A comparative DFT study of the catalytic activity of MnO 2 (2 1 1) and (2-2-1) surfaces for an oxygen reduction reaction

Chemical Physics Letters

Volumn 539-540, Issue , 2012, Pages 89-93

  Li, Li ^a   Wei, Zidong ^a   Chen, Siguo ^a   Qi, Xueqiang ^a   Ding, Wei ^a   Xia, Meirong ^a   Li, Rong ^a   Xiong, Kun ^a   Deng, Zihua ^a   Gao, Yuanyuan ^a  

^a CHONGQING UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION ENERGIES; DENSITY FUNCTIONAL THEORIES (DFT); DFT STUDY; ELECTRON TRANSFER; HIGH-INDEX; HOMO ENERGY LEVELS; OXYGEN REDUCTION; OXYGEN REDUCTION REACTION;

ADSORPTION; CATALYST ACTIVITY; DENSITY FUNCTIONAL THEORY; ELECTRIC CONDUCTIVITY; ELECTROLYTIC REDUCTION;

MANGANESE OXIDE;

EID: 84862700387     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2012.04.055     Document Type: Article

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