Monday, 31 October 2005: 6:00 PM-8:30 PM
Exhibit Hall A (Cincinnati Convention Center)

Thermodynamics and Transport Properties (01a)

#148 - Poster Session: Thermodynamics and Transport Properties (01A15)
tba
CoChair:Shekhar Garde
Chair:Michael L. Greenfield
Part 1 
Accurate Ab Initio Thermochemistry Via Various Reaction Schemes
David R. Urban, Ilie Fishtik, Jennifer Wilcox
Extension of the Trappe-Ua Force Field to Thiols, Sulfides and Disulfides
Jeffrey J. Potoff, Nusrat Lubna, Ganesh Kamath
Nucleation for Confined Lennard-Jones Fluid by Density Functional Theory
Dong Fu, Lili Liang
Bulk and Interfacial Properties of Simple Confined Fluids
Sang Kyu Kwak, Jayant K. Singh
Monte Carlo Simulation of Polymers within a Lattice
Erin N. Sawardecker, Marta Sales-Pardo, Luis A. N. Amaral
Thermodynamically Consistent Adaptation of Scaled Particle Theory to an Arbitrary Equation of State: Hard Sphere Fluid Properties and a New Reference System for Solvation Theories
Daniel W. Siderius, David S. Corti
The Effects of Disperse Attractions on Transport Properties Using Step Potential Equilibria and Dynamics (Spead)
Zeynep N. Gerek, Neil H. Gray, Richard Elliott
First-Order Mean Spherical Approximation and Its Application to the Critical Region
Yiping Tang, Jianguo Mi, Chongli Zhong, Yi-Gui Li
Thermodynamic Expression of Electrolyte Solution
Shuzo Ohe
Helical Structure from an Isotropic Homopolymer Model
Victor R. Vasquez, Leo Lue, James Magee, Jim Warwicker
Part 2 
Equation of State for Hard-Spheres and Hard-Chains in the Glassy Region
S. M. Waziri, Esam Z. Hamad
Thermodynamic Characterization of Milspec Hydrazine
Danielle L. Sanchez, Tim Jobe, Robert Rakoff, D.B. Wilson, Martha Mitchell
Global Parameter Optimization for Equations of State
Christopher Emborsky, David Miller, Sharon Sauer
Generalized Equation of State for the Perturbed-Chain Statistical Associating Fluid Theory
Hong Wei Xiang, Francois Montel, Alain Graciaa, Christelle Miqueu, Bruno Mendiboure
Incorporating Cross-Association in Aqueous Hydrogen Fluoride Mixtures
Barath Baburao, Donald P. Visco Jr.
Saft1-Rpm Equation of State: Application to Phase Equilibria and Thermodynamic Properties of Carbon Dioxide + Aqueous Electrolyte Solutions
Xiaoyan Ji, Sugata P. Tan, Hertanto Adidharma, Maciej Radosz
Part 3 
Triangular-Well of Variable Width: Theory and Molecular Simulation
Felix F. Betancourt-Cárdenas, Luis A. Galicia-Luna
Experimental Vapor-Liquid Equilibria for the Carbon Dioxide + Octane, and Carbon Dioxide + Decane Systems from 313 to 373 K
Rodrigo Jiménez-Gallegos, Luis A. Galicia-Luna, Octavio Elizalde-Solis
The Solubility, Compressed Liquid and Saturation Density of Phenol in Supercritical CO2
Abel Zuñiga-Moreno, Luis A. Galicia-Luna
A New Algorithm for Calculating CO2-Crude Minimum Miscibility Pressure
Adel Elsharkawy
Experimental Determination of the Liquid Phase Composition in the System CO2 / Methyldiethanolamine / H2o
Reda Sidi-Boumedine, Elise PROVOST, Walter FURST, Viep Hoang-Dinh, Jean-Louis PEYTAVY
Part 4 
Diffusion and Viscosity in Gas-Expanded Liquids
Malina E. Janakat, Christopher L. Kitchens, Jason P. Hallett, Xiuyang LU, Natalie B. Maxey, Megan Donaldson, Charles L. Liotta, Charles A. Eckert
Friction Theory and Free-Volume Theory Coupled with Statistical Associating Fluid Theory in Viscosity Modeling: Pure N-Alkanes
Sugata P. Tan, Hertanto Adidharma, Brian F. Towler, Maciej Radosz
An Eos-Based Viscosity Model for Polymer-Solvent Mixtures
Edmundo Etchechury-Alvarez, Ricardo Macias-Salinas
Thermodynamics of Water Interaction in Stratum Corneum by Using Isothermal Calorimetry
Santosh Yadav, Gerald B. Kasting, Neville G. Pinto
Modelling of Nanocapsules Formation: Phase Separation during Mass Transfer Processes
Hassou Maria, Yann le Gorrec, Christian Jallut, Françoise Couenne, Melaz Tayakout
Measurement and Modeling of Glass Transition Temperature of Cryoprotected Protein Crystallization Solutions
Binal N. Shah, Unmesh N. Chinte, Constance A. Schall
Response Surface Model on the Determination of Partial Molar Volume, Partial Molar Refraction, Electronic Polarizability and Molecular Radii from Dilute Multi-Component Data Alone
Marc Garland, Martin Tjahjono
ß-D Galactose Pentaacetate - Supercritical Carbon Dioxide as a Novel Binder-Binder Removal Agent for Metal Casting Operations: Phase Behavior of the Binary System
Cerag Dilek, Charles W. Manke, Esin Gulari
Part 5 
Gas Hydrate Equilibria in Porous Media with Pore Size Distributions
Sangyong Lee, Jae W. Lee
Mass Transfer of a Methane Hydrate under Controlled Conditions of Water
Keiichi Ogasawara, Akihiro Yamasaki, Fumio Kiyono
A Comparison of Variable Reference Potential Models for Gas Hydrates
Gerald D. Holder, Yi Zhang, Robert P. Warzinski
Prediction of the Dissociation Condition of a Simple Hydrate Phase on an H-Lw-V Line in Isochoric Operation
Fumio Kiyono, Hideo Tajima, Keiichi Ogasawara, Akihiro Yamasaki
First Principles on Optical and Electronic Properties Si Nanowires
Trinh Vo, Andrew Williamson, Giulia Galli
On the Thermodynamics of Chain Fluids from Simulation and the Heteronuclear Statistical Associating Fluid Theory
Yun Peng, Honggang Zhao, Clare McCabe
Sponsor:Engineering Sciences and Fundamentals

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