A natural potential surface dissection technique for molecular scattering
- 15 March 1983
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 78 (6) , 3032-3042
- https://doi.org/10.1063/1.445265
Abstract
This paper is concerned with the dissection of general potential scattering surfaces in a way that takes into account their natural contour structure. In this fashion, the scattering problem can be broken into a set of pieces based on the slowly varying nature of the potential surface along its natural contours. The boundary integral method is used to represent the solution in each subregion in terms of its value and normal derivative along the subregion boundaries. A simple illustrative example was considered based on direct numerical solutions of the resulting algebraic equations. For efficient treatment of realistic problems, we also show how previously developed R-matrix theory ideas may be readily applied in the present circumstances.Keywords
This publication has 27 references indexed in Scilit:
- A finite element method with local trigonometric basis for close coupling equationsThe Journal of Chemical Physics, 1981
- Numerical Methods in Water-Wave Diffraction and RadiationAnnual Review of Fluid Mechanics, 1978
- Multi-level adaptive solutions to boundary-value problemsMathematics of Computation, 1977
- Piecewise analytic wavefunctions for bound states and scatteringThe Journal of Chemical Physics, 1976
- Integral Equations without a Unique Solution can be made Useful for Solving some Plane Harmonic ProblemsIMA Journal of Applied Mathematics, 1975
- Variational correction to Wigner R-matrix theory of scatteringJournal of Physics B: Atomic and Molecular Physics, 1975
- Wave-induced oscillations in harbours of arbitrary geometryJournal of Fluid Mechanics, 1971
- Diffraction of Steady Acoustic Waves by Surfaces of Arbitrary ShapeThe Journal of the Acoustical Society of America, 1963
- Integral equation methods in potential theory. IProceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 1963
- Higher Angular Momenta and Long Range Interaction in Resonance ReactionsPhysical Review B, 1947