Asymptotic behavior of atomic and molecular wave functions
AUTOR(ES)
Katriel, J.
RESUMO
The asymptotic form of bound-state wave functions is derived by analytic continuation of asymptotic scattering-state wave functions. The result is also regorously derived by using an approach that is independent of scattering theory. One aspect of the result is that the N electron wave function becomes the lowest accessible exact wave function for the remaining N — 1 electrons when one electron is far away from all the nuclei. This shows that the recently developed extended Koopmans' procedures are in principle exact for the first ionization energy.
ACESSO AO ARTIGO
http://www.pubmedcentral.nih.gov/articlerender.fcgi?artid=349851Documentos Relacionados
- ASYMPTOTIC SPOTS OF ENTIRE AND MEROMORPHIC FUNCTIONS
- Photon Propagation Function: A Comparison of Asymptotic Functions
- ASYMPTOTIC BEHAVIOR AND PERIODIC SOLUTIONS OF A NONLINEAR DIFFERENTIAL-DIFFERENCE EQUATION*
- ASYMPTOTIC NORMALITY OF LINEAR COMBINATIONS OF FUNCTIONS OF ORDER STATISTICS, II*
- SPIN-COUPLED WAVE FUNCTIONS FOR ATOMS AND MOLECULES