2009 Annual Meeting

Session: Poster Session: Thermodynamics and Transport Properties

Chair

David S. Corti, Purdue University

Presentations

06:00 PM

(180u) Position Group Contribution Method for the Prediction of Vaporization Heat of Organic Compounds
Qiang Wang, Qingzhu Jia, Shaokao Xie, Jingwen Chai, Peisheng Ma
(180af) Molecular Dynamics of Pseudomonas Cepacia Lipase in Different Buffers and Correlations with Its Biocatalytic Activity
Samrish Variyath, JungSeung Kim, Vadim Guliants
(180ao) Nitriding of Metal Powder
Stephanie Egger
(180am) Solubility of CO2 in Aqueous Solutions of Several Classes of Amines
Ramy Abou Naccoul, Jacques Jose, Ilham Mokbel, Ahmed Hajjaji, Nadia Baskali, Ahmed Nouacer, Farid Belaribi
(180ag) Dynamic Modeling of the Modifed Claus Process
Richard Turton, Debangsu Bhattacharyya
(180v) Prediction of Vapor-Liquid and Liquid-Liquid Equilibria of Mixtures From Peng-Robinson+COSMOSAC Equation of State
Chieh-Ming Hsieh
(180l) Modeling the Phase Behavior, Excess Enthalpies and Henry's Constants of the H2O + H2S Binary Mixture Using the SAFT-VR+D Approach
M. Carolina Dos Ramos, Clare McCabe
(180r) Consideration of the Entropy in the Prediction of Stable Crystalline Polymorphs
Tai Boon Tan, Nancy Cribbin, Andrew Schultz, David Kofke
(180aa) Prediction of Vapour-Liquid Equilibria and Second-Derivative Properties with the SAFT-Gamma Group Contribution Approach
Thomas Lafitte, Claire S. Adjiman, Amparo Galindo, George Jackson
(180a) Prediction of Physical Properties of An Emerging Class of Compounds
(180w) Phase Behavior of the System Hyperbranched Polyglycerol – Methanol – CO2
Christian S. Schacht, Theo W. de Loos
(180ah) The Use of a Parallel Fermentation System for Optimization of Saccharomyces Cerevisiae Ethanol Production in Batch Culture
Aubrey Tiernan
(180x) Molecular Modeling of High-Energy Materials
Nandhini Sokkalingam, Jeffery J. Potoff
(180c) Improved Implementation of Kirkwood-Buff Solution Theory in Periodic Molecular Simulations
Dean R. Wheeler, Joseph W. Nichols, Stan G. Moore
(180ap) Development of Advanced Coal Gasification Kinetics Models for CFD (and process simulation) Codes
Richard Turton, Chris Guenther, Kiran Chaudhari
(180ai) Toxic/Flammable Gas Detectors Allocation: Multi-Grid Treatment
Giordhanne Bruno Carpaneda Gimenes, Antônio Tavernard Pereira Neto, Igor Ribeiro de Souza, Caio Veiga Penna Delgaudio, Valter Cesar de Souza, Flavio Waltz
(180y) Screening Ionic Liquids for Process Applications Utilizing COSMO Calculations
Donna L. Gaya, Kevin N. West, James H. Davis
(180aj) Experimental Densities for the [BMIM][Cl] + Water + 1-Propanol Mixture at 298 K and 0.08 Mpa
Luis E. Camacho-Camacho
(180ak) A Network-Based Study On the Progression of Astrocytoma in Human Beings
Chunjing Wang, James A. Eddy, Nathan D. Price
(180s) Modelling the Liquid Phase Behaviour of Aqueous Non-Ionic Amphiphilic Mixtures in the Presence of Oil and Salt Modelled with SAFT-VRE
Jens M. A. Schreckenberg, Claire S. Adjiman, George Jackson, Amparo Galindo
(180t) Modelling Real Fluids and Their Mixtures with An Improved SAFT-VR Equation of State for Segments Interacting through Mie Potentials (SAFT-VR Mie)
Thomas Lafitte, Anastasia Apostolakou, Amparo Galindo, Claire S. Adjiman, George Jackson
(180b) Molecular Dynamics Study On the Melting Point of Ionic Liquid [Emim]Br
Haijun Feng, Jian Zhou
(180al) Rapid Acid/Base Reactions That Produce Energetic Explosive Intermediates
Clint, J. Brown, Paul, M. Frisby, James, E. Smith
(180z) Electrical Conductivity of Carbon Filled Liquid Crystal Polymer Composites for Fuel Cell Bipolar Plate Applications
Julia A. King, Rodwick L. Barton Carter
(180ab) Prediction of Saturated Vapor Pressure with Simple Structure Property- Property Relationships
Mordechai Shacham, Neima Brauner
(180m) Low Vapor Pressure (down to 10-6 Pa) Determination of 12 Anthropogenic Polycondensed Hydrocarbons Using Dynamic Saturation Apparatus with Online Detection
Ramy Abou Naccoul, Ilham Mokbel, Antonio Carlo Razzouk, Jacques Jose, Joseph Saab, Naim Ouaini, Evelyne Rauzy
(180ac) Direct Calculation of PC-SAFT Parameters From Experimental LVE Data and From a GC-Plus Approach
Romain Privat, Jean-Noel Jaubert Jaubert
(180n) Phase Behavior of Arbutin in a Mixture of Ethanol and Supercritical Carbon Dioxide
Dong-Yuk Kang, Chang-Nam Han, Dong Lyun Cho, Jae-Soon Shin, Choon-Hyoung Kang
(180ad) Isobaric Vapor-Liquid Equilibrium of 1-Propanol and Benzene System
Dong-Yuk Kang, Hoi-Gu Jang, Chang-Nam Han, Dong Lyun Cho, Choon-Hyoung Kang
(180d) Reaction Pathway Analysis for Electrolysis of Alcohols and Sugars in Sub-Critical Water
Mitsuru Sasaki, Takanari Oshikawa, Hiromichi Koga, Asli Yuksel, Wahyudiono Wahyudiono, Motonobu Goto
(180ae) Thermal Cracking and Effects of Oxygen On Oxidation of Tricyclodecane
Sung Hyun Kim, Joong Yeon Kim, Sun Hee Park, Byung-Hee Chun, Jeong Sik Han, Byung Hun Jeong
(180e) Interactions Between Lipid Bilayers and Carbon-Based Nanoparticles
Young-Min Ban
(180f) Equations for the Thermophysical Properties of Dimethyl Carbonate
Yong Zhou, Jiangtao Wu
(180i) Determination of Pitzer Parameters for Pb(II) and Fe(II) Solubilities in Concentrated Brines in the Presence of Environmental Ligands
Ahmed E. Ismail, Laurence H. Brush, Je-Hun Jang, Shelly R. Johnsen, Martin B. Nemer, Yongliang Xiong
(180g) Analysis of Thermodynamic Properties of Coarse Grained Surfactant Models
Samantha A. Sanders, Athanassios Z. Panagiotopoulos
(180o) Transformation of Calcium Sulphate Dihydrate to Anhydrous Calcium Sulphate in Aqueous Solutions
Ghazal Azimi, Vladimiros G. Papangelakis
(180h) Computer-Aided Molecular Design of Ionic Liquids for the Pretreatment of Biomass Using the Signature Molecular Descriptor
Derick C. Weis
(180p) Measurement of Bubble Points of CO2 in Ionic Liquids, [BMP][Tfo]and [P14,6,6,6][Tf2N] Using Variable-Volume View Cell
Jong Sung Lim, Ha Na Song, Jun Hyuk Yim, Byung-Chul Lee
(180q) Vapor-Liquid Equilibrium Measurement for the Binary System of Carbon Dioxide (CO2) + 1,1,1-Trifluoroethane (R-143a) at High Pressures
Jong Sung Lim, Ah Ram Kim, Seol A. Kim, Ki-Pung Yoo
(180an) Removal of Sulfur Compounds From Solvent Extracts of Low Rank Coal
Kwang B. Yi, Chang Hyun Ko
(180j) Viscosity of Binary Mixtures of Soybean + Canola, + Coconut, and + Corn Biodiesel at Different Temperatures
Filipe Xavier Feitosa, Tamires Barreto Cidade, Monica C. G. Albuquerque, Hosiberto Batista De Sant Ana, Carolina B. Veloso