{"success":true,"data":{"mat_id":"agm097801097","formula":"Nd(PaS3)2","summary":{"formula":"Nd(PaS3)2","spg":5,"spg_symbol":"C2","crystal_system":"monoclinic","point_group":"2","nsites":9,"n_elements":3,"elements":["Nd","Pa","S"]},"energy":{"e_above_hull":0.09978147,"e_form":-2.0621312,"energy_corrected":-67.09362,"energy_total":-63.1128598},"electronic":{"band_gap_ind":0.2209,"band_gap_dir":0.254,"dos_ef":0.5942463},"magnetic":{"total_mag":1.02847},"structure":{"a":5.41361822409984,"b":5.413618227111076,"c":8.776765137018709,"alpha":80.1829263832903,"beta":99.81707363408925,"gamma":98.96994518793925,"volume":247.60470092328057,"n_sites":9},"meta":{"prototype_id":"AB2C6_56_spg2","decomposition":" Nd(Pa2S5)2  Nd2PaS5  Pa2S5 ","run_timestamp":"2025-04-08 14:53:08"},"composition":{"Nd":1,"Pa":2,"S":6}}}