Searched refs:init_geom_mpqc_conv (Results 1 – 1 of 1) sorted by relevance
511 DataGeomConv init_geom_mpqc_conv(gchar *namefile) in init_geom_mpqc_conv() function549 GeomConv[Ncalculs-1] = init_geom_mpqc_conv(NomFichier); in find_energy_mpqc_output()