Ligand effects on the optical and chiroptical properties of the thiolated Au18 cluster
Author:
Affiliation:
1. CICFIM-Facultad de Ciencias Físico-Matemáticas
2. Universidad Autónoma de Nuevo León
3. San Nicolás de los Garza
4. Mexico
Abstract
The effect of chiral and achiral ligands protecting the inner Au9 core of the Au18(SR)14 cluster is studied based on density functional theory (DFT) and its corrected long-range interaction (DFT-D) approach.
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2016/CP/C6CP04298H
Reference37 articles.
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5. T. Tsukuda , H.Tsunoyama and Y.Negishi, in Metal Nanoclusters in Catalysis and Materials Science: The Issue of Size Control, ed. B. Corain, G. Schmid and M. Toshima, Elsevier, Amsterdam, 2008, p. 373
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