Adsorption of OOH, OH and O on Pt/Pd alloys using cluster model: A theoretical study
碩士 === 國立中正大學 === 化學所 === 97 === In this study, B3LYP with LANL2DZ and 6-31G* basis set are used to calculate adsorption energies of OOH, OH and O on PtxPd15-x alloy clusters. The result shows the pure Pt and Pd cluster calculation of adsorption energies of OOH, OH and O is similar to the earlier sl...
Main Authors: | , |
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Other Authors: | |
Format: | Others |
Language: | zh-TW |
Published: |
2009
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Online Access: | http://ndltd.ncl.edu.tw/handle/69799198076488838309 |