Molecular dynamics simulation study of water adsorption on hydroxylated graphite surfaces

Journal of Physical Chemistry B

Volumn 110, Issue 16, 2006, Pages 8398-8408

  Picaud, Sylvain ^a   Collignon, B ^a   Hoang, Paul N M ^a   Rayez, J C ^b  

^a UNIVERSITÉ DE FRANCHE COMTÉ   (France)

^b CNRS   (France)

Author keywords

[No Author keywords available]

Indexed keywords

COMPOSITION; GRAPHITE; HYDROXYLATION; MOLECULAR DYNAMICS; SURFACE REACTIONS; THERMAL EFFECTS;

INFINITE GRAPHITE PLANE; QUANTUM CHEMICAL CALCULATIONS; WATER CLUSTERS; WATER-OH SITES INTERACTION;

WATER ABSORPTION;

EID: 33646436436     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp056889t     Document Type: Article

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