Local Redox Reaction of High Valence Manganese in Li2MnO3-Based Lithium Battery Cathodes

Summary: Li2MnO3 endows Li-rich layered oxides with a superior energy density; however, its electron transfer mechanism is still unclear. Here, the electronic and thermodynamic behavior of LixMnO3 (x = 0.5–2) is determined using first-principles computations. The cationic redox, anionic redox, and l...

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Bibliographic Details
Main Authors: Zihe Zhang, Shu Zhao, Boya Wang, Haijun Yu
Format: Article
Language:English
Published: Elsevier 2020-05-01
Series:Cell Reports Physical Science
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S2666386420300552