Kinetics and mechanisms for the adsorption, dissociation, and diffusion of hydrogen in Ni and Ni/YSZ slabs: A DFT study

Langmuir

Volumn 28, Issue 13, 2012, Pages 5596-5605

  Weng, Meng Hsiung ^a   Chen, Hsin Tsung ^b   Wang, Yao Chun ^a   Ju, Shin Pon ^a   Chang, Jee Gong ^c   Lin, M C ^d  

^a NATIONAL SUN YAT SEN UNIVERSITY   (Taiwan)

^b CHUNG YUAN CHRISTIAN UNIVERSITY   (Taiwan)

^c NATIONAL CENTER FOR HIGH PERFORMANCE COMPUTING   (Taiwan)

^d NATIONAL CHIAO TUNG UNIVERSITY   (Taiwan)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORIES (DFT); DFT STUDY; H DIFFUSION; HYDROGEN DISSOCIATION; INTERFACE REGIONS; KINETICS AND MECHANISM;

ADSORPTION; ATOMS; DISSOCIATION; HYDROGEN; RATE CONSTANTS;

DIFFUSION;

EID: 84859476847     PISSN: 07437463     EISSN: 15205827     Source Type: Journal    
DOI: 10.1021/la300305m     Document Type: Article

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