Long-range interactions between polar molecules and metallic surfaces: A comparison of classical and density functional theory based models

Chemical Physics Letters

Volumn 471, Issue 4-6, 2009, Pages 239-243

  Fernández Torre, Delia ^a   Kupiainen, Oona ^a   Pyykkö, Pekka ^a   Halonen, Lauri ^a  

^a UNIVERSITY OF HELSINKI   (Finland)

Author keywords

[No Author keywords available]

Indexed keywords

HYDROGEN; METALLIC COMPOUNDS; MOLECULES; PROBABILITY DENSITY FUNCTION;

CLASSICAL APPROACHES; DENSITY FUNCTIONAL; DENSITY-FUNCTIONAL THEORIES; ELECTROSTATIC MODELS; GENERALIZED GRADIENT APPROXIMATIONS; HYDROGEN FLUORIDES; IMAGE-CHARGE METHODS; INTERACTION ENERGIES; LONG DISTANCE INTERACTIONS; LONG-RANGE INTERACTIONS; METAL SURFACES; METALLIC SURFACES; PERIODIC BOUNDARY CONDITIONS; PLANE-WAVE BASIS FUNCTIONS; POINT DIPOLES; POLAR MOLECULES; WATER MOLECULES;

DENSITY FUNCTIONAL THEORY;

EID: 62249214187     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2009.02.037     Document Type: Article

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