Published August 2021
| public
Conference Paper
Grand canonical quantum mechanics with applications to mechanism and rates for electrocatalysis
Abstract
We will outline the new Quantum Mechanics based Grand Canonical Potential Kinetics (GCP-K) methodol. with applications to predicting Pourbaix diagrams and turn-over-frequency (TOF) as a function of applied potential and Tafel Slope for electrocatalytic CO₂ redn. to C₂ products, oxygen redn. reaction, and oxygen redn. reaction.
Additional Information
© 2021 American Chemical Society.Additional details
- Eprint ID
- 112402
- Resolver ID
- CaltechAUTHORS:20211214-175234930
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2021-12-14Created from EPrint's datestamp field
- Updated
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2021-12-14Created from EPrint's last_modified field