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Correlating the Crystal Structure of A Thiol-Protected Au Cluster and Optical Properties.

The article focuses on the unusual single crystal structure of a phenylethanethiol-capped, 25-atom gold cluster. Researchers correlated the structure with its optical absorption spectrum by performing time-dependent density functional theory (TDDFT) calculations. They suggested the importance to pre...

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Publicado en:Journal of the American Chemical Society Vol. 130; no. 18; pp. 5883 - 5886
Autores principales: Manzhou Zhu, Aikens, Christine M., Hollander, Frederick J., Schatz, George C., Jin, Rongchao
Formato: Artículo
Publicado: American Chemical Society 5/7/2008
Materias:
Crystal field theory
Cluster analysis (Statistics)
Density functionals
Functional analysis
Gold
Acceso en línea:Ver este registro en EBSCOhost
Sumario:The article focuses on the unusual single crystal structure of a phenylethanethiol-capped, 25-atom gold cluster. Researchers correlated the structure with its optical absorption spectrum by performing time-dependent density functional theory (TDDFT) calculations. They suggested the importance to prepare a series of size discrete gold thiolate clusters and to characterize their structures within the range.