DFT Investigations of Au<i><sub>n</sub></i> Nano-Clusters Supported on TiO<sub>2</sub> Nanotubes: Structures and Electronic Properties

DFT Investigations of Au<i><sub>n</sub></i> Nano-Clusters Supported on TiO<sub>2</sub> Nanotubes: Structures and Electronic Properties

TiO<sub>2</sub> nanotubes (TiO<sub>2</sub>NTs) are beneficial for photogenerated electron separation in photocatalysis. In order to improve the utilization rate of TiO<sub>2</sub>NTs in the visible light region, an effective method is to use Au<i><sub>...

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Bibliographic Details
Main Authors: Ying Wang, Ge Zhou
Format: Article
Language:English
Published: MDPI AG 2022-04-01
Series:Molecules
Subjects:
DMOL3
TiO<sub>2</sub>-nanotube
Au<i><sub>n</sub></i>
geometries
electronic properties
Online Access:https://www.mdpi.com/1420-3049/27/9/2756

Internet

https://www.mdpi.com/1420-3049/27/9/2756

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