| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5422858 | Surface Science | 2012 | 9 Pages |
Abstract
⺠An empirical, variable-charge COMB potential was proposed for the Cu/ZnO system. ⺠Cu atoms become more cationic when they interact with ZnO substrates. ⺠The dimer method was combined with COMB for determining migration barriers. ⺠Anisotropic migration of Cu atom on the ZnO(10-10) surface was predicted.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Yu-Ting Cheng, Tzu-Ray Shan, Bryce Devine, Donghwa Lee, Tao Liang, Beverly B. Hinojosa, Simon R. Phillpot, Aravind Asthagiri, Susan B. Sinnott,