Chemistry, Department of: Faculty Series
Xiao Cheng Zeng Publications
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Document Type
Article
Date of this Version
2009
Abstract
We present density-functional theory calculations of the dehydrogenation of methane and CHx (x = 1 – 3) on a Cu/Ni(111) surface, where Cu atoms are substituted on the Ni surface at a coverage of 1/4 monolayer.
Comments
Published in THE JOURNAL OF CHEMICAL PHYSICS 131, 2009. Copyright © 2009 American Institute of Physics. Used by permission.