Density functional theory study of ethanol decomposition reaction over Ni/α-Al2O3(0001) surface
碩士 === 國立臺灣科技大學 === 化學工程系 === 96 === Ethanol decomposition on clean α-Al2O3 (0001) and Ni/α-Al2O3 (0001) surface was studied using periodic DFT calculations. Our results are compared with the available experimental findings of ethanol steam reforming reaction. For n Ni atoms (n=3–4) deposition on α-...
| Main Authors: | , |
|---|---|
| Other Authors: | |
| Format: | Others |
| Language: | en_US |
| Published: |
2008
|
| Online Access: | http://ndltd.ncl.edu.tw/handle/17855359730641666318 |