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

Monday, November 17, 2014: 6:00 PM
Galleria Exhibit Hall (Hilton Atlanta)
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.

Thermodynamics and Transport Properties

Neeraj Rai
Email: neerajrai@che.msstate.edu

Andrew Paluch
Email: paluchas@miamioh.edu

- indicates paper has an Extended Abstract file available on CD.

(231a) Modeling Synthesis of Mesoporous Silica Materials with Hybrid MD/MC Simulations
Szu-Chia Chien, Germán Pérez-Sánchez, José R. B. Gomes, Miguel Jorge, Scott M. Auerbach and Peter A. Monson
File available
(231ad) Prediction of Human Serum Albumin Binding Affinity for Anti-Cancer Drugs Using Norm Indexes
Qian Haicheng Sr., Kanwal Kanwal Jr., Jia Qingzhu, Wang Qiang, Xu Xiangying, Ji Huifen, Yin Jingchen, Wang Wenxuan, Ma Peisheng Sr., Hao Qinglan and Deng Yu

(231ag) Thermophysical Properties of Fresh and Lean Thermally Degraded N-Methyldiethanolamine
Ahmad Abukaashabeh, Emad Alhseinat, Sameer Al-Asheh, Fawzi Banat and Vikas Mittal
File available
(231ai) Proposal and Evaluation of a New Norm-Based QSAR Model for HIV-1 Reverse Transcriptase Inhibitors for 2-Amino-6-Arylsulfonylbenzonitriles and Congeners
Kanwal Kanwal Jr., Qian Haicheng Sr., Jia Qingzhu, Wang Qiang, Xu Xiangying, Ji Huifen, Yin Jingchen, Wang Wenxuan, Ma Peisheng Sr., Hao Qinglan and Deng Yu

(231ap) Solvent Properties of Lipidic Ionic Liquids
Blane D. Green, Kevin N. West, Richard A. O'Brien and James H. Davis Jr.

(231aq) Minimum in the Thermal Conductivity of Supercooled Water: A Computer Simulation Study
John Biddle, Fernando Bresme, Jan Sengers and Mikhail A. Anisimov

(231at) Physical Property and Free Volume Correlations of Highly-Branched Alkylimidazoles for Gas Separations
Matthew S. Shannon, Joshua Moon, A. Christopher Irvin, Haining Liu, C. Heath Turner and Jason E. Bara

(231av) Octanol-Water Partition Coefficient of Trichloroethylene Via Molecular Simulations
Himanshu Goel, Shanmuga Venkatesan, Daniel C Botta and Neeraj Rai

(231aw) Developing First Principles Monte Carlo Methods for Phase Equilibria in the CP2K Software Suite
Neeraj Rai, J. Ilja Siepmann, Troy van Voorhis, Ben Slater and Michiel Sprik

(231ax) Structural and Transport Properties of Liquid Benzene
Shanmuga Venkatesan, Katie A. Maerzke, Neeraj Rai and J. Ilja Siepmann

(231az) Liquid Dynamic Viscosities of 1-Butanol and 2-Butanol up to 30 Mpa and 353 K
Luis A. Galicia-Luna, Alfredo Pimentel-Rodas and Jose J. Castro-Arellano

(231b) Solubility of Water in Alkanes, Perfluoroalkanes and Perfluoroalkylalkanes: Experimental Results and SAFT Modeling
Pedro Morgado, Gaurav Das, Rita Gomes, Amparo Galindo, Clare McCabe and Eduardo Filipe

(231bc) Flash Point of Binary Mixtures of Biodiesel + Different Diesel
Ricardo Torres, Daniel Trifoni and Ronaldo Santos
File available
(231be) A QSPR Approach for Accessing the Lower Heating Value
Karsten Müller, Johannes Albert and Wolfgang Arlt

(231e) Prediction of Kinematic Viscosities and Vapor-Liquid Equilibria for Ternary Systems Using Activity Coefficient Model
Katsumi Tochigi, Hiroyuki Matsuda, Kiyofumi Kurihara, Toshitaka Funazukuri and V.K. Rattan

(231k) Multi-Phase Equilibrium Flash with Salt Deposition in Systems with Multiple Salts
Angelo Lucia, Heath Henley, Edward Thomas and Ariana Clements

(231q) Effect of Anions on CO2 Solubility of Ionic Liquids Using a Magnetic Suspension Balance
Daisuke Kodama, Masaki Watanabe, Takuya Shimomura, Takashi Makino and Mitsuhiro Kanakubo

(231r) Generalized Binary Interaction Parameters for the Peng-Robinson Equation of State
Agelia M. Abudour, Sayeed A. Mohammad, Robert L. Robinson Jr. and Khaled A. M. Gasem

(231u) Solubility of CO2 in Deep Eutectic Solvents: Experiments and Modeling
Mohamed K. Hadj-Kali, Sarwono Mulyono, Emad M. Ali and Inas M. Alnashef

(231w) Relationship Between Viscosity and CO2 Loading in Aqueous and Non-Aqueous Amine Solvents
Jason M. Tedstone, Jason E. Bara, Claire Belson and John W. Whitley

File available
(659b) Thermodynamic Analysis of a Lignocelullose-Based Furfural Biorefinery
Carlos A. Cardona, Hector A. Forero, Valentina Aristizábal and Alvaro Gómez
See more of this Group/Topical: Engineering Sciences and Fundamentals