First-principles investigation of the activation of CO2 molecule on TM/Cu (TM=Fe, Co and Ni) surface alloys

Published 2015 View Full Article

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Title
First-principles investigation of the activation of CO2 molecule on TM/Cu (TM=Fe, Co and Ni) surface alloys
Authors
Keywords
Density functional theory, Bimetallic alloys, CO, 2, activation, d, -Band center
Journal
APPLIED SURFACE SCIENCE
Volume 353, Issue -, Pages 902-912
Publisher
Elsevier BV
Online
2015-07-11
DOI
10.1016/j.apsusc.2015.06.165

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