A. Veillard, E. Clementi
Theoretica Chimica Acta
The degeneracy effects in the isoelectronic series of the first-row atoms are analyzed. The near-degenerate configurations 1s22s 2p2 and 1s22s02pn+2 are computed within the framework of a two-configuration SCF technique. The newly obtained correlation energy diagram indicates a remarkable simplicity in its structure.
A. Veillard, E. Clementi
Theoretica Chimica Acta
E. Clementi, H. Clementi, et al.
The Journal of Chemical Physics
H. Kistenmacher, H. Popkie, et al.
The Journal of Chemical Physics
A. Veillard, E. Clementi
The Journal of Chemical Physics