COMPTuesday, 30 August 2005

1:25 PM-4:40 PM Washington DC Convention Center -- 150B, Oral
Large Scale Molecular Dynamics, Nanoscale, and Mesoscale Modeling and Simulation: Bridging the Gap
Polymer Applications and Methods
Organizer:Richard B. Ross
Organizer, Presiding:Sanat Mohanty
1:25 PMIntroductory Remarks
1:30 PMModeling the thermal decomposition of large molecules and nanostructures
Marc R. Nyden, Stanislav I. Stoliarov, Phillip R. Westmoreland
2:10 PMMultiscale simulation of ultraviolet absorber function in polymers
Michael L. Greenfield
2:50 PMUsing nanoconfinment to tailor semiconducting polymers
Michael L. Drummond, Bobby G. Sumpter, Michael D. Barnes, William A. Shelton, Robert J. Harrison
3:20 PMIntermission
3:30 PMMean-field prediction of block copolymer phase behavior and structure in selective solvent
Paschalis Alexandridis
4:10 PMComputer simulation studies on mechanisms of poration for hydrolytically degradable diblock copolymer membranes
Vanessa Ortiz, Steven O. Nielsen, Michael L. Klein, Dennis E. Discher

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The 230th ACS National Meeting, in Washington, DC, Aug 28-Sept 1, 2005