2016 AIChE Annual Meeting

Session: Poster Session: Thermodynamics and Transport Properties (Area 1A)

Area 1a Poster Session. Contributions in all areas of thermodynamics and transport properties are welcome. Posters can include equations of state, simulations, experiments, and/or theories. Many posters will likely discuss thermodynamics and phase behavior, since slots in those sessions are limited compared to the high demand. Selected papers will be invited to give a short presentation in a separate session.

Chair

Andrew Paluch, Miami University

Co-Chair

Neeraj Rai, Mississippi State University

Presentations

06:00 PM

(262ad) Real-Component Based Molecular Characterization of Petroleum Fluids
Meng Wang, Chau-Chyun Chen
(262az) A SAFT-Based Equation of State for Electrolyte Solutions; Focused on Second Order Thermodynamic Properties
Mohammad Reza Dehghani, Reza Shahriari
(262w) Eulerian Volume-Averaged Model and Numerical Simulations of Reactive Solid-Liquid Mixtures
Costa Reis Martina, Wang Yongqi, Heß Julian
(262u) Volumetric and Viscometric Properties of a Binary Mixture of a Model Diesel Compound with a Biobased Additive
Jesus Esteban, Tom Simons, Halina Murasiewicz, Serafim Bakalis, Peter J. Fryer
(262ba) Consideration of Ionic Liquid Dissociation in Thermodynamic Modeling of Ionic Liquids and Mixtures
Nazir Hossain, Chau-Chyun Chen
(262z) Accurate and Efficient Thermodynamic Properties from Molecular Simulation By Combining Lammps and Gomc
J Richard Elliott, S. Mostafa Razavi, Marcel Balçik, M. Göktug Ahunbay
(262ay) Physico-Chemical Characterization of Fluorinated Ionic Liquids for Their Use As Blood Substitutes
Fèlix Llovell, Lourdes F. Vega, Manuel Piñeiro, Luís P. N. Rebelo, Ana B. Pereiro, João M. M. Araújo, Margarida Ferreira
(262au) Influence of Ionic Activity on the Osmotic Energy Generation in a Nanotube
Li-Hsien Yeh, Chun-Chieh Yu, Chia-Hsi Lo
(262b) Spray Cooling of Hot Steel Plate Using Water Based TiO2 Nanofluid
Samarshi Chakraborty, Surjya K. Pal, Sudipto Chakraborty
(262ap) Empirical Fundamental Equations of State Correlations Based on Hybrid Datasets
Jadran Vrabec, Monika Thol, Andreas Köster, Gabor Rutkai, Rolf Lustig, Roland Span
(262bb) Thermodynamic Modeling of Polyelectrolyte Solutions with Electrolyte Nrtl Model
Chau-Chyun Chen, Yue Yu, Yuan Li
(262bf) Effect of Liquid Hydrocarbons (C6, C8, and C10) in Experimental Dissociation Points of Hydrates Formed By H2o + CO2
Birzavit J. Escamilla-Martín, Pedro Esquivel-Mora, Luis E Juárez-Vergara, Luis A. Galicia-Luna, Jose J. Castro-Arellano, Alfredo Pimentel-Rodas
(262aa) Effect of Branching on Phase Behavior of Chain Molecules from a New SAFT Based Model
Yuchong Zhang, Walter G. Chapman
(262bg) Comparative Study Between Dissociation Conditions of H2o + N2+ Undecane and H2o + CO2+ Undecane Mixtures in Hydrate Formation
Raúl A. Santos-Serena, Luis E Juárez-Vergara, Pedro Esquivel-Mora, Birzavit J. Escamilla-Martín, Luis A. Galicia-Luna
(262at) A Comprehensive Molecular Thermodynamic Model for Major Electrolytes in High Salinity Produced Water
Sheik Tanveer, Chau-Chyun Chen
(262ac) Solubility of Squalene and Squalene + Palmitic Acid in Supercritical Carbon Dioxide
Teresa Rosales-García, Gloria Dávila-Ortiz, Alfredo Pimentel-Rodas, Luis A. Galicia-Luna, Darío I. Téllez-Medina
(262ae) Predicting Mosced Parameters for Nonelectrolyte Solids Using Electronic Structure Calculations
Andrew Paluch, Jeremy Phifer
(262ab) Remote Read-out System for Thermal Barcode Based on Phase Change Materials
Sichao Hou, Ming Su
(262v) Modeling Phase Equilibria Using Numerical Algebraic Geometry
Hythem Sidky, Jonathan Whitmer, Alan Liddell, Jonathan Hauenstein, Dhagash Mehta
(262ag) Volumetric, Acoustic and Viscometric Properties of Binary Mixtures of (n-Butylammonium based ionic liquid + Ethanol) at Different Temperatures
Ricardo B. Torres, Samara S. Bittencourt, Heloisa E. Hoga, José V. H. D'Angelo
(262av) Apparent Molar Volumes of Saccharides in Aqueous Sodium Chloride Mixtures at Different Temperatures
Ricardo B. Torres, Barbara M. Ortega, Ronaldo G. Santos
(262ah) Modeling Sorption and Phase Equilibria Using CP2K Software Suite
Neeraj Rai, Himanshu Goel, Charles Butler, Zachary Windom, Amber Jackson
(262e) Aluminum Nitride Hydrolysis Enabled By Hydroxyl-Mediated Surface Proton Hopping
Christopher J. Bartel, Christopher L. Muhich, Alan Weimer, Charles B. Musgrave
(262ai) Molecular Modeling of Nonionic Block Copolymer Micelles
Shun Xi, Walter Chapman
(262al) SAFT-Q: A Transferable Parameter Quartic Equation of State Version of the Statistical Associating Fluid Theory for Pure Fluids and Mixtures
Arthur S. Gow, Jonathan Smolen, Matthew Seaman
Inorganic systems
Phase-equilibria
Ionic solutions and liquids
Interfaces
Hydrates
(262bc) Solubility of Gases in Conventional Solvents and an Ionic Liquid for Synthesis Gas and Natural Gas Sweetening from Monte Carlo Simulations
Seyed Hossein Jamali, Mahinder Ramdin, Thijs J. H. Vlugt
(262aw) Ionic Current Rectification in a Polyelectrolyte-Modified Conical Nanopore
Shiojenn Tseng, Chih-Yuan Lin, Hou-Hsueh Wu, Jyh-Ping Hsu
(262ax) Diffusiophoresis of a pH-Regulated Toroidal Polyelectrolyte in a Solution Containing Multiple Ionic Species
Jyh-Ping Hsu, Shang-Hung Hsieh, Shiojenn Tseng
(262i) Experimental and Computational Studies on the Reactivity and Binding Mode of Thiophene on Ni/La-Doped  (6,0)ZnO Nanotube
Peng Wang, Huiping Tian, Yan Sun, Shiping Huang
(262aq) Improving the Backbone of Activity Models
Gerard.J.P. Krooshof, Remco Tuinier, Gijsbertus de With
(262j) Computational Thermodynamic Analysis of a Solar Thermochemical Manganese Oxide - Manganese Sulfate Water Splitting Cycle
Rahul Bhosale, Parag N. Sutar, Fares Almomani, Dareen Dardor, Marc Rosen
(262k) Equation of State Selection for Organic Rankine Cycle Modeling Under Uncertainty
Jerome Frutiger, John O'Connell, Jens Abildskov, Gurkan Sin
(262ar) Phase Equilibria Prediction for Systems Containing Lipids
Olivia Ana Perederic, Larissa P. Cunico, Bent Sarup, John Woodley, Rafiqul Gani
(262n) From the PPR78 to the E-PPR78 and PR2SRK Models: 10 Years with the Development of Predictive Cubic EoS
Romain Privat, Jean-Noël Jaubert
(262as) Viscosity and Density of (CO2 + Synthetic Crude Oil) Mixtures at Temperatures from (298 to 423) K and at Pressures up to 100 Mpa
Claudio Calabrese, Geoffrey Maitland, Martin Trusler
(262ao) Experimental Phase Equilibria of Water-Hydrocarbon Systems
Xiangwei Liu
(262am) Prediction of Liquid Kinematic Viscosities Using the Eos + GE Mixing Rule with Eyring-Activity Coefficient Models
Katsumi Tochigi, Hiroyuki Matsuda, Kiyofumi Kurihara, Toshitaka Funazukuri, V.K. Rattan
(262a) A Fundamental Understanding of Cation Transport in Mixed Metal Ferrite Spinels
Victoria J. Aston, Christopher L. Muhich, Ryan Trottier, Alan Weimer, Charles B. Musgrave
(262l) Designing an Extraterrestrial Submarine for Titan. II. Experimental Pressure-Density-Temperature-Composition Measurements of Nitrogen in Liquid Methane-Ethane Mixtures
Ian Richardson, Jacob Leachman, Jason Hartwig
(262o) Designing an Extraterrestrial Submarine for Titan. III. Estimating Titan Sea Mixture Properties
Jason Hartwig, Peter Meyerhofer, Ian Richardson, Steve Oleson, Anthony Colozza, Ralph Lorenz
(262bd) Study on the Transient Interfacial Tension in a Microfluidic Droplet Formation Coupling Interphase Mass Transfer Process
Wenjie Lan, Shaowei Li, Che Wang, Xuqiang Guo, Guangsheng Luo
(262m) Prediction of Flash Points: A Review and Practice on Ethanol-Blends
Bernard Liat Wen Loo, Kok Hwa Lim, Guo Zhen, Reginald Thio
(262p) Synthesis and Solubility Measurement of Menadione Derivatives, 2-Chloro-3-((4-chlorobenzyl)Aminonaphtalene-1,4-Dione and 2-Chloro-3-((4-chlorophenethyl)Amino)Naphtalene-1,4-Dione in Supercritical Carbon Dioxide
(262r) Understanding Branching Effect on Phase Behavior of Alkanes Using a Dimer Version of SAFT-Lj
(262q) Development of a Thermodynamic Model for Confined Fluids
Noura Dawass, Ioannis G. Economou, Marcelo Castier, Michelle D'Lima