HIS article gives a compilation and basis function analysis of existingab initio molecular
eigen-functions. Our review pertains to that body of the literature in which a directsolution of …

This report describes the development of the theory of charge exchange in collisions of ions
with atoms or ions, paying particular attention to the work of the last decade. The successful …

Publisher Summary This chapter presents the calculation of atomic transition probabilities.
Measurements of lifetimes proceed by exciting the atoms of interest either optically or by …

We analyze data of the pseudopotential files and successive plane-wave calculations,
determining the Slater-Condon parameters related to the 4f and 5d shells of the lanthanide …

A survey of the observed quadrupole coupling constants of the deuteron is presented. It is
concluded on the basis of calculations that the field gradients at hydrogen nuclei will be …

The method for calculation of spin-orbital interaction in benzene, developed by Mizushima
and Koide, is extended to N-heterocyclic molecules in which both (π, π∗) and (n, π∗) states …

This paper deals with the evaluation of screened-hydrogenic orbitals for a many-electron
atom. Expressions for Slater intergrals and their derivatives with respect to the effective …

Publisher Summary This chapter focuses on the techniques used in the calculations of
electron affinities of atoms and molecules. The extrapolation method lends support to the …

Publisher Summary This chapter discusses atomic rearrangement collisions. The
application of the theory of rearrangement collisions logically extends far beyond the …

The observation of a predominantly isotropic fluorine hyperfine interaction in the
paramagnetic resonance of Mn++ ions dissolved in a Zn F 2 crystal has been interpreted in …