We recently organised a CCP6 Workshop on "Wide-Amplitude Rovibrational
Bound States in Polyatomic Molecules". CCP6 has now published a
booklet containing short reviews by the Workshop participants, and
single copies of this are available free of charge (until we run out).
Copies will be sent out automatically to the Workshop participants and
everyone on the CCP6 Newsletter mailing list.
If you are not in either of the above groups and you would like a copy,
please either:
1) Fill in the form on the Web at
http://www.abdn.ac.uk/~che194/research/rv01/bk/form.html
or
2) Send email to [log in to unmask] , including
your _postal_ address in a format that can easily be cut-and-pasted
to an address label.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
An electronic version of the booklet, which is in HTML and therefore
loses some of the pretty formatting of the paper version, will soon be
made available at
http://www.abdn.ac.uk/~che194/research/rv01/bk/web.html
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Wide-Amplitude Rovibrational Bound States in Polyatomic Molecules,
edited by Igor N. Kozin, Mark M. Law and Jonathan N. L. Connor,
published by CCP6, Daresbury 2002.
ISBN 0-9522736-8-3
Contents:
Preface
What is CCP6?
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
+---------------------------------------------------------------------+
+ Dr. M. M. Law +
+ +
+ Chemistry Department Tel (01224) 272933 (UK) +
+ University of Aberdeen Tel +44 1224 272933 (International) +
+ Meston Walk +
+ Aberdeen Tel 01224 272943 (secretary) +
+ AB24 3UE Fax 01224 272921 +
+ Scotland e-mail: [log in to unmask] +
+ +
+ World-Wide Web home page: http://www.abdn.ac.uk/~che194/ +
+---------------------------------------------------------------------+
|