Quantum Mechanical Model of Three-Body Rearrangement Scattering. II. Calculations for a Resonance Energy
- 15 March 1970
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 52 (6), 3179-3182
- https://doi.org/10.1063/1.1673454
Abstract
In a companion paper, Robinson shows that the basis set which Hulburt and Hirschfelder used to obtain the transmission and reflection coefficients for a quantum mechanical model of reactive scattering of three atoms in a line was incomplete for a set of resonance energies. In the present paper, using Robinson's complete basis set, agreement is obtained with Tang, Kleinman, and Karplus's estimate of the transmission coefficient for E(8μl 2 / h 2 ) = 2 . It is found that the “point matching” method of solution does not converge as rapidly as the truncated Fourier series. Graphs of the flux and particle density are given.Keywords
This publication has 4 references indexed in Scilit:
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- Solvable Quantum-Mechanical Model of Three-Body Rearrangement ScatteringThe Journal of Chemical Physics, 1969
- The Transmission Coefficient in the Theory of Absolute Reaction RatesThe Journal of Chemical Physics, 1943
- Some Quantum-Mechanical Considerations in the Theory of Reactions Involving an Activation EnergyThe Journal of Chemical Physics, 1939