Methane dissociation on the ceria (111) surface

Journal of Physical Chemistry C

Volumn 112, Issue 44, 2008, Pages 17311-17318

  Knapp, Daniel ^a   Ziegler, Tom ^a  

^a UNIVERSITY OF CALGARY   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; ANODES; CARBON DIOXIDE; CHEMICAL OXYGEN DEMAND; COKE; COPPER; ELECTRIC BATTERIES; ELECTRODES; FUEL CELLS; METHANE; OXIDATION; SOLID OXIDE FUEL CELLS (SOFC);

ADSORPTION SITES; CARBON COKES; CERIA ANODES; COMPLETE OXIDATIONS; GAIN INSIGHTS; KINETIC BARRIERS; OXIDATION OF METHANES; SOLID OXIDES; TRANSITION STATES;

CERIUM COMPOUNDS;

EID: 56549095385     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp8039862     Document Type: Article

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51. 2 state by this overlap and is consequently stabilized relative to the unreduced state. This stabilization lowers the vacancy creation energy and is the main source of the discrepancy between the two DFT + U approaches.
52. 3+ ions, or 7.7 Å.
53. 2(g).