I&ECSunday, 26 March 2006

1:30 PM-5:45 PM Georgia World Congress Center -- B314, Oral
Ionic Liquids: Not Just Solvents Anymore OR Ionic Liquids: Parallel Futures (Sponsored by Green Chemistry and Engineering, Separation Science and Technology and Novel Chemistry with Industrial Applications Sub-Divisions)
Ionic Liquid Structure Activity Relationships and Modeling
Organizers:Joan F. Brennecke
Robin D. Rogers
Kenneth R. Seddon
Organizer, Presiding:Edward J. Maginn
1:30 PMForce fields and simulation on imidazolium based ionic liquids
Wenchuan Wang, Zhiping Liu
2:00 PMNanostructural organization in ionic liquids
Agílio A. H. Pádua, José Nuno A. Canongia Lopes
2:30 PMGlassy solvation dynamics and spectroscopy in room-temperature ionic liquids
Claudio J. Margulis, Zhonghan Hu, Xuhui Huang, Yuhui Li, Bruce J. Berne
3:00 PMMultiscale simulation of ionic liquids: An emerging picture of their unique dynamical and structural behavior
Gregory A. Voth
3:30 PMIntermission
3:45 PMSolvation structure and transport of acidic protons in ionic liquids: Insights from computer simulations
Mario G. Del Popolo, Jorge Kohanoff, Ruth M. Lynden-Bell
4:15 PMTheoretical investigation of ionic liquids in the catalysis of the Diels-Alder reaction
Orlando Acevedo, William L. Jorgensen, Jeffrey D. Evanseck
4:45 PMMolecular dynamics study of the mechanism of cellulose dissolution in the ionic liquid 1-n-butyl-3-methylimidazolium chloride
Zhiwei Liu, Richard C. Remsing, Preston B. Moore, Guillermo Moyna
5:15 PMAtomistic simulation of ionic liquids containing pyridinium and triazolium cations
Edward J. Maginn

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Symposium Grid -- Division of Industrial and Engineering Chemistry -- Session Listing

The 231st ACS National Meeting, Atlanta, GA, March 26-30, 2006