666 Thermophysical Properties and Phase Behavior III

Thursday, November 17, 2016: 8:30 AM - 11:00 AM
Yosemite B (Hilton San Francisco Union Square)
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 especially encouraged. The topic and style of the presentations should be consistent with the broader audience of this session.

Sponsor:
Thermodynamics and Transport Properties

Chair:
Jeremy C. Palmer
Email: jcpalmer@uh.edu

Co-Chair:
Sergiy Markutsya
Email: smarkutsya@uky.edu


8:30 AM
(666a) Linear Independence and Optimality Concepts Revisited in Thermodynamics and Kinetics
Patricia Pichardo and Vasilios Manousiouthakis

8:48 AM
(666b) Designing an Extraterrestrial Submarine for Titan. I. Nitrogen Solubility Modeling in the Titan Hydrocarbon Seas
Jason W. Hartwig, Peter Meyerhofer, Steve Oleson, Anthony Colozza and Ralph Lorenz

9:06 AM
(666c) Testing DFT Predictions at Finite Temperatures: Anomalous Phase Behavior and Long-Range Superstructures of CoPt
Elizabeth Decolvenaere, Michael Gordon and Anton Van der Ven

9:24 AM
(666d) Demonstration of the Equivalence of Ring-Additivity and Group-Contribution Methods for Properties of Unsubstituted Polycyclic Aromatic Hydrocarbons (PAH)
Christopher Pope

9:42 AM
(666e) Experimental Measurements and Predictions of the Properties of Refrigerant Fluids Using Ab-Initio, SAFT-VR Mie and COSMO Calculations
Patrice L. Paricaud, Olivier Baudouin, Christophe Coquelet, Abdelatif Baba-Ahmed, Louis Campagnolo, Johnny Deschamps, Laurent Catoire, Jiri Janecek, Julien Glorian, Celine Houriez, Jamal El Abbadi and Gilbert Fuchs

10:00 AM
(666f) Exploring the Bulk Phase Properties and Structural Properties for CO2 and so2 Via First Principles Calculations
Himanshu Goel and Neeraj Rai

10:18 AM
(666h) First-Principles Phase Diagrams: Iron at Earth’s Inner Core Conditions with Full Inclusion of Anharmonic and Finite-Size Effects
Sabry G. Moustafa, Andrew J. Schultz, Eva Zurek and David A. Kofke
See more of this Group/Topical: Engineering Sciences and Fundamentals
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