Formaldehyde decomposition and coupling on V(100): A first-principles study

Journal of Physical Chemistry C

Volumn 116, Issue 19, 2012, Pages 10639-10648

  Wang, Hui ^a   He, Chao Zheng ^a   Huai, Li Yuan ^a   Liu, Jing Yao ^a  

^a JILIN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

BOND SCISSIONS; DIFFERENT MECHANISMS; DIRECT COUPLING; FIRST-PRINCIPLES STUDY; HIGH TEMPERATURE; HIGH-TEMPERATURE REACTION; IN-LINE; LOW TEMPERATURE REACTIONS; LOW TEMPERATURES; PERIODIC DENSITY FUNCTIONAL THEORY; THREE REACTION PATHWAYS;

CALCULATIONS; DENSITY FUNCTIONAL THEORY; FORMALDEHYDE; HYDROGENATION; OXYGEN; TEMPERATURE;

REACTION INTERMEDIATES;

EID: 84861685309     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp301364w     Document Type: Article

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