Hydroxylation of the surface of the corundum basal plane

Surface Science

Volumn 380, Issue 1, 1997, Pages 113-123

  Nygren, Martin A ^a   Gay, David H ^a   Catlow, C R A ^a  

^a DAVY FARADAY RESEARCH LABORATORY   (United Kingdom)

Author keywords

Ab initio quantum chemical methods and calculations; Aluminium oxide; Construction and use of effective interatomic interactions; Surface chemical reaction; Surface energy; Water

Indexed keywords

ALUMINUM COMPOUNDS; COMPUTATIONAL METHODS; DESORPTION; ENTHALPY; HYDROXYLATION; INTERFACIAL ENERGY; MATHEMATICAL MODELS; OXYGEN; RELAXATION PROCESSES; SURFACE PHENOMENA; WATER;

BASAL PLANE SURFACES; POLAR OXYGEN TERMINATED CUT;

CORUNDUM;

EID: 0031142351     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(97)01596-3     Document Type: Article

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