2007 Annual Meeting

Session: Multiscale Modeling and Characterization of Polymers

Chair

Coray M. Colina, Pennsylvania State University

Co-Chair

Manolis Doxastakis, University of Houston

Presentations

08:30 AM

(543a) Structural and Dynamical Properties of Polystyrene Determined by Coarse-Graining MD Simulations
Dirk Reith, Kurt Kremer, Vagelis Hamandaris, Nico F.A. Van der Vegt

08:48 AM

(543b) Rheological And Entanglement Characteristics Of Polyethylene Liquids And Visualization Of Conformational Changes In Shear And Elongational Flows
Jun Mo Kim, David J. Keffer, Martin Kröger, Brian J. Edwards

09:06 AM

(543c) Free Volume And Transport Properties In Polymeric Materials
Xiaoyan Wang

09:24 AM

(543d) Transport Properties in Nanocomposites: Modeling Cfd Approach for Randomly Distributed Systems
Matteo Minelli, Marco Giacinti Baschetti, Ferruccio Doghieri

09:42 AM

(543e) Mesoscale Simulations Of Hydrated Nafion Membranes
Aleksey Vishnyakov, Alexander V. Neimark

10:00 AM

(543g) Multiscale Simulations Of Fluid Flow Through Polymer Grafted “Smart” Nano- And Micro-Porous Materials
Zhengmin Li, Donald Brenner

10:18 AM

(543h) Development of Structure-Property Relationships for Biobased Polymers Using Quantum and Molecular Mechanics Simulations
David Bruce, James McAliley