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Reaction mechanism of methanol dehydrogenation on a sodium carbonate catalyst

✍ Scribed by Shoujin Su; Michael R. Prairie; Albert Renken

Publisher
Elsevier Science
Year
1992
Tongue
English
Weight
722 KB
Volume
91
Category
Article
ISSN
0926-860X

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## Abstract The decomposition mechanisms of methanol on five different Pt surfaces, the flat surface of Pt(111), Pt‐defect, Pt‐step, Pt(110)(1 Γ— 1), and Pt(110)(2 Γ— 1), have been studied with the DFT‐GGA method using the repeated slab model. The adsorption energies under the most stable configurati