Ab initio study of chemisorption reactions for carboxylic acids on hydrogenated silicon surfaces

Journal of Physical Chemistry B

Volumn 108, Issue 45, 2004, Pages 17278-17280

  Cucinotta, Clotilde S ^a   Ruini, Alice ^a   Caldas, Marilia J ^a,b   Molinari, Elisa ^a  

^a UNIVERSITY OF MODENA AND REGGIO EMILIA   (Italy)

^b UNIVERSITY OF SÃO PAULO   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

CARBOXYLIC ACIDS; CHEMICAL BONDS; CHEMISORPTION; HYDROGENATION; MONOLAYERS; PROBABILITY DENSITY FUNCTION; SILICON; SUBSTRATES; THERMODYNAMIC STABILITY;

ENERGY LINE-UP; FORCE-FIELD METHOD; HYDROSILATION; RESIDUE;

CHEMICAL REACTIONS;

EID: 9144238232     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0460902     Document Type: Article

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