First-principles computational insights into lithium battery cathode materials

Shu Zhao, Boya Wang, Zihe Zhang, Xu Zhang, Shiman He, Haijun Yu

doi:10.1007/s41918-021-00115-5

Electrochemical Energy Reviews >

2022 , Vol. 5 >Issue 1: 1 - 31

DOI: https://doi.org/10.1007/s41918-021-00115-5

First-principles computational insights into lithium battery cathode materials

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1. Institute of Advanced Battery Materials and Devices, Faculty of Materials and Manufacturing, Beijing University of Technology, Beijing, 100124, China;
2. Key Laboratory of Advanced Functional Materials, Ministry of Education, Beijing University of Technology, Beijing, 100124, China

Received date: 2021-02-23

Revised date: 2021-04-14

Online published: 2022-03-14

Supported by

This work was financially supported by the Beijing Natural Science Foundation (JQ19003, KZ202010005007 KZ201910005002) and the National Natural Science Foundation of China (U19A2018, 21875007, 51802009 and 22075007).

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Abstract

First-principles calculations|Cathode materials|Lithium-ion batteries|Anionic redox|Cationic redox

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Shu Zhao, Boya Wang, Zihe Zhang, Xu Zhang, Shiman He, Haijun Yu . First-principles computational insights into lithium battery cathode materials[J]. Electrochemical Energy Reviews, 2022 , 5(1) : 1 -31 . DOI: 10.1007/s41918-021-00115-5

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