{"success":true,"data":{"mat_id":"agm017384629","formula":"KEr(TlBr3)2","summary":{"formula":"KEr(TlBr3)2","spg":146,"spg_symbol":"R3","crystal_system":"trigonal","point_group":"3","nsites":10,"n_elements":4,"elements":["K","Er","Tl","Br"]},"energy":{"e_above_hull":0.005292613,"e_form":-1.4593354,"energy_corrected":-35.028194,"energy_total":-35.02819387},"electronic":{"band_gap_ind":4.052,"band_gap_dir":4.1467,"dos_ef":0},"magnetic":{"total_mag":-1.0e-7},"structure":{"a":8.372660175698305,"b":8.37266018046164,"c":8.372660177621478,"alpha":57.91946923764027,"beta":57.91946920273639,"gamma":57.919469201743546,"volume":395.21040020608297,"n_sites":10},"meta":{"prototype_id":"ABC2D6_231_spg2","decomposition":" KEr(TlBr3)2 ","run_timestamp":"2024-10-16 05:10:07.066147"},"composition":{"K":1,"Er":1,"Tl":2,"Br":6}}}