Chemical response of aldehydes to compression between (0001) surfaces of -alumina

Journal of Chemical Physics

Volumn 134, Issue 1, 2011, Pages

  Haw, Sarah M ^a   Mosey, Nicholas J ^a  

^a QUEEN S UNIVERSITY   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

C-C BONDS; CARBON ATOMS; CARBONYL GROUPS; CHEMICAL BEHAVIOR; CHEMICAL PROCESS; CHEMICAL SPECIES; FIRST-PRINCIPLES; HYDROGEN ATOMS; METAL OXIDE SURFACES; MOLECULAR DYNAMICS SIMULATIONS; MONOLAYER COVERAGE; PROTON ACCEPTORS; UNI-AXIAL COMPRESSION; WANNIER FUNCTIONS;

ADSORPTION; ALDEHYDES; CHEMICAL BONDS; ELECTRONIC STRUCTURE; METALLIC COMPOUNDS; MOLECULAR DYNAMICS; MOLECULES; MONOLAYERS; PROTON TRANSFER; REACTION KINETICS; REACTION PRODUCTS;

SURFACE STRUCTURE;

ALDEHYDE; ALUMINUM OXIDE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; MOLECULAR DYNAMICS; SURFACE PROPERTY;

ALDEHYDES; ALUMINUM OXIDE; MODELS, MOLECULAR; MOLECULAR DYNAMICS SIMULATION; SURFACE PROPERTIES;

EID: 78651273631     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3528980     Document Type: Article

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