2006 AIChE Annual Meeting

Session: Reaction Path Analysis I

This session focuses on experimental and computational unraveling of reaction pathways in complex reacting systems.

Chair

Linda J. Broadbelt, Northwestern University

Co-Chair

Presentations

12:30 PM

(254a) In-Situ Infared Study of Catalytic Ignition of Methane on Rh/Al2o3
Chundi Cao, Abdennour Bourane, John R. Schlup, Keith Hohn

12:49 PM

(254b) On-Line Spectroscopic Studies and Kinetic Measurements of Liquid-Phase Heterogeneous Catalytic Systems
Feng Gao, Ayman Daoud Allian, Huajun Zhang, Shuying Cheng, Marc Garland

01:08 PM

(254c) Elucidating the Reaction Pathway for Water-Enhanced Cycloaddition
Eric J. Doskocil

01:27 PM

(254d) Mechanistic Studies of Olefin Epoxidation by Hydrogen Peroxide Catalyzed by Iron Porphyrins
Ned A. Stephenson, Alexis T. Bell

01:46 PM

(254e) Ab Initio Reaction Path Analysis of the Initial Hydrogen Abstraction from Organic Acids by Hydroxyl Radicals
Wenjie Sun, Liming Yang, Liya E Yu, Mark Saeys

02:05 PM

(254f) Kinetic Study of Acrylate Polymerization at High Temperature
Xinrui Yu, Robin A. Hutchinson, Linda J. Broadbelt

02:24 PM

(254g) A First-Principles Analysis of the Synthesis of Organic/Inorganic Hybrid Nanoscale Systems: Epoxy Amine Addition for Polysilsesquioxanes
Vamsi M. Vadhri, Matthew Neurock

02:42 PM

(254h) A Density Functional Theory Study of Reaction of H2 and O2 to Form H2O2 on Gas-Phase Au-Alloy Clusters
Ajay M. Joshi, W. Nicholas Delgass, Kendall T. Thomson