On the HSAB based estimate of charge transfer between adsorbates and metal surfaces

Chemical Physics

Volumn 393, Issue 1, 2012, Pages 1-12

  Kokalj, Anton ^a  

^a JO EF STEFAN INSTITUTE   (Slovenia)

Author keywords

Adsorption; Benzotriazole; Charge transfer; Chlorine; Corrosion inhibitors; Density functional theory (DFT); HSAB; Mulliken electronegativity of metals; Nitrogen; Oxygen; Quantum chemical calculations; Work functions of metal surfaces

Indexed keywords

EID: 84855574404     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2011.10.021     Document Type: Article

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