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Lecture 3: Molecular dynamics: foundations II. <br> <em> Geometric integrators and applications to molecular dynamics.</em>
Presenter
- Benedict Leimkuhler
May 15, 2009
IMA
Lecture 2: Molecular dynamics: foundations I. <br> <em>Dynamical issues, ergodicity, and averages at constant energy.</em>
Presenter
- Benedict Leimkuhler
May 15, 2009
IMA
Climate change dynamics in theory, experiments and reality
Presenter
- David Zetland
May 5, 2009
SLMath
Nonadiabatic solvation dynamics and decoherence: a molecular hydrodynamic approach
Presenter
- Irene Burghardt
March 5, 2009
IMA
Electronically non-adiabatic dynamics via semiclassical initial value methods
Presenter
- William Miller
March 4, 2009
IMA
Non-Markovian quantum dynamics: Foundations and applications to relaxation and transport processes
Presenter
- Heinz-Peter Breuer
March 2, 2009
IMA
Surface hopping dynamics with direct semiempirical solution of the electronic problem
Presenter
- Maurizio Persico
January 14, 2009
IMA
Quantum molecular dynamics of complex systems studied with MCTDH: Dynamics and IR-spectroscopy of the protonated water dimer H5O2+ and its isotopologues
Presenter
- Hans-Dieter Meyer
January 13, 2009
IMA
Ab initio molecular dynamics via the Car-Parrinello method: Basic ideas, theory, and algorithms
Presenter
- Mark Tuckerman
December 7, 2008
IMA