Interaction of O2 with reduced rutile TiO2(110) surface

Surface Science

Volumn 610, Issue , 2013, Pages 33-41

  Xu, H ^a   Tong, S Y ^a  

^a SOUTHERN UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

Author keywords

Density functional theory calculations; Oxygen vacancies and adsorption; Reaction pathways; Rutile TiO2 surface

Indexed keywords

ADSORPTION GEOMETRIES; DENSITY FUNCTIONAL THEORY CALCULATIONS; DIFFUSION PATHWAYS; EXPERIMENTAL OBSERVATION; FORMATION ENERGIES; INTRINSIC PROPERTY; LOW TEMPERATURES; OZONE MOLECULE; REACTION BARRIERS; REACTION PATHWAYS; ROOM TEMPERATURE; RUTILE TIO; SINGLE POINT DEFECTS; TI ATOMS;

ADSORPTION; DENSITY FUNCTIONAL THEORY; MOLECULES; OXIDE MINERALS; OXYGEN; OXYGEN VACANCIES; POINT DEFECTS;

TITANIUM DIOXIDE;

EID: 84874336654     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2013.01.003     Document Type: Article

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