Wednesday, March 29

08:30 - 09:30 Keynote

Mark Peletier
Upscaling the dynamics of dislocations

Lecture Hall, ZIB

09:30 - 10:30 Keynote

Gary Froyland
Coherence and multiscale dynamics in geophysical

Lecture Hall, ZIB

10:30 - 11:00 Coffee break
11:00 - 13:00 Mini Symposium
Mini Symposium

Open Systems

Molecular Kinetics and Kinetic Models from MD simulations

Chair: Carsten Hartmann
Lecture Hall, ZIB

Chair: Douwe Bonthuis
Lecture Hall, Informatik
11:00 Internal Structure and Dynamics of Complex Fluid Interfaces
Patrick Ilg
11:00 Connecting local solvent dynamics to thermodynamic properties
Matthias Heyden
11:30 Sampling with non-reversible dynamics
Michela Ottobre
11:40 Enhancing Important Fluctuations and Exploring Free Landscapes with Variationally Enhanced Sampling
Omar Valsson
12:00 Open Boundary Molecular Dynamics
Matej Praprotnik
12:20 Kinetics of protein-ligand binding and protein-protein interactions revealed in atomic detail using Markov state modeling
Nuria Plattner
12:30 Theory and simulation of open quantum systems
Jens Eisert
13:00 - 14:30 Lunch break
14:30 - 16:30 Mini Symposium
Mini Symposium

Stochastic Modeling Approaches for Turbulent Flows

Multi-scale Reaction Kinetics

Chair: Thomas von Larcher
Lecture Hall, ZIB

Chair: Mohsen Sadeghi
Lecture Hall, Informatik
14:30 Stochastic Chaos in a turbulent von Karman flow
Davide Faranda
14:30 Combining molecular dynamics with mesoscopic Green’s function reaction dynamics simulations
Pieter Rein ten Wolde
14:55 Flow regimes and scale interactions in the stably stratified atmospheric boundary layer
Nikki Vercauteren
15:10 Move before reacting – multi-scale motion of molecules in biological/bio-mimetic fluids
Matthias Weiss
15:15 Beyond the limit of infinite time-scale separation: Edgeworth approximations and homogenisation
Jeroen Wouters
15:50 The spatiotemporal chemical master equation
Stefanie Winkelmann
15:40 Energy Conserving Stochastic Models of the Atmosphere
Christian Franzke
16:05 Optimisation of an idealised primitive equation ocean model using stochastic parameterization
Fenwick Cooper
16:30 - 17:00
Coffee break
Closing words

Rupert Klein

Lecture Hall, ZIB