Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5382112 | Chemical Physics Letters | 2013 | 6 Pages |
Abstract
We use DFT-GGA method to optimize CO2 adsorption on Cu2O (1 1 1) oxygen-vacancy surface. The figure describes the CO2 adsorption via the form of CO2δ- radical anion at oxygen vacancy.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Huanwen Wu, Ning Zhang, Hongming Wang, Sanguo Hong,