Quantum mechanical scattering studies using 2D cubic spline interpolation of a potential-energy surface
- 1 March 1976
- journal article
- letter
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 64 (5) , 2259-2261
- https://doi.org/10.1063/1.432417
Abstract
The quantum mechanical scattering results for a collinear A+BC exchange reaction using an analytic surface are compared with those obtained by the use of the corresponding spline fitted surface. (AIP)Keywords
This publication has 4 references indexed in Scilit:
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- Use of the method of diatomics-in-molecules in fitting ab initio potential surfaces:the system HeH+2Chemical Physics Letters, 1972
- Dynamics of the Collinear H+H2 Reaction. I. Probability Density and FluxThe Journal of Chemical Physics, 1971
- Semiempirical VB Calculation of the (H2I2) Interaction PotentialThe Journal of Chemical Physics, 1970