Study on the Li1-xNi0.5Mn1.5O4 for Lithium Ion Batteries: a First-Principles Theory

The crystal structure, voltage and capacity of Li1-xNi0.5Mn1.5O4 were studied by using the first principle theory. The results show that the structure of Li1-xNi0.5Mn1.5O4 has changed, and the lattice parameter decreased from 8.342 Å to 8.247 Å with the decrease of Li content. But the change in each...

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Detalhes bibliográficos

Principais autores:	Haiyan Chen, Lingxiao Lan, Meihong Huang, Xinghua Liang, Yuchao Zhao, Fawei Tang
Formato:	Artigo
Idioma:	Inglês
Publicado em:	Elsevier 2017-12-01
Colecção:	International Journal of Electrochemical Science
Assuntos:	Li1-xNi0.5Mn1.5O4 first-principles formation energy delithiated
Acesso em linha:	http://www.sciencedirect.com/science/article/pii/S1452398123148851
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