2021 Annual Meeting

Session: Thermophysical Properties: Theory and Experiments for Charged Systems

Chair

Erik Santiso, NC State University

Co-Chairs

Clare McCabe, Vanderbilt University
Sanket Deshmukh, Virginia Polytechnic Institute and State University
Hiroyuki Matsuda, Nihon University

Presentations

08:00 AM

(451a) Individual and Mean Ionic Activity Coefficients: Insight from Molecular Dynamics Simulations
Athanassios Panagiotopoulos, Sina Hassanjani Saravi

08:16 AM

(451b) Designing Molten Salt Eutectics: A Combined Thermodynamic Modeling and Machine Learning Approach
Shreyas Honrao, Ashwin Ravichandran, Eric Fonseca, John W. Lawson

08:32 AM

(451c) Tuning Deep Eutectic Solvent Properties with Phenolic-Derivative Hydrogen Bond Donors
Derrick Poe, Yong Zhang, Xiaoyu Wang, William Dean, Jeffrey Klein, Burcu Gurkan, Edward Maginn

09:04 AM

(451e) Multi-Scale Modeling of Amine-Based Water-Free Solvents for CO2 Capture
Ismail Alkhatib, Daniel Bahamon, Omar Khalifa, Lourdes Vega

09:20 AM

(451f) A Theory of Localized Excitations in Supercooled Liquids
Muhammad Hasyim, Kranthi K. Mandadapu

09:36 AM

(451g) Vapor-Liquid Equilibria of Binary and Ternary Mixtures Containing Ethyl Lactate As Entrainer for the Separation of Binary Azeotropic Mixture Ethyl Acetate + Ethanol
Hiroyuki Matsuda, Takaki Onoo, Jun Koyama, Hibiki Tanaka, Kiyofumi Kurihara, Katsumi Tochigi

09:52 AM

(451h) Predicting the Temperature Dependence of Sucrose and ?-Glycine Aqueous Solubility from Thermodynamic Data Measured at a Single Temperature
Andrew Manson, Leo Lue, Jan Sefcik, Andrew Coll

10:08 AM

(451i) Vapor-Liquid-Liquid Phase Transition of a Chiral Tetramer Model
Yiming Wang, Frank H. Stillinger, Pablo Debenedetti