Erratum and answer to the comment by Harris on: Numerical treatment of two-center overlap integrals (J Mol Mod, 12,213-220, 2006).
In the present contribution, we present two numerical tables for overlap integrals over Slater type functions and over B functions using the method present in the paper (J Mol Model, 12:213-220, 2006) where there were typos in the data that led Harris to conclude that our method is flawed and not useful for serious work. The typos are corrected and the numerical tables are listed as well as values from the literature and values obtained using ACJU code in order to perform comparisons with regards to accuracy.
Safouhi
Hassan
H
University of Alberta, Edmonton, Canada. hassan.safouhi@ualberta.ca
D009716:Numerical Analysis, Computer-Assisted