Published January 26, 2021
| public
Book Section - Chapter
Fuel Cells Electrocatalysis with QM and FF
- Creators
-
Goddard, William A., III
Abstract
Our studies on hydrogen PEM fuel cells have focused on the Oxygen Reduction Reaction (ORR), which is currently the biggest obstacle to wide spread application, and the role of the Nafion electrolyte in proton conduction and degradation. The big breakthrough here was full solvent (5 layers) solvation, which required ReaxFF to pre-equilibrate the system.
Additional Information
© Springer Nature Switzerland AG 2021. First Online: 26 January 2021.Additional details
- Eprint ID
- 107762
- Resolver ID
- CaltechAUTHORS:20210127-081738476
- Created
-
2021-01-27Created from EPrint's datestamp field
- Updated
-
2021-11-16Created from EPrint's last_modified field
- Series Name
- Springer Series in Materials Science
- Series Volume or Issue Number
- 284
- Other Numbering System Name
- WAG
- Other Numbering System Identifier
- 1459