Wide-Amplitude Rovibrational Bound States
in Polyatomic Molecules
Edited by
Igor N. Kozin, Mark M. Law
Department of Chemistry, University of Aberdeen,
Meston Walk, Aberdeen, AB24 3UE, United Kingdom
and Jonathan N. L. Connor
Department of Chemistry, University of Manchester,
Manchester, M13 9PL, United Kingdom
Published by
Collaborative Computational Project on Molecular Quantum Dynamics (CCP6),
Daresbury Laboratory, Daresbury, Warrington, WA4 4AD, United Kingdom
Suggested Dewey classification: 539.6
ISBN 0-9522736-8-3
© CCP6 2002
Order a copy of the booklet.
- Rovibrational Calculations Using Normal Coordinates and
Large Amplitude Coordinates
N. C. Handy
- Quantum Ro-Vibrational Spectrum Calculation Based on a
Polyspherical Parametrization of an N-Atom System
C. Iung, F. Gatti, F. Ribeiro and C. Leforestier
- Corrections to the Born-Oppenheimer Approximation
D. W. Schwenke
- Characterization of Vibrational Energy Levels of
Tetratomic Molecules
M. Mladenovic and M. Lewerenz
- Recent developments in the use of Lanczos-based iterative
methods to calculate spectra
T. Carrington Jr, B. Poirier, and X.-G. Wang
- Large Amplitude Motion in Molecular Complexes
Z. Yu, T. Stone, C.-C. Chuang , W. Klemperer
- Accurate Intermolecular Potentials from Explicitly
Correlated Electronic Wavefunctions
W. Klopper and C. C. M. Samson
- High Resolution Overtone Spectroscopy: Unraveling Global
Vibrational Energy Patterns
M. Herman
- From High Resolution Spectroscopy to Detailed Molecular
Quantum Dynamics
D. Luckhaus
- Predicting the Spectra of Carboions
P. R. Bunker
- Studies of Large Amplitude Motions in Weakly Bound Complexes
using Diffusion Monte Carlo
A. B. McCoy and H.-S. Lee
- Using the Semiclassical Initial Value Representation to
Include Quantum Effects in Molecular Dynamics
W. H. Miller
- A New Way of Intramolecular Vibrational Redistribution Induced by
Fast Internal Motion as Revealed by Jet Cooled Spectrum of Cyclopentene
L. Lespade, D. Cavagnat
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If you have any queries, send mail to:
m.m.law@abdn.ac.uk.
This page last modified July 21st, 2002