{"success":true,"data":{"mat_id":"agm077706531","formula":"Ba6P3I2Cl","summary":{"formula":"Ba6P3I2Cl","spg":12,"spg_symbol":"C2\/m","crystal_system":"monoclinic","point_group":"2\/m","nsites":12,"n_elements":4,"elements":["Ba","P","I","Cl"]},"energy":{"e_above_hull":0.013608098,"e_form":-1.5442191,"energy_corrected":-50.650833,"energy_total":-50.65083482},"electronic":{"band_gap_ind":1.4001,"band_gap_dir":1.4217,"dos_ef":-0.0021199},"magnetic":{"total_mag":-5.74e-5},"structure":{"a":8.21889185756957,"b":8.218891864276952,"c":8.634785811295673,"alpha":80.9230867309688,"beta":99.0769132794051,"gamma":60.0313612834522,"volume":479.51001794990697,"n_sites":12},"meta":{"prototype_id":"AB2C3D6_1_spg12","decomposition":" Ba2PCl  Ba2PI ","run_timestamp":"2025-01-10 01:45:07"},"composition":{"Ba":6,"P":3,"I":2,"Cl":1}}}