Water monomer interaction with gold nanoclusters from van der Waals density functional theory

Journal of Chemical Physics

Volumn 136, Issue 2, 2012, Pages

  Xue, Yongqiang ^a  

^a STATE UNIVERSITY OF NEW YORK   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

3D CLUSTERS; ADSORPTION ENERGIES; ADSORPTION STRUCTURES; BULK SURFACES; COHESIVE ENERGIES; COVALENT INTERACTIONS; ELECTRON DENSITIES; FLUXIONALITY; GENERALIZED GRADIENT APPROXIMATIONS; GOLD NANOCLUSTER; IN-PLANE; INDUCED CHARGES; LONE PAIR; NONLOCAL; ORBITAL INTERACTION; ORBITALS; PHYSICAL PICTURES; PLANAR CLUSTERS; PROJECTED DENSITY OF STATE; SURFACE ADSORPTION; THREE-DIMENSIONAL (3D) CLUSTERS; VAN DER WAALS; WATER ADSORPTION; WATER MOLECULE;

ADSORPTION; ATOMS; BOND LENGTH; GEOMETRY; GOLD; MOLECULES; MULTILAYERS; NANOCLUSTERS; THREE DIMENSIONAL; VAN DER WAALS FORCES;

DENSITY FUNCTIONAL THEORY;

GOLD; METAL NANOPARTICLE; WATER;

ARTICLE; CHEMICAL PHENOMENA; CHEMISTRY; QUANTUM THEORY;

GOLD; HYDROPHOBIC AND HYDROPHILIC INTERACTIONS; METAL NANOPARTICLES; QUANTUM THEORY; WATER;

EID: 84855932786     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3675494     Document Type: Article

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