{"success":true,"data":{"mat_id":"agm069543567","formula":"CaThCl6","summary":{"formula":"CaThCl6","spg":12,"spg_symbol":"C2\/m","crystal_system":"monoclinic","point_group":"2\/m","nsites":8,"n_elements":3,"elements":["Ca","Th","Cl"]},"energy":{"e_above_hull":0.01683214,"e_form":-2.6778426,"energy_corrected":-38.370277,"energy_total":-38.37027888},"electronic":{"band_gap_ind":4.4735,"band_gap_dir":4.4966,"dos_ef":0},"magnetic":{"total_mag":1.0e-7},"structure":{"a":6.852214689414478,"b":6.852850145080634,"c":7.107731617573647,"alpha":82.57620993591327,"beta":61.31684321230133,"gamma":74.50681046332184,"volume":282.1626889018469,"n_sites":8},"meta":{"prototype_id":"ABC6_5_spg149","decomposition":" ThCl4  CaCl2 ","run_timestamp":"2024-12-17 00:20:13"},"composition":{"Ca":1,"Th":1,"Cl":6}}}