2019 AIChE Annual Meeting

Session: Modeling of Interfacial Systems

The focus of this session will be on modeling and/or simulation studies of interfacial systems. Studies with an experimental component are welcome. All interfacial systems are of interest.

Chair

Manuela Ayee-Leong, Dordt University

Co-Chair

David Cantu, University of Nevada-Reno

Presentations

12:30 PM

(698b) Modeling of Interfacial Properties and Interfacial Mass Transfer in Liquid-Liquid Extraction Systems
Roland Nagl, Patrick Zimmermann, Tim Zeiner

12:45 PM

(698c) Mechanism of Adsorption of Non-Ionic Surfactants on Calcite
Soumik Das, Fardin Khabaz, Quoc P. Nguyen, Roger Bonnecaze

01:00 PM

(698d) Prediction of Surface Tensions and Adsorption Isotherms of Alkane Isomers
Patrick Zimmermann

01:15 PM

(698e) Molecular Simulation on the Antifouling Mechanism of Zwitterionic Materials
Yiqi Chen, Andrew Schultz, Jeffrey Errington

01:30 PM

(698f) First-Principles Design of Nerve Agent Sensing Systems Using Chemoresponsive Liquid Crystals
Jake Gold, Tibor Szilvási, Nicholas L. Abbott, Manos Mavrikakis

01:45 PM

(698g) Examination of the Relationships between Terminal Group Chemistry and Tribological Properties in Monolayer Films through Molecular Dynamics Screening
Andrew Z. Summers, Justin Gilmer, Christopher R. Iacovella, Peter Cummings, Clare McCabe

02:00 PM

(698h) Simulations of the Diffusive Behavior of DNA Adsorbed on Charged Lipid Bilayers
Chih-Chen Hsieh, I-an Chiang, Chang Ming-Yi

02:15 PM

(698i) Predicting Contact Angle in Oil/Brine/Calcite Systems Using Molecular Simulations
Arjun Valiya Parambathu, Mohamed S. AlHosani, Fernando Yrazu, Dilip Asthagiri, Walter Chapman

02:30 PM

(698j) Heat Transfer across Tip-Surface Nanointerface: A Quantitative Model By Scanning Thermal Microscopy (SThM)
Yifan Li, Nitin Mehra, Jiahua Zhu

02:45 PM

(698k) Controlling Protein Crystallization through Wetting Near a Critical Point
Jens Glaser, Sharon C. Glotzer