{"success":true,"data":{"mat_id":"agm084413656","formula":"Ba6P3Br2Cl","summary":{"formula":"Ba6P3Br2Cl","spg":12,"spg_symbol":"C2\/m","crystal_system":"monoclinic","point_group":"2\/m","nsites":12,"n_elements":4,"elements":["Ba","P","Br","Cl"]},"energy":{"e_above_hull":0.0032826609,"e_form":-1.6447346,"energy_corrected":-52.102516,"energy_total":-52.10251807},"electronic":{"band_gap_ind":1.3733,"band_gap_dir":1.3992,"dos_ef":-0.001675},"magnetic":{"total_mag":-0.0004849},"structure":{"a":8.136087197348061,"b":8.136087198786894,"c":8.356584923285027,"alpha":80.64580607204901,"beta":99.35419389736701,"gamma":60.00972866457156,"volume":453.0945638312466,"n_sites":12},"meta":{"prototype_id":"AB2C3D6_529_spg12","decomposition":" Ba2PBr  Ba2PCl ","run_timestamp":"2025-03-09 04:53:29"},"composition":{"Ba":6,"P":3,"Br":2,"Cl":1}}}