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Poly and Polymer Electrolytes for Energy Conversion: Ab Initio, Molecular, and Continuum Models | ||||||||
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Program All
talks take place in room 201 of the Huygens building. Talks
are including 10 to 15 minutes discussion time Directed
discussion = organized, in room 201 Informal
discussion = spontaneous, not organized Poster
session = posters can be put up in the corridor (room for 35 posters) ========================================================================= Monday 23 August 2010 ========================================================================= 09:30 - 10:00 Office assignment and coffee 10:00 - 10:15 Welcome Remarks 10:15 - 11:00 Overview Talk: Keith Promislow 11:00 - 12:00 Marcus
Mueller: Structure
formation in multicomponent polymer materials: soft,
coarse-grained models 12:00 - 13:30 Lunchbreak@Huygens
Restaurant 13:30 - 14:30 J.C.
Hummelen (Fabrication of BHJ solar cells) 14:30 - 15:00 Coffee/tea break 15:00 - 16:00 Alison
Walker: Multiscale modelling
of excitonic solar cells 16:00 - 16:30 Directed
discussion (Arjen Doelman) 16:30 - 17:00 6 Junior
participants, 5 minutes talks 17:00 - 19:00 Wine & Cheese party in the Common
room Poster session ========================================================================= Tuesday 24 August 2010 ========================================================================= 09:00 - 10:00 Kurt
Kremer: Organic
Materials for Molecular Electronics: Scale Bridging Simulation Approach 10:00 - 10:30 Coffee/tea break 10:30 - 11:15 Carme Calderer: Gels:
mechanis and chemistry 11:15 - 12:00 David
Wang: Numerical Modeling of
Polyelectrolyte Adsorption and Layer- by-Layer Assembly 12:00 - 13:30 Lunchbreak@Huygens
Restaurant 13:30 - 15:00 Informal Tutorial on SCFT by Wang/Garcia-Cervera Numerical advances in Self-Consistent
Field Theory simulations, and applications
to block copolymer lithography 15:00 - 16:00 Jim
McCusker: The Science of Solar Energy
Conversion: Fundamental Issues and Global Applications 16:00 - 16:30 Directed
Discussion (K. Promislow) ========================================================================= Wednesday 25 August 2010 ========================================================================= 09:00 - 10:00 Stephen
Paddison: Connecting the structure and transport properties of polymer
electrolyte membranes through modeling and experiments 10:00 - 10:30 Coffee/tea break 10:30 - 11:15 James
Elliott: A
unified morphological description of Nafion membranes
from SAXS and
mesoscale simulations 11:15 - 12:00 Vincent
Meunier: Modeling of carbon nanostructures for capacitive energy storage 12:00 - 14:00 Lunchbreak@Huygens
Restaurant and informal discussions 14:00 - 14:45 David
Andelman: Block Copolymers at Surfaces: Patterns, Templates and Electric Fields 14:45 - 15:30 Martin
Muser: Split
charge equilibration: A charge transfer method for electrolytes
and other non-metallic materials 15:30 - 16:00 Coffee/tea break 16:00 - 16:45 Christian
Holm: Investigating Polyelectrolyte Multilayers
(PEMs) via Simulations 16:45 - 17:00 Bus transfer to harbor, downtown Leiden 17:00 - 21:00 Boat trip@Kaaglakes with dinner on board Transport to harbor: see info link
boat trip above. ========================================================================= Thursday 26 August 2010 ========================================================================= 09:00 - 10:00 Hans
Fraaije: Stogastic
quasi-Newton method for molecular simulations 10:00 - 10:30 Coffee/tea break 10:30 - 11:15 Carlos
Garcia-Cervera: A Linear Scaling Subspace Iteration Algorithm with Optimally Localized Non-Orthogonal
Wave Functions for Kohn-Sham Density Functional Theory 11:15
- 12:00 Nico van der Vegt: Systematic coarse-graining of molecular
models: simple-yet-specific models for polymers and polyelectrolytes 12:00 - 13:30 Lunchbreak@Huygens
Restaurant & Informal discussions 13:30 - 15:00 Informal Tutorial on RG theory Vvedensky 15:00 - 16:00 John
Strain: Moving interfaces and elliptic systems 16:00 - 16:45 Chris
Budd: Emergent
scaling laws in dielectric materials 16:45 - 17:15 Coffee/tea break 17:15 - 17:45 Directed
Discussion (S. Paddison) ========================================================================= Friday 27 August 2010 ========================================================================= 09:00 - 10:00 Dimitry Vvedensky: Coarse-Grained Theory of Surface Nanostructure Formation 10:00 - 10:30 Coffee/tea break 10:30 - 11:15 Douwe Bonthuis: Electro-hydraulic Power Conversion in Water-filled Nanochannels 11:15 - 12:00 Rolf
Ryham: Energetic
Variational Approaches in Modeling the Ionic Fluids 12:00 - 14:00 Lunchbreak@Huygens
Restaurant 14:00 - 15:00 Closing Talk Marc Koper: Fuel cell catalysis in acidic and alkaline electrolytes === end of
workshop === [Back] |