Theoretical Investigation of Ammonia Thermal Desorption and Oxidation on RuO2(110): A Combined DFT and Microkinetic Study
碩士 === 國立臺灣科技大學 === 化學工程系 === 99 === We combined the DFT calculations and microkinetic modeling to simulate the TDS spectra of NH3, O2, and H2O and predict the formation rates of ammonia oxidation products including N2, NO, and N2O with various conditions on the RuO2(110) surface. In the TDS simula...
| Main Authors: | , |
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| Other Authors: | |
| Format: | Others |
| Language: | zh-TW |
| Published: |
2011
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| Online Access: | http://ndltd.ncl.edu.tw/handle/56552240794286027746 |