Effects of Defects and Doping on an Al Atom Adsorbed on Graphene: A First-Principles Investigation

In order to enhance the interaction between an Al atom and graphene in graphene-reinforced aluminum-based composites, the method of first-principles calculation was used to investigate the adsorption behavior of Al atoms on graphene. Our calculations indicate that defective and doped graphene are en...

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Bibliographic Details
Main Authors: Xiaoshuang Dai, Tao Shen, Jiaojiao Chen, Hongchen Liu
Format: Article
Language:English
Published: MDPI AG 2020-02-01
Series:Coatings
Subjects:
Online Access:https://www.mdpi.com/2079-6412/10/2/131