Adsorption and dissociation of H 2 on the Cu 2 O(1 1 1) surface: A density functional theory study

Applied Surface Science

Volumn 257, Issue 4, 2010, Pages 1175-1180

  Zhang, Riguang ^a   Wang, Baojun ^a   Ling, Lixia ^a   Liu, Hongyan ^a   Huang, Wei ^a  

^a TAIYUAN UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

Adsorption; Density functional theory; Dissociation; Hydrogen

Indexed keywords

ADSORPTION; ATOMS; BINARY ALLOYS; COPPER ALLOYS; COPPER OXIDES; DISSOCIATION; HYDROGEN; OXYGEN VACANCIES;

ACTIVE CENTER; ADSORPTION MODEL; CALCULATION RESULTS; DENSITY FUNCTIONAL THEORY STUDIES; DISSOCIATION PATHWAYS; DISSOCIATIVE ADSORPTION; MOLECULAR HYDROGEN; SHORT BRIDGES;

DENSITY FUNCTIONAL THEORY;

EID: 77957167394     PISSN: 01694332     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.apsusc.2010.07.095     Document Type: Article

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