Using a pruned basis, a non-product quadrature grid, and the exact Watson normal-coordinate kinetic energy operator to solve the vibrational Schrödinger equation for C2H4-Reference-Cited by-同舟云学术

Using a pruned basis, a non-product quadrature grid, and the exact Watson normal-coordinate kinetic energy operator to solve the vibrational Schrödinger equation for C2H4

Published:2011-08-14 Issue:6 Volume:135 Page:064101
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Avila Gustavo,Carrington Tucker

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.3617249

Reference103 articles.

1. The calculation of the vibration-rotation energies of triatomic molecules using scattering coordinates

2. The variational method for the calculation of RO-vibrational energy levels

3. A general discrete variable method to calculate vibrational energy levels of three‐ and four‐atom molecules

4. A General Variational Algorithm to Calculate Vibrational Energy Levels of Tetraatomic Molecules

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