Electronic-Structures Calculations of Calcium-Intercalated Bilayer Graphene: A First-Principle Study

In this study, electronic structure calculations of Ca-intercalated bilayer graphene are conducted using the density functional theory (DFT). We modeled two configurations by positioning calcium in the middle of the bilayer (M-site) and on top of the bilayer surface (T-site). Our results show that t...

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书目详细资料
Main Authors: Hidayati, Sri, Santoso, Iman, Yunitasari, Sefty, Sholihun, Sholihun
格式: 文件
语言:English
出版: Chemistry Department, Universitas Gadjah Mada, Indonesia 2022
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在线阅读:https://repository.ugm.ac.id/278885/1/Hidayati_MIPA.pdf