Disordered reconstructions of the reduced SnO2-(110) surface

Surface Science

Volumn 605, Issue 7-8, 2011, Pages 714-722

  Ágoston, Péter ^a   Albe, Karsten ^a  

^a DARMSTADT UNIVERSITY OF TECHNOLOGY   (Germany)

Author keywords

Ab initio quantum chemical methods and calculations; Density functional calculations; Low index single crystal surfaces; Oxidation; Surface defects; Surface thermodynamics (including phase transitions); Tin oxides

Indexed keywords

AB INITIO QUANTUM CHEMICAL METHODS AND CALCULATIONS; BUILDING BLOCKES; DENSITY FUNCTIONAL CALCULATIONS; EQUILIBRIUM RECONSTRUCTION; INTERSTITIALS; LOW INDEX SINGLE CRYSTAL SURFACES; SURFACE PHASE; SURFACE THERMODYNAMICS (INCLUDING PHASE TRANSITIONS);

CALCULATIONS; DENSITY FUNCTIONAL THEORY; OXIDATION; PHASE DIAGRAMS; PHASE TRANSITIONS; QUANTUM CHEMISTRY; REPAIR; SINGLE CRYSTAL SURFACES; THERMODYNAMICS; TIN; TIN OXIDES;

SURFACE DEFECTS;

EID: 79952453959     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2011.01.007     Document Type: Article

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