{"success":true,"data":{"mat_id":"agm017190526","formula":"Cs3Nd5(PS4)6","summary":{"formula":"Cs3Nd5(PS4)6","spg":9,"spg_symbol":"Cc","crystal_system":"monoclinic","point_group":"m","nsites":76,"n_elements":4,"elements":["Cs","Nd","P","S"]},"energy":{"e_above_hull":0,"e_form":-1.5237037,"energy_corrected":-431.69977,"energy_total":-399.85369609},"electronic":{"band_gap_ind":2.281,"band_gap_dir":2.281,"dos_ef":0},"magnetic":{"total_mag":-1.51e-5},"structure":{"a":10.619691043458076,"b":10.619691043458076,"c":21.53928716069061,"alpha":79.71654342160686,"beta":79.71654342160686,"gamma":77.88015435585254,"volume":2311.6088224966334,"n_sites":76},"meta":{"prototype_id":"A3B5C6D24_4_spg9","decomposition":" Cs3Nd5(PS4)6 ","run_timestamp":"2024-11-01 05:26:51.739258"},"composition":{"Cs":6,"Nd":10,"P":12,"S":48}}}