367 Thermophysical Properties and Phase Behavior


Description:
Experimental and theoretical contributions to the general field of thermodynamic properties and phase behavior are encouraged, including those that introduce novel experimental or modeling techniques. Papers on non-equilibrium thermodynamics are also encouraged. The topic and style of the presentations should be consistent with the broader audience of this session.

Sponsor:
Thermodynamics and Transport Properties


Chair:
Sanket Deshmukh
Assistant Professor
Virginia Polytechnic Institute and State University
Department of Chemical Engineering
UCD Engineering and Materials Science Centre
Blacksburg, VA
Email: sanketad@vt.edu

Co-chairs:
Clare McCabe
Professor
Vanderbilt University
Chemical and Biomolecular Engineering
PMB 351604
Nashville, TN
37235-1604
Email: c.mccabe@vanderbilt.edu

Erik E. Santiso
Assistant Professor
North Carolina State University
Department of Chemical & Biomolecular Engineering
Department of Chemical Engineering,
Raleigh, NC
02139
Email: eesantis@ncsu.edu

Hiroyuki Matsuda
Associate Professor
Nihon University
Department of Materials and Applied Chemistry
1-8 Surugadai, Kanda, Chiyoda-ku
Tokyo
Phone Number: +81-3-3259-0814
Fax Number: +81-3-3293-7572
Email: matsuda.hiroyuki@nihon-u.ac.jp


Papers:
367a
Area 1a Plenary Lecture (placeholder)
Erik E. Santiso, North Carolina State University
367b
Higher-Order Hydrophobic Effects: Capturing the Distinct Heat Capacity and Compressibility Signatures of Non-Polar Gas Hydration with Molecular Simulations
Henry S. Ashbaugh, Tulane University
367c
Electrostatic and Induction Effects in Solubility of Water in Alkane
Dilip Asthagiri, Rice University; Arjun Valiya Parambathu, Rice University; Walter G. Chapman, Rice University
367d
Effect of Fluorination on Interfacial Properties and Partitioning of Alcohols
Mohammad Barhaghi, Wayne State University; Chloe Luyet, Wayne State University; Jeffrey J. Potoff, Wayne State University
367e
Application of Kirkwood-Buff Integral Data in Development of a Charmm-Type Carbohydrate Force Field to Model Activity Behavior
Theresa Cloutier, Massachusetts Institute of Technology; Chaitanya Sudrik, Massachusetts Institute of Technology; Hasige Sathish, MedImmune; Bernhardt L. Trout, Massachusetts Institute of Technology
367f
Transitioning from Empirical to Ab Initio Potentials for the Prediction of Thermodynamic Properties and Phase Equilibria
Richard J. Sadus, Swinburne University of Technology
367g
Constrained Subset Selection for the Regression of Multi-Component Helmholtz Energy Equations
Marissa Engle, Carnegie Mellon University; Nick Sahinidis, Carnegie Mellon University
Abstract Submissions Closed
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