The Conformational Dynamics of the Ligands Determines the Electronic Circular Dichroism of the Chiral Au(38)(SC(2)H(4)Ph)(24) Cluster

[Image: see text] Effects of the conformational dynamics of 2-PET protective ligands on the electronic circular dichroism (ECD) of the chiral Au(38)(SC(2)H(4)Ph)(24) cluster are investigated. We adopt a computational protocol in which ECD spectra are calculated via the first principle polTDDFT appro...

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Detalles Bibliográficos
Autores principales: Monti, M., Brancolini, G., Coccia, E., Toffoli, D., Fortunelli, A., Corni, S., Aschi, M., Stener, M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9940292/
https://www.ncbi.nlm.nih.gov/pubmed/36787099
http://dx.doi.org/10.1021/acs.jpclett.2c03923

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9940292/
https://www.ncbi.nlm.nih.gov/pubmed/36787099
http://dx.doi.org/10.1021/acs.jpclett.2c03923

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