Goddard, William A., III and Nielsen, Robert J. and Merinov, Boris and Cheng, Mu-Jeng and Cortez, Mendoza (2013) First principles based theory and applications to understanding and developing new catalysts for energy and fuels. In: 245th ACS National Meeting & Exposition, Abstracts of Papers, April 7-11, 2013, New Orleans, LA. https://resolver.caltech.edu/CaltechAUTHORS:20130729-104103263
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Abstract
We will summarize recent advances in First-principles based methods for catalysis and surface reactions and the application of these methods for predicting catalytic processes on surfaces with a focus on the Oxygen Redn. Reaction (ORR) The Oxygen Evolution Reaction (OER), and Selective activation and functionalization for various metallic and oxide electrodes and catalysts.
| Item Type: | Conference or Workshop Item (Paper) | ||||||||||
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| Additional Information: | © 2013 American Chemical Society. | ||||||||||
| Record Number: | CaltechAUTHORS:20130729-104103263 | ||||||||||
| Persistent URL: | https://resolver.caltech.edu/CaltechAUTHORS:20130729-104103263 | ||||||||||
| Usage Policy: | No commercial reproduction, distribution, display or performance rights in this work are provided. | ||||||||||
| ID Code: | 39627 | ||||||||||
| Collection: | CaltechAUTHORS | ||||||||||
| Deposited By: | Tony Diaz | ||||||||||
| Deposited On: | 29 Jul 2013 21:20 | ||||||||||
| Last Modified: | 03 Oct 2019 05:09 |
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