{"success":true,"data":{"mat_id":"agm033803685","formula":"Nd2ThS3","summary":{"formula":"Nd2ThS3","spg":139,"spg_symbol":"I4\/mmm","crystal_system":"tetragonal","point_group":"4\/mmm","nsites":6,"n_elements":3,"elements":["Nd","Th","S"]},"energy":{"e_above_hull":0.010494327,"e_form":-2.2872672,"energy_corrected":-43.07308,"energy_total":-41.08269741},"electronic":{"band_gap_ind":0,"band_gap_dir":0.0017,"dos_ef":2.8801005},"magnetic":{"total_mag":-8.0e-7},"structure":{"a":9.071566212026555,"b":9.071566211115572,"c":9.071566213733396,"alpha":154.14870686650585,"beta":154.14870682435804,"gamma":36.88349811148196,"volume":141.73923941997913,"n_sites":6},"meta":{"prototype_id":"AB2C3_103_spg139","decomposition":" Nd3ThS4  NdTh3S4 ","run_timestamp":"2025-04-15 10:01:33"},"composition":{"Nd":2,"Th":1,"S":3}}}