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Cited by 248

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Cation−Solvent, Cation−Anion, and Solvent−Solvent Interactions with Electrolyte Solvation in Lithium Batteries

Chen, Xiang, Zhang, Xue–Qiang, Li, Hao–Ran, Zhang, Qiang·2019·Batteries & Supercaps

Abstract

Electrolyte solvation is a fundamental issue that regulates the lithium (Li) ion solvation sheath structure, the formation of cathode/anode−electrolyte interphase, and the plating/stripping behavior of Li ions in working Li batteries. Herein, we probe the cation‐solvent, cation‐anion, and solvent‐solvent interactions under both vacuum and electrolyte conditions through density functional theory calculations. The solvation effects can significantly weaken the aforementioned interactions in electrolytes as well as increase the Li−O/F distances in Li+‐containing complexes. The dissolution behaviour of Li salts in electrolytes was further explored and experimentally validated by dissolving lithium nitrate in different solvents. This work affords a mechanistic understanding of electrolyte microstructure and highlights the significant role of electrolyte solvation in regulating battery performance, affording fruitful insights into emerging electrolyte design for high‐performance batteries.

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Metadata

Authors
Chen, X., Zhang, X., Li, H., & Zhang, Q.
Venue
Batteries & Supercaps
Publisher
Wiley
Published
2019-01-11
Volume
2
Issue
2
Pages
128-131
ISSN
2566-6223 (ISSN-L)
OpenAlex
W2902278684
Cited by
248
References
2
FWCI
5.64
Type
journal article
Language
en
Open access
closed

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CoChat. (2026). Citation check: Cation−Solvent, Cation−Anion, and Solvent−Solvent Interactions with Electrolyte Solvation in Lithium Batteries. https://app.cochat.ai/papers/10.1002/batt.201800118
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Chen, X., Zhang, X., Li, H., & Zhang, Q. (2019). Cation−Solvent, Cation−Anion, and Solvent−Solvent Interactions with Electrolyte Solvation in Lithium Batteries. Batteries & Supercaps. https://doi.org/10.1002/batt.201800118

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