Investigation of Mechanism for Fischer-Tropsch Synthesis by Density Functional Theory and Kinetic Monte Carlo Method
碩士 === 國立臺灣師範大學 === 化學系 === 103 === This thesis is focused on mechanistic study of Fischer-Tropsch(F-T) synthesis reaction on Ru(0001) and Co(0001) surfaces by density functional theory(DFT) and kinetic Monte Carlo (kMC) method. DFT was employed to optimize the local minima and transition states for...
| Main Authors: | , |
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| Format: | Others |
| Language: | zh-TW |
| Published: |
2015
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| Online Access: | http://ndltd.ncl.edu.tw/handle/78374845588966037255 |