{"success":true,"data":{"mat_id":"agm005233159","formula":"Ba6CaNb2Ir(ClO6)2","summary":{"formula":"Ba6CaNb2Ir(ClO6)2","spg":1,"spg_symbol":"P1","crystal_system":"triclinic","point_group":"1","nsites":24,"n_elements":6,"elements":["Ba","Ca","Nb","Ir","Cl","O"]},"energy":{"e_above_hull":0.16792923,"e_form":-2.8544626,"energy_corrected":-173.05232,"energy_total":-164.6248352},"electronic":{"band_gap_ind":0.6532,"band_gap_dir":0.6534,"dos_ef":-0.3520792},"magnetic":{"total_mag":1.0768785},"structure":{"a":6.18141670882902,"b":6.143977787531707,"c":16.170089693589293,"alpha":95.37086754352647,"beta":83.71036941431582,"gamma":120.83009532288493,"volume":523.6562767021369,"n_sites":24},"meta":{"prototype_id":"ABC2D2E6F12_1_spg8","decomposition":" Ba5Nb3ClO12  Ba3CaIrO6  Ba4Cl6O  Ba3CaNb2O9  Ba2Cl2O  Ir ","run_timestamp":"2024-10-14 11:03:03"},"composition":{"Ba":6,"Ca":1,"Nb":2,"Ir":1,"Cl":2,"O":12}}}