Thiolate adsorption on Au(hkl) and equilibrium shape of large thiolate-covered gold nanoparticles

Journal of Chemical Physics

Volumn 138, Issue 6, 2013, Pages

  Barmparis, Georgios D ^a   Honkala, Karoliina ^b   Remediakis, Ioannis N ^a  

^a UNIVERSITY OF CRETE   (Greece)

^b UNIVERSITY OF JYVÄSKYLÄ   (Finland)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION ENERGIES; ATOMISTIC MODELS; AU SURFACES; BOND ANGLE; BRIDGE SITES; DENSITY FUNCTIONALS; DIMETHYL DISULFIDES; DISSOCIATIVE CHEMISORPTION; EQUILIBRIUM POSITIONS; EQUILIBRIUM SHAPE; GOLD ATOMS; GOLD NANOPARTICLES; METHANETHIOLATE; MODEL SYSTEM; STEP-EDGE; THEORY CALCULATION; THIOLATES; WULFF CONSTRUCTION;

CHEMISORPTION; DENSITY FUNCTIONAL THEORY; GOLD; METAL NANOPARTICLES;

ADSORPTION;

EID: 84874240191     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4790368     Document Type: Article

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