Calculation of Matrix Elements for One-Dimensional Quantum-Mechanical Problems
- 1 November 1968
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 49 (9) , 4209-4211
- https://doi.org/10.1063/1.1670738
Abstract
A simple method proposed by Harris et al. using the techniques of transformation theory for the generation of the matrix elements of one‐dimensional potential functions in a discrete, orthonormal basis is shown to be equivalent to Gaussian quadratures when the basis is constructed of orthogonal polynomials. The basis on is also discussed.
Keywords
This publication has 4 references indexed in Scilit:
- Energy Levels of One- and Two-Dimensional Anharmonic OscillatorsThe Journal of Chemical Physics, 1967
- Computation of vibrational-rotational energy levels of diatomic potential curvesJournal of Molecular Spectroscopy, 1967
- Microwave Spectrum, Vibration—Rotation Interaction, and Potential Function for the Ring-Puckering Vibration of Trimethylene SulfideThe Journal of Chemical Physics, 1966
- Calculation of Matrix Elements for One-Dimensional Quantum-Mechanical Problems and the Application to Anharmonic OscillatorsThe Journal of Chemical Physics, 1965