{"success":true,"data":{"mat_id":"agm008697407","formula":"Ba2Ca2Se5","summary":{"formula":"Ba2Ca2Se5","spg":12,"spg_symbol":"C2\/m","crystal_system":"monoclinic","point_group":"2\/m","nsites":9,"n_elements":3,"elements":["Ba","Ca","Se"]},"energy":{"e_above_hull":0.07038774,"e_form":-1.7486696,"energy_corrected":-41.04063,"energy_total":-41.04063134},"electronic":{"band_gap_ind":1.6697,"band_gap_dir":1.8174,"dos_ef":0},"magnetic":{"total_mag":3.0e-7},"structure":{"a":8.109209850350494,"b":8.109209850350494,"c":7.918652955188493,"alpha":77.08687686310051,"beta":77.08687686310051,"gamma":34.482178812773,"volume":286.6243803573902,"n_sites":9},"meta":{"prototype_id":"A2B2C5_239_spg12","decomposition":" BaSe2  CaSe  BaSe ","run_timestamp":"2024-05-28 10:45:34.818760"},"composition":{"Ba":2,"Ca":2,"Se":5}}}