AVS 62nd International Symposium & Exhibition
    In-Situ Spectroscopy and Microscopy Focus Topic Monday Sessions
       Session IS+AS+SS-MoM

Invited Paper IS+AS+SS-MoM8
The Use of Integrated Operando, In Situ and DFT Techniques to Unravel the Steps of Heterogeneous Catalytic Reactions

Monday, October 19, 2015, 10:40 am, Room 211C

Session: Fundamental Studies of Surface Chemistry of Single Crystal and Nanomaterials under Reaction Conditions
Presenter: Fabio Ribeiro, Purdue University
Authors: F. Ribeiro, Purdue University
W.N. Delgass, Purdue University
J. Greeeley, Purdue University
R. Gounder, Purdue University
J. Miller, Purdue University
W.F. Schneider, University of Notre Dame
Correspondent: Click to Email

Our quest to understand catalysis is limited by our ability to observe the active site while it is turning over. To facilitate this task we developed model catalysts where the active sites are deposited on the external surface area of an appropriate support. Effective characterization, however, happens only with the simultaneous measurement of the rate of reaction while the catalyst is in operation, called operando measurements. The application of operando techniques is becoming a more common tool to help unravel catalytic functions. Our group has custom-built an operando reactor for the measurement of X-ray absorption spectroscopy. While operando measurements are a major improvement, they provide a static picture of a system that is actually dynamic. Dynamic techniques where the catalyst kinetic and structural properties can be followed simultaneously with a time resolution of a fraction of a turnover are the techniques of choice. We will show examples using a transmission FTIR cell we developed. The great advantage and sometimes necessity of performing experiments in the dynamic and operando modes will be discussed. The help from theory will also be illustrated.