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Density Functional Theory Studies of the Electronic Structure and Muon Hyperfine Interaction in [Au(25)(SR)(18)](0) and [Au(25)(SeR)(18)](0) Nanoclusters

[Image: see text] Density functional theory computational investigation was performed to study the electronic structures, muon sites, and the associated hyperfine interactions in [Au(25)(SR)(18)](0) and [Au(25)(SeR)(18)](0) where R is phenylethane. The calculated electronic structures show inhomogen...

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Detalles Bibliográficos
Autores principales: Ahmad, Siti N., Zaharim, Wan N., Sulaiman, Shukri, Hasan Baseri, Dang F., Mohd Rosli, Nur A., Ang, Lee S., Yahaya, Nor Z., Watanabe, Isao
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2020
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7774246/
https://www.ncbi.nlm.nih.gov/pubmed/33403287
http://dx.doi.org/10.1021/acsomega.0c04937

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