1. Calculations have been made for H2(X1Σg+), Li2(X1Σg+), Na2(X1Σg+), and K2(X1Σg+), but of decreasing quality by one of the authors (P.E.C.). Also see H. A. Pohl, R. Rein, and K. Appel (Ref. 2) for a simplified SCF method applied to hydrogen halides.
2. H. A. Pohl, R. Rein, and K. Appel, J. Chem. Phys. 41, 3385 (1964) (HCl).JCPSA60021-9606
3. P. E. Cade and W. M. Huo, J. Chem. Phys. 47, 614 (1967), preceding paper.JCPSA60021-9606
4. Later calculations will involve certain excited states. Therefore specific configurations and states are cited using the experimental symbol if it is unambiguously attributable to the particular state.
5. P. S. Bagus (Argonne National Laboratory) (private communication). These are atomic calculations for Na(2S), Al(2P), Si(3P), P(4S), S(3P), and Cl(2P) to Hartree‐Fock accuracy using the expansion method.