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Study of surface reactions and intermediates of ICH2CH2OH and ClCH2CH2OH on oxygen-precovered Cu(1 0 0)

โœ Scribed by Pei-Teng Chang; Kuan-Hung Kuo; Jian-Jung Shih; Chia-Yuan Chen; Jong-Liang Lin


Book ID
108278901
Publisher
Elsevier Science
Year
2004
Tongue
English
Weight
367 KB
Volume
561
Category
Article
ISSN
0039-6028

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The interactions of H and H 2 with W(1 0 0)-c(2 ร‚ 2)Cu and W(1 0 0) have been investigated through density functional theory (DFT) calculations to elucidate the effect of Cu atoms on the reactivity of the alloy. Cu atoms do not alter the attraction towards top-W sites felt by H 2 molecules approachi