B3LYP study of water adsorption on cluster models of Pt(1 1 1), Pt(1 0 0) and Pt(1 1 0): Effect of applied electric field

Electrochimica Acta

Volumn 53, Issue 26, 2008, Pages 7796-7804

  Blanco, Raquel ^a   Orts, José Manuel ^a  

^a UNIVERSITY OF ALICANTE   (Spain)

Author keywords

Adsorption energy; Applied field; IR frequencies; Platinum; Water adsorption

Indexed keywords

ADSORPTION; CHLORINE COMPOUNDS; DENSITY FUNCTIONAL THEORY; DEWATERING; ELECTRIC FIELDS; ELECTROMAGNETIC FIELD THEORY; ELECTROMAGNETIC FIELDS; MOLECULES; PLATINUM COMPOUNDS; PROBABILITY DENSITY FUNCTION;

A-DENSITY; ADSORPTION ENERGIES; ADSORPTION ENERGY; APPLIED ELECTRIC FIELD; APPLIED FIELD; B3LYP/LANL2DZ; CLUSTER MODELLING; IR FREQUENCIES; PT(1 0 0); WATER ADSORPTION; WATER MOLECULES;

PLATINUM;

EID: 49349090521     PISSN: 00134686     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.electacta.2008.05.042     Document Type: Article

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