{"success":true,"data":{"mat_id":"agm005246919","formula":"LiSc2Al2(CO)2","summary":{"formula":"LiSc2Al2(CO)2","spg":160,"spg_symbol":"R3m","crystal_system":"trigonal","point_group":"3m","nsites":9,"n_elements":5,"elements":["Li","Sc","Al","C","O"]},"energy":{"e_above_hull":0.15237764,"e_form":-1.5522803,"energy_corrected":-64.40269,"energy_total":-62.99810492},"electronic":{"band_gap_ind":0.2608,"band_gap_dir":0.2921,"dos_ef":0.485101},"magnetic":{"total_mag":1.019748},"structure":{"a":12.557813825172532,"b":12.557813828798306,"c":12.557814108366378,"alpha":14.869277198602346,"beta":14.869277182167542,"gamma":14.869274691713969,"volume":113.57056472957322,"n_sites":9},"meta":{"prototype_id":"AB2C2D2E2_28_spg160","decomposition":" ScAl3  Li3Al2  Sc(AlC)3  Sc2CO  LiScO2 ","run_timestamp":"2024-10-05 23:33:18"},"composition":{"Li":1,"Sc":2,"Al":2,"C":2,"O":2}}}