| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 6527613 | Journal of Catalysis | 2014 | 12 Pages |
Abstract
- Density functional theory and microkinetic modelling are used to quantitatively determine the activities of flat and stepped surfaces of both nickel and nickel carbide.
- The coke formation probability is evaluated on each surface.
- A deactivation scheme, which could be used to rationalise the activity and coke formation observed experimentally, is developed.
Related Topics
Physical Sciences and Engineering
Chemical Engineering
Catalysis
Authors
Ziyun Wang, X.-M. Cao, Jinghao Zhu, P. Hu,