Ab Initio Modeling of Electrolyte Molecule Ethylene Carbonate Decomposition Reaction on Li(Ni,Mn,Co)O2 Cathode Surface

Electrolyte decomposition reactions on Li-ion battery electrodes contribute to the formation of solid electrolyte interphase (SEI) layers. These SEI layers are one of the known causes for the loss in battery voltage and capacity over repeated charge/discharge cycles. In this work, density functional...

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Veröffentlicht in:	ACS applied materials & interfaces 2017-06, Vol.9 (24), p.20545-20553
Hauptverfasser:	Xu, Shenzhen, Luo, Guangfu, Jacobs, Ryan, Fang, Shuyu, Mahanthappa, Mahesh K, Hamers, Robert J, Morgan, Dane
Format:	Artikel
Sprache:	eng
Online-Zugang:	Volltext
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