H. Kistenmacher, H. Popkie, et al.
The Journal of Chemical Physics
The correlation energy for systems containing 3d and 4s electrons has been examined making use of recently obtained Hartree-Fock energies for the elements from K to Zn. In addition to the expected pair correlation between 3d electrons, a large extrashell correlation has been found. These results make it desirable to re-examine the simple correlation model previously put forward. The relativistic correction for the elements in consideration has been discussed.