2017 Annual Meeting

Session: Fundamental, Theory, and Model Development - In Honor of Keith Gubbins' 80th Birthday II (Invited Talks)

This session of invited speakers will honor achievements by Keith Gubbins in the area of Computational Molecular Science. Invited contributions only.

Chair

Erik Santiso, NC State University

Co-Chair

Liangliang Huang, University of Oklahoma

Presentations

12:30 PM

(147a) Metastable Phase Transitions
Pablo Debenedetti

12:55 PM

(147b) Computational Investigation of Multipolar Colloidal Particle
David M. Rutkowski, Ryan C. Maloney, Orlin Velev, Sabine H.L. Klapp, Carol Hall

01:20 PM

(147c) Interfacial Tensions from SAFT: Connecting Equations of State to Molecular Simulations
Erich A. Müller

01:45 PM

(147d) Generalized Gibbs Free Energy of Confined Nanoparticles
Xiaohua Lu

02:10 PM

(147e) Molecular Modeling of Polymeric Systems
Coray Colina

02:35 PM

(147f) Effect and Regulation of Surface Wettability on Molecular Transport and Reaction
Shuangliang Zhao, Honglai Liu