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

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]+⋅⋅⋅...

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Bibliographic Details
Main Authors: Zhi-Feng Li, Xiao-Ping Yang, Hui-Xue Li, Guo-Fang Zuo
Format: Article
Language:English
Published: MDPI AG 2018-09-01
Series:Nanomaterials
Subjects:
TD-DFT
metallophilic
modulation
recognition
spectroscopic properties
Online Access:http://www.mdpi.com/2079-4991/8/9/685

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http://www.mdpi.com/2079-4991/8/9/685

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