We recently organised a CCP6 Workshop on "Time-dependent Quantum
Dynamics". 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 (the latter should
have received the January 2001 edition of the CCP6 Newsletter
earlier this year).
If you are not in either of the above groups and you would like a
copy please email
Marko Cvitas ([log in to unmask])
Your email should include your _postal_ address in a format that
can easily be cut-and-pasted to an address label.
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Time-dependent Quantum Dynamics,
edited by Stuart C. Althorpe, Pavel Soldan, and Gabriel G. Balint-Kurti,
published by CCP6, Daresbury, 2001.
ISBN 0-9522736-7-5
Contents:
Multi-configurational quantum/classical approaches for studying
photodissociation and reaction dynamics
Anne B. McCoy, Lichang Wang and Feng Chen
Mixed quantum/classical dynamics applied to vibrational energy
relaxation in rare gas-halogen clusters
Beatriz Miguel, Adolfo Bastida, Sebastian Fernandez Alberti, and
Nadine Halberstadt
The multi-configuration time-dependent Hartree (MCTDH) algorithm:
an efficient method for propagating wavepackets of several dimensions
Hans-Dieter Meyer and Graham A. Worth
An introduction to reaction rate theory
Uwe Manthe
HeH2+: A case study in time-dependent quantum mechanical approach
to reactive scattering
B. Maiti and N. Sathyamurthy
The real wave packet approach to scattering dynamics: theory and
applications
Stephen K. Gray
Time-dependent reactive scattering calculations using parallel computers
Anthony J. H. M. Meijer
Potential energy surface, quantum dynamics, and the
H2 + OH -> H2O + H reaction
Dong H. Zhang
A divide-and-conquer approach to approximations for reactive scattering
Donald J. Kouri and David K. Hoffman
Wavepacket calculations of differential cross sections for reactive
scattering
Stuart C. Althorpe
Semirigid vibrating rotor target model for polyatomic reaction dynamics
John Z.H. Zhang
Quantum dynamics of four atom systems
Evelyn M. Goldfield
Time dependent wave packet method for fast reactions at low energies
Erasmo Buonomo and David C. Clary
Application of Mandelshtam and Taylor's absorbing boundary conditions
evolution operator expression in time-dependent wave packet calculations
on molecule-surface scattering
Geert-Jan Kroes
Time-dependent quantum theory of photodissociation and non-adiabatic
processes
Gabriel G. Balint-Kurti and Alex Brown
--
Dr S.C. Althorpe Tel: +44-191-374-7013
Department of Chemistry Fax: +44-191-386-1127
University of Durham
Durham DH1 3LE
United Kingdom http://www.dur.ac.uk/s.c.althorpe/
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