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

Ayee-Leong, M., Dordt University

Co-Chair

Cantu, D., University of Nevada-Reno

Presentations

12:30 PM

(698b) Modeling of Interfacial Properties and Interfacial Mass Transfer in Liquid-Liquid Extraction Systems
Nagl, R., Zimmermann, P., Zeiner, T.

12:45 PM

(698c) Mechanism of Adsorption of Non-Ionic Surfactants on Calcite
Das, S., Khabaz, F., Nguyen, Q. P., Bonnecaze, R.

01:00 PM

(698d) Prediction of Surface Tensions and Adsorption Isotherms of Alkane Isomers
Zimmermann, P.

01:15 PM

(698e) Molecular Simulation on the Antifouling Mechanism of Zwitterionic Materials
Chen, Y., Schultz, A., Errington, J.

01:30 PM

(698f) First-Principles Design of Nerve Agent Sensing Systems Using Chemoresponsive Liquid Crystals
Gold, J., Szilvási, T., Abbott, N. L., Mavrikakis, M.

01:45 PM

(698g) Examination of the Relationships between Terminal Group Chemistry and Tribological Properties in Monolayer Films through Molecular Dynamics Screening
Summers, A. Z., Gilmer, J., Iacovella, C. R., Cummings, P., McCabe, C.

02:00 PM

(698h) Simulations of the Diffusive Behavior of DNA Adsorbed on Charged Lipid Bilayers
Hsieh, C. C., Chiang, I. A., Ming-Yi, C.

02:15 PM

(698i) Predicting Contact Angle in Oil/Brine/Calcite Systems Using Molecular Simulations
Valiya Parambathu, A., AlHosani, M. S., Yrazu, F., Asthagiri, D., Chapman, W.

02:30 PM

(698j) Heat Transfer across Tip-Surface Nanointerface: A Quantitative Model By Scanning Thermal Microscopy (SThM)
Li, Y., Mehra, N., Zhu, J.

02:45 PM

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