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Workshop Schedule


Sunday May 4, 2014
16:00-19:30 Symposium in honor of Hermann Hartmann (Schedule)
Monday May 5, 2014
09:00-09:30 Registration
09:30-09:45 Welcome
09:45-10:30 Klaus Richter (Overview Talk)
Complex systems: From classical to quantum, from single to many particle problems
10:30-11:00 Coffee break
11:00-11:30 Jiri Vanicek
Ab initio quantum, semiclassical, and mixed quantum-classical molecular dynamics
11:30-12:00 Klaus Møller
Chemical dynamics: Quantum states riding on classical trajectories
12:00-12:30 Ivano Tavernelli
Nonadiabatic dynamics of complex molecular systems based on time-dependent density functional theory
12:30-14:00 Lunch
14:00-14:45 Frank Grossmann (Overview Talk)
Semiclassical initial value representations for complex quantum dynamics: A primer with selected applications
14:45-15:15 Caroline Lasser
Tailored multivariate Hermite functions
15:15-15:45 Angel Sanz Ortiz
From quantumness to classicality: A Bohmian journey
15:45-16:15 Coffee break
16:15-17:00 Gerhard Hummer (Overview Talk)
Molecular simulation of protein dynamics and function
17:00-17:30 Gregor Diezemann
Force probe molecular dynamics simulations of reversible dynamics in hydrogen-bond networks
17:30-18:30 Discussion
20:00 COST Workgroup 2 Meeting
Tuesday May 6, 2014
09:00-09:30 Registration
09:30-10:00 Federica Agostini
Exact time dependent potential energy surface in non-adiabatic processes
10:00-10:30 Volker Betz
Superadiabatic transitions in molecular quantum dynamics
10:30-11:00 Coffee break
11:00-11:45 Christoph Lienau (Overview Talk)
Real-time probing of coherent energy and charge transfer phenomena in hybrid nanostructures
11:45-12:15 David Coker
Quantum dynamics simulations exploring coherence in excitation energy transfer and charge separation in extended light harvesting systems
12:15-14:00 Lunch
14:00-14:30 Oliver Kühn
Excitons in molecular aggregates: From electronic structure to dissipative dynamics
14:30-15:00 Peter Nalbach
Quantum energy transport in correlated and non-equilibrium environments
15:00-15:30 Martin Plenio
Dynamics of electronic and vibrational motion: From numerical simulation methods to long-lived electronic coherences
15:30-16:00 coffee break
16:00-16:30 Michael Thoss
Quantum dynamics and transport in molecular systems using time-dependent multiconfiguration methods
16:30-17:00 Sara Bonella
Approximating quantum time correlation functions via the Phase Integration Method
17:00-18:00 Discussion
20:00 Workshop dinner
Wednesday May 7, 2014
09:30-10:15 Bill Coffey (Overview Talk)
On the Kramers escape rate for point particles and classical spins
10:15-10:35 Declan Byrne
Linear and nonlinear stationary AC response of the magnetization of nanomagnets in the presence of thermal agitation and spin-transfer torques
10:35-11:00 Coffee break
11:00-11:45 Heinz-Peter Breuer (Overview Talk)
Non-equilibrium Quantum Dynamics of Open Systems
11:45-12:15 Walter Strunz
Hierarchy of stochastic pure states for open quantum system dynamics
12:15-12:45 Rocco Martinazzo
Effective mode representation of structured environments: towards first principles quantum dynamics of hydrogen atoms on graphene
12:45-14:15 Lunch
14:15-15:00 Dieter Schuch (Overview talk)
On a Complex Way of Connecting Quantum Theory with Nonlinear Dynamics
15:00-15:30 Coffee break
15:00-16:00 Round Table Discussion