Thiophenol and thiophenol radical and their complexes with gold clusters Au5 and Au6

Journal of Molecular Structure

Volumn 708, Issue 1-3, 2004, Pages 165-173

  Remacle, F ^a   Kryachko, E S ^a,b  

^a UNIVERSITY OF LIÈGE   (Belgium)

^b BOGOLYUBOV INSTITUTE FOR THEORETICAL PHYSICS   (Ukraine)

Author keywords

Bond dissociation energy; Gold sulfur bond; Rotational barrier; S H bond; S H cleavage; Thiophenol; Thiophenol radical

Indexed keywords

GOLD; GOLD COMPLEX; SULFUR; THIOPHENOL; THIOPHENOL DERIVATIVE;

ARTICLE; CALCULATION; CLUSTER ANALYSIS; DENSITY FUNCTIONAL THEORY; ENTHALPY; MATHEMATICAL COMPUTING; OSCILLATOR; THERMODYNAMICS;

EID: 6944220418     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2004.02.056     Document Type: Article

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