Study of Proton Adsorption at Heterogeneous Oxide/Electrolyte Interface. Prediction of the Surface Potential Using Monte Carlo Simulations and 1-pK Approach

Journal of Computational Chemistry

Volumn 25, Issue 5, 2004, Pages 704-711

  Zarzycki, P ^a   Charmas, R ^b   Szabelski, P ^a  

^a MARIA CURIE SK ODOWSKA UNIVERSITY   (Poland)

^b JÓZEF PI SUDSKI UNIVERSITY OF PHYSICAL EDUCATION IN WARSAW   (Poland)

Author keywords

Electrolyte oxide interface; Heterogeneity; Monte Carlo simulations; Proton adsorption; Surface potential

Indexed keywords

ADSORPTION; ADSORPTION ISOTHERMS; COMPUTER SIMULATION; ELECTROLYTES; ELECTROSTATICS; MONTE CARLO METHODS; PH EFFECTS; PROTONS;

ELECTROLYTE/OXIDE INTERFACES; HETEROGENEITY; MONTE CARLO SIMULATIONS; PROTON ADSORPTION; SURFACE POTENTIALS;

SURFACE PHENOMENA;

EID: 1842738512     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/jcc.10419     Document Type: Article

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