A density functional theory study of atomic steps on stoichiometric rutile TiO2(110)

Journal of Chemical Physics

Volumn 139, Issue 23, 2013, Pages

  Stausholm Møller, Jess ^a   Kristoffersen, Henrik Høgh ^a   Martinez, Umberto ^a   Hammer, Bjørk ^a  

^a AARHUS UNIVERSITY   (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

OXIDE MINERALS; OXYGEN;

ATOMIC STEP; BULK TERMINATION; DENSITY FUNCTIONAL THEORY STUDIES; ROBUST METHODS; SLAB THICKNESS; STEP STRUCTURE; THEORETICAL STUDY; VICINAL SURFACE;

DENSITY FUNCTIONAL THEORY;

EID: 84922920452     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4840515     Document Type: Article

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