Preliminary Program subject to change
01A20 20 Years of Gibbs Ensemble
OverviewWe invite papers appropriate for commemorating 20 years of development and progress using the method of Gibbs Ensemble simulation.
Primary SponsorThermodynamics and Transport Properties (01a)

Chair

David A. Kofke
Chemical and Biological Engineering
University of Buffalo
303 Furnas Hall
SUNY at Buffalo
Buffalo, NY 14260
Phone Number: 716-645-2911x2909
Email: kofke@eng.buffalo.edu

CoChair

J. Il Siepmann
Professor
University of Minnesota
Department of Chemistry
Minneapolis, MN 55455-0431
Phone Number: 612-624-1844
Fax Number: 612-626-7541
Email: siepmann@chem.umn.edu
Introductory Remarks: Michael Stapleton
Origins And Development Of The Gibbs Ensemble Methodology
Athanassios Z. Panagiotopoulos, Princeton University, A223 Engineering Quad., Princeton, NJ 08544
Phase Equilibria Of Patchy "Protein-Like" Models
Sanat Kumar, Chemical Engineering, Columbia University, 500 W 120St, New York, NY 10027
Simulation Of Phase Transitions In Coarse Grained Systems
Juan Jose De Pablo, Department of Chemical and Biological Engineering, University of Wisconsin, 1415 Engineering Drive, Madison, WI 53706
Beyond The Gibbs-Ensemble
Berend Smit, Centre Européen de Calcul Atomique et Moléculaire (CECAM), Ecole Normale Supérieure (ENS), Allée d'Italie 46, Lyon, France
Use Of The Gibbs Ensemble Monte Carlo Approach For The Calculation Of Gibbs Free Energies Of Transfer And Henry's Law Constants
J. Ilja Siepmann1, Jake L. Rafferty1, Kelly E. Anderson2 and Ling Zhang2, (1)University of Minnesota, Department of Chemistry, Minneapolis, MN 55455-0431, (2)Department of Chemistry, University of Minnesota, Department of Chemistry, Minneapolis, MN 55455-0431
Investigating The Phase Behavior Of Fluids In The Vicinity Of A Surface
Jeffrey R. Errington, Chemical and Biological Engineering, University at Buffalo, 509 Furnas Hall, Buffalo, NY 14260
Application Of Gibbs Ensemble Monte Carlo To The Calculation Of Adsorption Isotherms For Toxic Materials
Jeffrey J. Potoff, Ganesh Kamath and Nandhini Sokkalingam, Department of Chemical Engineering, Wayne State University, 5050 Anthony Wayne Dr, Detroit, MI 48202
Mesoscopic Canonical Ensemble
Alexander V. Neimark, Department of Chemical and Biochemical Engineering, Rutgers University, 98 Brett Road, Piscataway, NJ 08854-8058
Concluding Remarks: David Kofke

Engineering Sciences and Fundamentals