 I\n0.001803 0.333219 0.624762 I\n0.333219 0.001804 0.124762 I\n0.333219 0.331415 0.375238 I\n0.331415 -0.001804 0.624762 I\n","nsites":18,"nelements":3,"elements":["Li","U","I"],"chemical_system":"I-Li-U","density":5.185440700851924,"density_atomic":0.0277347893012524,"volume":649.0043895587548,"volume_molar":21.713309932114974,"formula_full":"Li4 U2 I12","formula_reduced":"Li2UI6","formula_anonymous":"AB2C6","energy_above_hull":0.5976292944444446,"spacegroup":163},{"id":"jvasp-99967","created_at":"2022-09-04T14:36:34.313063Z","updated_at":"2022-09-04T14:36:34.313092Z","structure_string":"Li1 U1 I6\n1.0\n7.200155 -0.135110 1.289092\n-3.808133 6.112169 1.289092\n-0.099541 -0.175400 7.239512\nLi U I\n1 1 6\ndirect\n0.853982 0.146018 0.500000 Li\n-0.001069 0.001069 -0.000000 U\n0.253326 0.258178 0.238561 I\n0.741823 0.746674 0.761438 I\n0.070365 0.404321 0.747420 I\n0.399880 0.079982 0.750322 I\n0.920018 0.600121 0.249677 I\n0.595680 0.929636 0.252579 I\n","nsites":8,"nelements":3,"elements":["Li","U","I"],"chemical_system":"I-Li-U","density":5.252475722441935,"density_atomic":0.025144078637822337,"volume":318.16636096445404,"volume_molar":23.950532635311394,"formula_full":"Li1 U1 I6","formula_reduced":"LiUI6","formula_anonymous":"ABC6","energy_above_hull":0.57697045625,"spacegroup":5},{"id":"jvasp-98018","created_at":"2022-09-04T14:36:22.049994Z","updated_at":"2022-09-04T14:36:22.050016Z","structure_string":"Li8 Zn4 I16\n1.0\n7.017376 -0.000000 0.000000\n0.000000 8.521139 0.000000\n0.000000 0.000000 14.748634\nLi Zn I\n8 4 16\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.997930 0.750000 0.736990 Li\n0.497930 0.250000 0.763010 Li\n0.002070 0.250000 0.263010 Li\n0.502071 0.750000 0.236990 Li\n0.903926 0.750000 0.414508 Zn\n0.403926 0.250000 0.085492 Zn\n0.096074 0.250000 0.585491 Zn\n0.596074 0.750000 0.914508 Zn\n0.746488 0.996133 0.332745 I\n0.246488 0.003867 0.167255 I\n0.746488 0.503867 0.332745 I\n0.246488 0.496133 0.167255 I\n0.253512 0.003867 0.667255 I\n0.753513 0.996133 0.832745 I\n0.752143 0.750000 0.078774 I\n0.723925 0.250000 0.588255 I\n0.247857 0.250000 0.921226 I\n0.747858 0.750000 0.578774 I\n0.276075 0.750000 0.411745 I\n0.776076 0.250000 0.088255 I\n0.753513 0.503867 0.832745 I\n0.223925 0.750000 0.911745 I\n0.252143 0.250000 0.421226 I\n0.253512 0.496133 0.667255 I\n","nsites":28,"nelements":3,"elements":["Li","Zn","I"],"chemical_system":"I-Li-Zn","density":4.420338968328657,"density_atomic":0.03174927671629596,"volume":881.9098542055427,"volume_molar":18.96780457020306,"formula_full":"Li8 Zn4 I16","formula_reduced":"Li2ZnI4","formula_anonymous":"AB2C4","energy_above_hull":0.0,"spacegroup":62}]}