{"success":true,"data":{"mat_id":"agm010796094","formula":"Ba6Ta2Ru(BrO6)2","summary":{"formula":"Ba6Ta2Ru(BrO6)2","spg":164,"spg_symbol":"P-3m1","crystal_system":"trigonal","point_group":"-3m","nsites":23,"n_elements":5,"elements":["Ba","Ta","Ru","Br","O"]},"energy":{"e_above_hull":0.019293955,"e_form":-2.9597473,"energy_corrected":-175.436,"energy_total":-167.00852569},"electronic":{"band_gap_ind":0.3009,"band_gap_dir":0.3513,"dos_ef":1.6540356},"magnetic":{"total_mag":2.0001712},"structure":{"a":6.044448922946726,"b":6.044448922946726,"c":15.34657529,"alpha":90,"beta":90,"gamma":120.00000003225337,"volume":485.5741180201648,"n_sites":23},"meta":{"prototype_id":"AB2C2D6E12_2_spg164","decomposition":" BaRuO3  Ba5Ta2Br2O9 ","run_timestamp":"2024-10-15 15:45:50.549132"},"composition":{"Ba":6,"Ta":2,"Ru":1,"Br":2,"O":12}}}