{"success":true,"data":{"mat_id":"agm010796783","formula":"Ba6Ti2Ir(BrO6)2","summary":{"formula":"Ba6Ti2Ir(BrO6)2","spg":164,"spg_symbol":"P-3m1","crystal_system":"trigonal","point_group":"-3m","nsites":23,"n_elements":5,"elements":["Ba","Ti","Ir","Br","O"]},"energy":{"e_above_hull":0,"e_form":-2.87013,"energy_corrected":-165.04454,"energy_total":-156.61706254},"electronic":{"band_gap_ind":0.4096,"band_gap_dir":0.4097,"dos_ef":0.3807696},"magnetic":{"total_mag":3.0252638},"structure":{"a":5.964467687853782,"b":5.964467687853782,"c":15.39536171,"alpha":90,"beta":90,"gamma":120.00000008711625,"volume":474.3117775050853,"n_sites":23},"meta":{"prototype_id":"AB2C2D6E12_2_spg164","decomposition":" Ba6Ti2Ir(BrO6)2 ","run_timestamp":"2024-07-24 05:51:05.023997"},"composition":{"Ba":6,"Ti":2,"Ir":1,"Br":2,"O":12}}}