{"success":true,"data":{"mat_id":"agm010795923","formula":"Ba6Ti2Ir(ClO6)2","summary":{"formula":"Ba6Ti2Ir(ClO6)2","spg":164,"spg_symbol":"P-3m1","crystal_system":"trigonal","point_group":"-3m","nsites":23,"n_elements":5,"elements":["Ba","Ti","Ir","Cl","O"]},"energy":{"e_above_hull":0.0023533013,"e_form":-2.9583244,"energy_corrected":-166.23495,"energy_total":-157.80748192},"electronic":{"band_gap_ind":0.407,"band_gap_dir":0.4071,"dos_ef":0.3963292},"magnetic":{"total_mag":3.0255587},"structure":{"a":5.953869224044131,"b":5.953869224044131,"c":15.0475125,"alpha":90,"beta":90,"gamma":120.0000000449384,"volume":461.9488886784867,"n_sites":23},"meta":{"prototype_id":"AB2C2D6E12_2_spg164","decomposition":" Ba2TiO4  Ba4Ir6ClO18  Ba11(IrO6)4  BaTiO3  BaCl2 ","run_timestamp":"2024-07-22 18:23:19.717997"},"composition":{"Ba":6,"Ti":2,"Ir":1,"Cl":2,"O":12}}}