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Exploring high-energy and mechanically robust anode materials based on doped graphene for lithium-ion batteries: a first-principles study
Title
Exploring high-energy and mechanically robust anode materials based on doped graphene for lithium-ion batteries: a first-principles study
Author
Xu, Jun, Chang, Cheng, Yin, Sha
Date Created
2020
Subjects--Topical
Lithium ion batteries, Mechanical engineering
Description
In this study, the adsorption of Li atoms on various types of doped graphene with substituents, including boron, nitrogen, sulfur and silicon atoms, has been theoretically investigated by first-principles calculations, based on the density functio...