Phosphorescent Modulation of Metallophilic Clusters and Recognition of Solvents through a Flexible Host-Guest Assembly: A Theoretical Investigation

MP2 (Second order approximation of Møller–Plesset perturbation theory) and DFT/TD-DFT (Density functional theory/Time-dependent_density_functional_theory) investigations have been performed on metallophilic nanomaterials of host clusters [Au(NHC)(2)](+)⋅⋅⋅[M(CN)(2)](−)⋅⋅⋅[Au(NHC)(2)](+) (NHC = N-het...

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Detalles Bibliográficos
Autores principales: Li, Zhi-Feng, Yang, Xiao-Ping, Li, Hui-Xue, Zuo, Guo-Fang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2018
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6163230/
https://www.ncbi.nlm.nih.gov/pubmed/30200542
http://dx.doi.org/10.3390/nano8090685

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6163230/
https://www.ncbi.nlm.nih.gov/pubmed/30200542
http://dx.doi.org/10.3390/nano8090685

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