| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 6527281 | Journal of Catalysis | 2014 | 9 Pages |
Abstract
- First DFT study of complete catalytic cycle of CO2 hydrolysis by Zn-tetra.
- Microkinetic model built based on first principles reveals rate-determining step.
- Analytical rate expression aids experimentalists in biomimetic catalyst design.
- New insight into the pH dependence of the rate of carbon dioxide hydrolysis.
Related Topics
Physical Sciences and Engineering
Chemical Engineering
Catalysis
Authors
Renhu Ma, George F. Schuette, Linda J. Broadbelt,