Abstract
An approach to compute couplings between bound and unbound wave functions was presented. Only classical Fourier coefficients of the Hamiltonians were used for the analysis.The approach was an extension of the technique used in the action-angle representation to compute bound-state to bound-state couplings. For one-dimensional Hamiltonians, an analogous approach was developed and demonstrated for several coupling potentials. The discussion about the generalization of higher dimensions was also done.
Original language | English |
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Pages (from-to) | 9574-9579 |
Number of pages | 6 |
Journal | Journal of Chemical Physics |
Volume | 117 |
Issue number | 21 |
DOIs | |
State | Published - 1 Dec 2002 |
Externally published | Yes |
ASJC Scopus subject areas
- General Physics and Astronomy
- Physical and Theoretical Chemistry