2017 Annual Meeting

Session: Molecular Simulation of Surface, Interface and Confinement Effects - In Honor of Keith Gubbins' 80th Birthday I (Invited Talks)

Molecular Simulation of Surface, Interface and Confinement Effects - In Honor of Keith Gubbins' 80th Birthday I

Chair

Huang, L., University of Oklahoma

Co-Chairs

Santiso, E., NC State University

Hung, F., Northeastern University

Presentations

08:00 AM

(84a) Atomistic Simulations of Ordered and Disordered Carbons: "Mimicking" Versus "Targeting"

08:19 AM

(84b) Graphene Oxide Membranes: A Molecular Simulation Approach

08:38 AM

(84c) Polyethylene Oxide (PEO) in a Polyethylene (PE) Framework: A Simple Model for Simulation Studies of Scaling and Solvent Effects on Polymers in an Open Framework

08:57 AM

(84d) Molecular Understanding and Design of Zwitterionic Materials

09:16 AM

(84e) Interfacial Transport of Protons on a 2-Dimensional Functionalized Graphane Surface

09:35 AM

(84f) Gas Adsorption Behavior in Ionic Polyimide Composite Membranes

09:54 AM

(84g) Computational Simulation of Supported Nanocatalysts Under Realistic Conditions