| Introductory Remarks |
Comparing Model Asphalt Systems Using Molecular Simulation
Liqun Zhang, University of Rhode Island, Dept. of Chemical Engineering, 205 Crawford Hall, Kingston, RI 02881 and Michael L. Greenfield, University of Rhode Island, Dept. of Chemical Eng., 205 Crawford Hall, Kingston, RI 02881 |
The Molecular Modeling and Design of High Performance Biodegradable Lubricants
Mary J. Biddy, Department of Chemical and Biological Engineering, University of Wisconsin, Madison, WI 53706, Michael J. Tupy, Cargill Inc., 2301 Crosby Road, Wayzata, MN 55391 and Juan J. de Pablo, Department of Chemical and Biological Engineering, University of Wisconsin, Madison, WI 53706 |
Design of New Lubricant Formulations through Mechanistic Modeling
Jim Pfaendtner, Chemical and Biological Engineering, Northwestern University, 2145 Sheridan Rd E136, Evanston, IL 60208-3120, Q. Jane Wang, Mechanical Engineering, Northwestern University and Linda Broadbelt, Northwestern University, Department of Chemical Engineering, 2145 Sheridan Road E136, Evanston, IL 60208-3120 |
Break |
Solubilities of Phenol and Dihydroxybenzenes in Water and Water/Ethanol
Mixtures Using Monte Carlo Simulations
Divesh Bhatt, Department of Chemistry, University of Minnesota, P190 Kolthoff Hall, Minneapolis, MN 55455 and J. Ilja Siepmann, University of Minnesota, Department of Chemistry, Minneapolis, MN 55455-0431 |
Phase Equilibria and Transport in Carbon Dioxide Expanded Solvents
Brian B. Laird1, Yao A Houndonougbo1, Jianxin Guo2, Gerry Lushington2 and Krzysztof Kuczera3, (1)Chemistry, University of Kansas, 1251 Wescoe Hall Drive, Lawrence, KS 66045, (2)Molecular Modeling and Graphics Laboratory, University of Kansas, 1251 Wescoe Hall Drive, Lawrence, KS 66045, (3)Chemistry and Molecular Biosciences, University of Kansas, 1251 Wescoe Hall Drive, Lawrence, KS 66045 |
Multilevel Modeling of Complex Systems
Steen Christensen1, Jens Abildskov1, Günther Peters2 and Flemming Yssing Hansen2, (1)Department of Chemical Engineering, Technical University of Denmark, Søltoftsplads, Kgs. Lyngby, 2800, Denmark, (2)Department of Chemistry, Technical University of Denmark, Søltoftsplads, Kgs. Lyngby, 2800, Denmark |
Generalized Uniquac-Qspr Model for Vapor-Liquid Equilibria Prediction of Binary Mixtures
Devipriya Ravindranath, Srinivasa S. Godavarthy, Rob L. Robinson Jr. and Khaled A. M. Gasem, Oklahoma State University, 423 Engineering North, Stillwater, OK 74078 |