CHx adsorption (x = 1-4) and thermodynamic stability on the CeO2(111) surface: A first-principles investigation

RSC Advances

Volumn 4, Issue 24, 2014, Pages 12245-12251

  Fronzi, Marco ^a   Piccinin, Simone ^b   Delley, Bernard ^c   Traversa, Enrico ^d   Stampfl, Catherine ^e  

^a OSAKA UNIVERSITY   (Japan)

^b IOM CNR LABORATORIO TASC   (Italy)

^c PAUL SCHERRER INSTITUTE   (Switzerland)

^d KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Saudi Arabia)

^e UNIVERSITY OF SYDNEY   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO INVESTIGATION; CERIUM OXIDES; ENVIRONMENTAL CONDITIONS; FIRST-PRINCIPLES INVESTIGATIONS; IN-VACUUM; PARTIAL OXIDATION OF METHANE; TRANSITION PHASIS;

ELECTRONIC STRUCTURE;

METHANE;

EID: 84897715758     PISSN: None     EISSN: 20462069     Source Type: Journal    
DOI: 10.1039/c4ra01224k     Document Type: Article

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