Theoretical investigations of Li+ and Co3+ positions for layered LiCoO2 Lithium ion battery cathode material using first principle method

There are a few structures available for the layered LiCoO2 cathode materials, with the metals in different atomic positions. In this study, first principles calculations based on density functional theory were used to evaluate two LiCoO2 structures with different Li+ and Co3+ atomic positions. The...

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Bibliographische Detailangaben

Hauptverfasser:	Mustaffa, D. T., Kamarulzaman, N., Taib, M. F. M., Rusdi, R., Ibrahim, A. B.
Format:	Tagungsbericht
Sprache:	eng
Schlagworte:	Cathodes Density functional theory Electrode materials First principles Lithium Lithium compounds Lithium-ion batteries Mathematical analysis Rechargeable batteries
Online-Zugang:	Volltext
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