37 Modeling of Interfacial Systems

Sunday, November 13, 2016: 3:30 PM - 6:00 PM
Union Square 25 (Hilton San Francisco Union Square)
Description:
The focus of this session will be on simulation studies of interfacial systems

Sponsor:
Interfacial Phenomena
Co-Sponsor(s):
Thermodynamics and Transport Properties (01A)

Chair:
Ateeque Malani
Email: amalani@iitb.ac.in

Co-Chair:
Stephanie Lam
Email: stephanie.x.lam@gsk.com


3:30 PM
(37j) Density Gradient Theory for Modeling Interfacial Properties of Surfactant Systems
Xiaoqun Mu, Walter G. Chapman and Faruk O. Alpak

3:45 PM
(37b) A Simple-to-Apply Predictive Wetting Model for Textured (Rough/Patterned) Surfaces and the Role of Re-Entrant Cavities
Szu-Ying Chen, Yair Kaufman, Himanshu Mishra, Alex Schrader, Dong-woog Lee, Saurabh Das, Stephen H. Donaldson Jr. and Jacob N. Israelachvili

4:00 PM
(37c) Obtaining Solid-Liquid Interfacial Free Energy for Realistic Systems 
Xin Qi and Kristen Fichthorn

4:15 PM
(37d) Protein Interfacial Behavior Studied with Multiscale Simulations
Mohammadreza Samieegohar and Tao Wei

4:30 PM
(37e) Modeling Surface-Anchored Nematic Liquid Crystals for Chemoresponsive Application
Tibor Szilvási, Luke T. Roling, Huaizhe Yu, Prabin Rai, Robert Twieg, Nicholas L. Abbott and Manos Mavrikakis

4:45 PM
(37f) Molecular Dynamics Simulations of HIV-1 Regulatory Protein on Graphene
Jian Zhou

5:00 PM
(37g) A Thermodynamic Approach to Interfacial Transport Phenomen
David Venerus and Hans Christian Öttinger

5:15 PM
(37h) Adhesion and Translocation of Nanoparticles through Lipid Bilayers Studied By Mesoscale Simulations
Sean Burgess, Zhengjia Wang, Aleksey Vishnyakov and Alexander V. Neimark

5:30 PM
(37i) Calculating the Interfacial Properties of CO2/Water/Silica Systems Using Monte Carlo Molecular Simulations
Adam R. Rall and Jeffrey R. Errington
See more of this Group/Topical: Engineering Sciences and Fundamentals
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