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Frontiers of Chemical Science and Engineering >> 2020, Volume 14, Issue 6 doi: 10.1007/s11705-019-1908-y
Mechanism of methanol decomposition on the Pd/WC(0001) surface unveiled by first-principles calculations
. College of Chemical Engineering, Zhejiang University of Technology, Hangzhou 310014, China.. School of Materials and Environmental Engineering, Chizhou University, Chizhou 247000, China
Abstract
Keywords
density functional theory ; methanol ; direct methanol fuel cells ; WC(0001)-supported Pd monolayer ; decomposition mechanism
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