A set of f-polarization functions for pseudo-potential basis sets of the transition metals ScCu, YAg and LaAu

A Set of seven-component f-type polarization functions has been optimized for use with the pseudo-potentials of Hay and Wadt at the CISD level of theory for the transition metals ScCu, YAg, LaAu in the energetically lowest-lying s1 dn electronic state.