Density functional calculations to study the mechanism of the Fischer-Tropsch reaction on Fe(111) and W(111) surfaces

Journal of Physical Chemistry C

Volumn 115, Issue 22, 2011, Pages 11045-11055

  Li, Han Jung ^a   Chang, Chun Chih ^a   Ho, Jia Jen ^a  

^a NATIONAL TAIWAN NORMAL UNIVERSITY   (Taiwan)

Author keywords

[No Author keywords available]

Indexed keywords

BOND SCISSIONS; C-C COUPLING; CO ACTIVATION; COUPLING REACTION; DENSITIES OF STATE; DENSITY FUNCTIONAL THEORY CALCULATIONS; FISCHER-TROPSCH REACTION; REACTION BARRIERS;

CHEMICAL BONDS; DENSITY FUNCTIONAL THEORY; FISCHER-TROPSCH SYNTHESIS;

SURFACE REACTIONS;

EID: 79958744040     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp112372g     Document Type: Article

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