{"success":true,"data":{"mat_id":"agm020487372","formula":"Cs2Ca(NbBr3)6","summary":{"formula":"Cs2Ca(NbBr3)6","spg":148,"spg_symbol":"R-3","crystal_system":"trigonal","point_group":"-3","nsites":27,"n_elements":4,"elements":["Cs","Ca","Nb","Br"]},"energy":{"e_above_hull":0,"e_form":-1.174136,"energy_corrected":-125.94685,"energy_total":-125.94685571},"electronic":{"band_gap_ind":1.1258,"band_gap_dir":1.1262,"dos_ef":-0.0389704},"magnetic":{"total_mag":0},"structure":{"a":10.94403173940646,"b":10.944031743623475,"c":10.944031741562828,"alpha":55.34262196639383,"beta":55.34262200236913,"gamma":55.34262199766922,"volume":826.5712395095231,"n_sites":27},"meta":{"prototype_id":"AB2C6D18_9_spg148","decomposition":" Cs2Ca(NbBr3)6 ","run_timestamp":"2024-08-25 14:52:17.498599"},"composition":{"Cs":2,"Ca":1,"Nb":6,"Br":18}}}