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Smooth models for the Coulomb potential
Journal article

Smooth models for the Coulomb potential

Abstract

Smooth model potentials with parameters selected to reproduce the spectrum of one-electron atoms are used to approximate the singular Coulomb potential. Even when the potentials do not mimic the Coulomb singularity, much of the spectrum is reproduced within the chemical accuracy. For the hydrogen atom, the smooth approximations to the Coulomb potential are more accurate for higher angular momentum states. The transferability of the model …

Authors

González-Espinoza CE; Ayers PW; Karwowski J; Savin A

Journal

Theoretical Chemistry Accounts, Vol. 135, No. 12,

Publisher

Springer Nature

Publication Date

December 2016

DOI

10.1007/s00214-016-2007-5

ISSN

1432-881X