2012 AIChE Annual Meeting

Session: In Honor of Keith Gubbins' 75th Birthday III: Fundamentals & Model Development

Chair

Karl Johnson, University of Pittsburgh

Co-Chair

Francisco R. Hung, Louisiana State University

Presentations

03:15 PM

Introductory Remarks

03:25 PM

(145a) New Directions for Entropic Forces in Hard Particle Fluids

03:45 PM

(145b) A Pseudo-Quantum Description of Classical Vacancy Diffusion in Crystals
Giovanni Ciccotti, Simone Meloni, Pierre-Antoine Geslin

04:05 PM

(145c) 2-Component Van Der Waals EoS and the Second Osmotic Virial Coefficient
Benjamin Widom

04:25 PM

(145d) Extending the Capabilities of Molecular-Based Equations of State: Simultaneous Calculations of Phase Equilibria and Transport Properties
Felix Llovell, Rosa Marcos, Lourdes F. Vega

04:45 PM

(145e) Property Prediction with Analogous Series: A Continuum View of Discrete Molecular Entities
Brian K. Peterson

05:05 PM

(145f) SAFT-γ Coarse Grained Models for the Molecular Simulation of Complex Fluids with a Top-Down Methodology
Carlos Avendano, Thomas Lafitte, Vassilis Papaionannou

05:25 PM

(145g) Novel Nanoporous Materials: In Silico Design