{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=599","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=597","results":[{"id":"jvasp-114085","created_at":"2022-09-04T14:38:49.956572Z","updated_at":"2022-09-04T14:38:49.956605Z","structure_string":"Ba1 Te1\n1.0\n5.701023 -0.000000 0.000000\n-2.850512 4.937231 -0.000000\n0.000000 0.000000 5.666903\nBa Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666666 0.000000 Te\n","nsites":2,"nelements":2,"elements":["Ba","Te"],"chemical_system":"Ba-Te","density":2.7579938909900883,"density_atomic":0.01253856906430989,"volume":159.50783456565648,"volume_molar":48.028931603858844,"formula_full":"Ba1 Te1","formula_reduced":"BaTe","formula_anonymous":"AB","energy_above_hull":0.407895,"spacegroup":187},{"id":"jvasp-123336","created_at":"2022-09-04T14:38:50.220544Z","updated_at":"2022-09-04T14:38:50.220569Z","structure_string":"Ho1 Ag3\n1.0\n4.359893 0.000000 0.000000\n0.000000 4.359893 0.000000\n-0.000000 0.000000 4.359893\nHo Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Ho\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n","nsites":4,"nelements":2,"elements":["Ho","Ag"],"chemical_system":"Ag-Ho","density":9.788524148947126,"density_atomic":0.04826502087342287,"volume":82.87575406815166,"volume_molar":12.477236414738798,"formula_full":"Ho1 Ag3","formula_reduced":"HoAg3","formula_anonymous":"AB3","energy_above_hull":0.1125843366666666,"spacegroup":221},{"id":"jvasp-123361","created_at":"2022-09-04T14:38:50.461632Z","updated_at":"2022-09-04T14:38:50.461645Z","structure_string":"Tm1 Ag3\n1.0\n4.334521 0.000000 0.000000\n-0.000000 4.334521 0.000000\n-0.000000 0.000000 4.334521\nTm Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Tm\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n","nsites":4,"nelements":2,"elements":["Tm","Ag"],"chemical_system":"Ag-Tm","density":10.043063765234809,"density_atomic":0.04911754562187736,"volume":81.43729393144528,"volume_molar":12.260671179216432,"formula_full":"Tm1 Ag3","formula_reduced":"TmAg3","formula_anonymous":"AB3","energy_above_hull":0.0972440075,"spacegroup":221},{"id":"jvasp-121185","created_at":"2022-09-04T14:38:52.889802Z","updated_at":"2022-09-04T14:38:52.889819Z","structure_string":"Li2 S1\n1.0\n3.824007 1.145064 -0.487852\n-0.993856 -3.880509 -0.341459\n0.689596 -3.988885 -3.992528\nLi S\n2 1\ndirect\n0.682911 0.224375 0.255581 Li\n0.682970 0.224126 0.755635 Li\n0.182953 0.224230 0.005629 S\n","nsites":3,"nelements":2,"elements":["Li","S"],"chemical_system":"Li-S","density":1.6591924199246462,"density_atomic":0.06523966942889133,"volume":45.98429186202242,"volume_molar":9.23079594473405,"formula_full":"Li2 S1","formula_reduced":"Li2S","formula_anonymous":"AB2","energy_above_hull":0.4638300000000001,"spacegroup":225},{"id":"jvasp-118892","created_at":"2022-09-04T14:38:50.500523Z","updated_at":"2022-09-04T14:38:50.500545Z","structure_string":"Li2 F1\n1.0\n2.705316 0.000000 -0.121915\n0.000000 2.906310 0.000000\n-0.238904 0.000000 4.955475\nLi F\n2 1\ndirect\n-0.083643 0.000000 -0.114909 Li\n0.016968 0.000000 0.381585 Li\n0.466676 0.000000 0.133325 F\n","nsites":3,"nelements":2,"elements":["Li","F"],"chemical_system":"F-Li","density":1.404383034512941,"density_atomic":0.07716504204287462,"volume":38.87770835831506,"volume_molar":7.804234405333394,"formula_full":"Li2 F1","formula_reduced":"Li2F","formula_anonymous":"AB2","energy_above_hull":0.6870533333333335,"spacegroup":10},{"id":"jvasp-121192","created_at":"2022-09-04T14:38:52.887467Z","updated_at":"2022-09-04T14:38:52.887487Z","structure_string":"Li1 Te1\n1.0\n4.679895 0.000000 -0.000000\n-2.339947 4.052908 0.000000\n-0.000000 -0.000000 3.144610\nLi Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.333332 0.666667 0.000000 Te\n","nsites":2,"nelements":2,"elements":["Li","Te"],"chemical_system":"Li-Te","density":3.7457095906654616,"density_atomic":0.03353206889924212,"volume":59.644396115540694,"volume_molar":17.959347447649165,"formula_full":"Li1 Te1","formula_reduced":"LiTe","formula_anonymous":"AB","energy_above_hull":0.2023788833333334,"spacegroup":187},{"id":"jvasp-123696","created_at":"2022-09-04T14:38:52.952865Z","updated_at":"2022-09-04T14:38:52.952891Z","structure_string":"Pr1 Se2\n1.0\n2.257058 -3.821598 -0.602763\n2.181073 3.777728 -0.000000\n-0.726092 0.419209 5.863086\nPr Se\n1 2\ndirect\n-0.000000 0.333357 0.166667 Pr\n0.766020 0.716331 0.435376 Se\n0.233981 -0.049688 0.897959 Se\n","nsites":3,"nelements":2,"elements":["Pr","Se"],"chemical_system":"Pr-Se","density":5.133754992893842,"density_atomic":0.031037484521840766,"volume":96.65731763438916,"volume_molar":19.402799075944056,"formula_full":"Pr1 Se2","formula_reduced":"PrSe2","formula_anonymous":"AB2","energy_above_hull":null,"spacegroup":12},{"id":"jvasp-123554","created_at":"2022-09-04T14:38:51.813148Z","updated_at":"2022-09-04T14:38:51.813185Z","structure_string":"B1 P3\n1.0\n3.090879 -0.000000 -0.989738\n-0.023917 4.709834 -0.074692\n-0.028787 -0.054626 5.231262\nB P\n1 3\ndirect\n0.440320 0.836319 0.880645 B\n0.581480 0.106883 0.162959 P\n0.092734 0.420317 0.185468 P\n0.885462 0.636477 0.770927 P\n","nsites":4,"nelements":2,"elements":["B","P"],"chemical_system":"B-P","density":2.2662841020607125,"density_atomic":0.052627325187748125,"volume":76.00614292537173,"volume_molar":11.442992283031668,"formula_full":"B1 P3","formula_reduced":"BP3","formula_anonymous":"AB3","energy_above_hull":3.394822270833334,"spacegroup":8},{"id":"jvasp-120340","created_at":"2022-09-04T14:38:53.092923Z","updated_at":"2022-09-04T14:38:53.092961Z","structure_string":"Mg1 Se2\n1.0\n4.161349 0.000000 0.000000\n0.000000 3.834815 0.000000\n0.000000 0.000000 5.581871\nMg Se\n1 2\ndirect\n0.466669 0.000000 0.000000 Mg\n-0.033334 0.000000 0.729604 Se\n-0.033334 0.000000 0.270395 Se\n","nsites":3,"nelements":2,"elements":["Mg","Se"],"chemical_system":"Mg-Se","density":3.3970246877693953,"density_atomic":0.033679287982459005,"volume":89.07551731979824,"volume_molar":17.880843452321432,"formula_full":"Mg1 Se2","formula_reduced":"MgSe2","formula_anonymous":"AB2","energy_above_hull":0.7471677888888888,"spacegroup":47},{"id":"jvasp-118737","created_at":"2022-09-04T14:38:52.881942Z","updated_at":"2022-09-04T14:38:52.881973Z","structure_string":"Mn1 F2\n1.0\n2.993578 0.000000 0.000000\n0.000000 2.425902 0.000000\n0.000000 0.000000 4.479256\nMn F\n1 2\ndirect\n0.466673 0.000000 0.000000 Mn\n-0.033336 0.000000 0.253147 F\n-0.033336 0.000000 0.746855 F\n","nsites":3,"nelements":2,"elements":["Mn","F"],"chemical_system":"F-Mn","density":4.744145402342435,"density_atomic":0.0922256106669348,"volume":32.52892529857301,"volume_molar":6.529792230651056,"formula_full":"Mn1 F2","formula_reduced":"MnF2","formula_anonymous":"AB2","energy_above_hull":0.7030526021264367,"spacegroup":47},{"id":"jvasp-122903","created_at":"2022-09-04T14:38:52.870535Z","updated_at":"2022-09-04T14:38:52.870562Z","structure_string":"V1 I1\n1.0\n3.371855 0.000000 0.000000\n0.000000 3.371855 0.000000\n-0.000000 0.000000 3.371855\nV I\n1 1\ndirect\n0.500001 0.500001 0.500001 V\n0.000000 0.000000 0.000000 I\n","nsites":2,"nelements":2,"elements":["V","I"],"chemical_system":"I-V","density":7.703471050570629,"density_atomic":0.05217029885260068,"volume":38.33598894364586,"volume_molar":11.543236079621954,"formula_full":"V1 I1","formula_reduced":"VI","formula_anonymous":"AB","energy_above_hull":null,"spacegroup":221},{"id":"jvasp-121144","created_at":"2022-09-04T14:38:52.846038Z","updated_at":"2022-09-04T14:38:52.846054Z","structure_string":"Ti1 I3\n1.0\n4.830187 0.000000 -0.000000\n-2.415093 4.183065 0.000000\n-0.000000 -0.000000 8.203010\nTi I\n1 3\ndirect\n0.666667 0.333333 0.000000 Ti\n0.333333 0.666666 0.745231 I\n0.000000 0.000000 0.000000 I\n0.333333 0.666666 0.254769 I\n","nsites":4,"nelements":2,"elements":["Ti","I"],"chemical_system":"I-Ti","density":4.293877147712066,"density_atomic":0.02413393799180458,"volume":165.74170371028228,"volume_molar":24.952996738638355,"formula_full":"Ti1 I3","formula_reduced":"TiI3","formula_anonymous":"AB3","energy_above_hull":0.6925217895833333,"spacegroup":187}]}