Structure and energetics of benzene adsorbed on transition-metal surfaces: Density-functional theory with van der Waals interactions including collective substrate response

New Journal of Physics

Volumn 15, Issue , 2013, Pages

  Liu, Wei ^a   Ruiz, Victor G ^a   Zhang, Guo Xu ^a   Santra, Biswajit ^a   Ren, Xinguo ^a   Scheffler, Matthias ^a   Tkatchenko, Alexandre ^a  

^a FRITZ HABER INSTITUT DER MAX PLANCK GESELLSCHAFT   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

EQUILIBRIUM DISTANCES; HYBRID INORGANIC/ORGANIC; INTERFACE GEOMETRY; MICROCALORIMETRY MEASUREMENTS; PERDEW-BURKE-ERNZERHOF; RANDOM PHASE APPROXIMATIONS; STRUCTURE AND ENERGETICS; VAN DER WAALS INTERACTIONS;

BENZENE; BINDING ENERGY; DENSITY FUNCTIONAL THEORY; ELECTRONS; IRIDIUM; LOW ENERGY ELECTRON DIFFRACTION; PALLADIUM; PLATINUM; RHODIUM; SILVER; TEMPERATURE PROGRAMMED DESORPTION; TRANSITION METALS; VAN DER WAALS FORCES;

SUBSTRATES;

EID: 84879022212     PISSN: 13672630     EISSN: None     Source Type: Journal    
DOI: 10.1088/1367-2630/15/5/053046     Document Type: Article

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