Hydrogen activation, diffusion, and clustering on CeO2(111): A DFT+ U study

Journal of Chemical Physics

Volumn 141, Issue 1, 2014, Pages

  Fernández Torre, Delia ^a,b   Carrasco, Javier ^c,d   Ganduglia Pirovano, M Verónica ^d   Pérez, Rubén ^a,e  

^a UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

^b INSTITUTO DE ESTRUCTURA DE LA MATERIA   (Spain)

^c CIC ENERGIGUNE   (Spain)

^d INSTITUTO DE CATÁLISIS Y PETROLEOQUÍMICA   (Spain)

^e Ciudad Universitaria de Cantoblanco   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

DISSOCIATION; ENERGY BARRIERS; OLIGOMERS; OXYGEN; SCANNING TUNNELING MICROSCOPY;

ATOMIC FORCE AND SCANNING TUNNELING MICROSCOPY; CHEMISORPTION ENERGY; HYDROGEN ACTIVATION; LOCAL ENERGY MINIMA; MOLECULAR DISSOCIATION; PARTIAL HYDROGENATION; RELATIVE STABILITIES; SURFACE OXYGEN VACANCIES;

ATOMS;

CESIUM; HYDROGEN; OXYGEN;

ADSORPTION; CHEMISTRY; DIFFUSION; QUANTUM THEORY; SCANNING TUNNELING MICROSCOPY; SURFACE PROPERTY;

ADSORPTION; CESIUM; DIFFUSION; HYDROGEN; MICROSCOPY, SCANNING TUNNELING; OXYGEN; QUANTUM THEORY; SURFACE PROPERTIES;

EID: 84904015783     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4885546     Document Type: Article

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