{"success":true,"data":{"mat_id":"agm006457641","formula":"Zr(H3Ir)2","summary":{"formula":"Zr(H3Ir)2","spg":191,"spg_symbol":"P6\/mmm","crystal_system":"hexagonal","point_group":"6\/mmm","nsites":9,"n_elements":3,"elements":["Zr","H","Ir"]},"energy":{"e_above_hull":0.2511956,"e_form":-0.051377818,"energy_corrected":-46.17096,"energy_total":-46.17095887},"electronic":{"band_gap_ind":0,"band_gap_dir":0.0014,"dos_ef":6.0507646},"magnetic":{"total_mag":0.1588272},"structure":{"a":4.633057256234586,"b":4.633057256234586,"c":4.01125967,"alpha":90,"beta":90,"gamma":119.99999994623037,"volume":74.56701251234456,"n_sites":9},"meta":{"prototype_id":"AB2C6_1497_spg147","decomposition":" ZrH3Ir  Zr2HIr6  H2 ","run_timestamp":"2024-02-28 21:12:58.630969"},"composition":{"Zr":1,"H":6,"Ir":2}}}