Session: Thermophysical Properties and Phase Behavior III (2012 Annual Meeting)

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. The topic and style of the presentations should be consistent with the broader audience of this session.

Sponsor:

Thermodynamics and Transport Properties

Co-chairs:

Rajesh Khare
Associate Professor
Texas Tech University
Department of Chemical Engineering
6th Street and Canton
Lubbock, TX 79409-3121
Phone Number: 806-742-0449
Fax Number: 806-742-3552
Email: rajesh.khare@ttu.edu

Arthi Jayaraman
Assistant Professor
University of Colorado at Boulder
Chemical and Biological Engineering
424 UCB
Boulder, CO 80309
Email: arthi.jayaraman@colorado.edu

Papers:

456a

Role of Bond Flexibility On the Diffusion and Shear Viscosity of Water
Gabriele Raabe, Technische Universität Braunschweig; Richard J. Sadus, Swinburne University of Technology

456b

Cold Water As a Novel Supercritical-Fluid Solvent: A Two-State Model
Daphne A. Fuentevilla, University of Maryland; Vincent Holten, University of Maryland; Mikhail A. Anisimov, University of Maryland

456c

Thermophysical and Structural Properties of Electrolyte Solutions Confined in a Carbon Nanotube
Daniel W. Siderius, National Institute of Standards and Technology; Jeffrey A. Fagan, National Institute of Standards and Technology; Vincent K. Shen, National Institute of Standards and Technology

456d

Bridge Functionals Representing Higher-Order Terms in the Perturbative Classical Density Functional Theory of Solid-Fluid Transitions
Anurag Verma, University of Massachusetts, Amherst.; David Ford, University of Massachusetts Amherst

456e

Liquid-Vapor Coexistence Properties of Complex Molecules Using Grand-Canonical and Isothermal-Isobaric Temperature Expanded Ensemble Simulations
Kaustubh S. Rane, University at Buffalo, The State University of New York; Sabharish Murali, University at Buffalo, The State University of New York; Jeffrey R. Errington, University at Buffalo, The State University of New York

456f

Molecular Modeling of Vapor-Deposited Ultra-Stable Glasses
Sadanand Singh, University of Wisconsin - Madison; Devin B. Averett, University of Wisconsin - Madison; Juan De Pablo, University of Wisconsin-Madison

456g

Topological Thermodynamic Tools for a Consistent Representation of the Acetic Acid-Isoamyl Alcohol-Isoamyl Acetate-Water Reactive System
Wilmar Osorio Viana, Universidad Nacional de Colombia Sede Manizales; Miguel Duque Bernal, Universidad Nacional de Colombia Sede Manizales; Jesús David Quintero Arias, Universidad Nacional de Colombia Sede Manizales; Izabela Dobrosz Gómez, Universidad Nacional de Colombia Sede Manizales; Javier Fontalvo, Universidad Nacional de Colombia Sede Manizales; Miguel Angel Gómez-García, Universidad Nacional de Colombia Sede Manizales

456h

Molecular Dynamics Study of the Phase Behaviour of H2O-CO2-NaCl and H2O+NaCl Systems
Thomas Lafitte, Princeton University; Yang Liu, Princeton University; Pablo G. Debenedetti, Princeton University; Athanassios Z. Panagiotopoulos, Princeton University

See more of this Group/Topical: Engineering Sciences and Fundamentals

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