Concentration Effect of Fluoroethylene Carbonate on the Formation of Solid Electrolyte Interphase Layer in Sodium-Ion Batteries

被引:83
作者
Bouibes, Amine [1 ]
Takenaka, Norio [1 ,2 ]
Fujie, Takuya [1 ]
Kubota, Kei [2 ,3 ]
Komaba, Shinichi [2 ,3 ]
Nagaoka, Masataka [1 ,2 ,4 ]
机构
[1] Nagoya Univ, Grad Sch Informat, Chikusa Ku, Nagoya, Aichi 4648601, Japan
[2] Kyoto Univ, ESICB, Nishikyo Ku, Kyoto 6158520, Japan
[3] Tokyo Univ Sci, Dept Appl Chem, Shinjuku Ku, 1-3 Kagurazaka, Tokyo 1628601, Japan
[4] Japan Sci & Technol Agcy, Core Res Evolut Sci & Technol, Kawaguchi, Saitama 3320012, Japan
关键词
Na-ion battery; FEC additive concentration; SEI film; hybrid MC/MD reaction method; Red Moon method; MC/MD REACTION METHOD; MECHANICAL-PROPERTIES; NEGATIVE ELECTRODES; MOLECULAR-DYNAMICS; ETHYLENE CARBONATE; SURFACE-LAYER; HARD-CARBON; AB-INITIO; GRAPHITE; FILM;
D O I
10.1021/acsami.8b07530
中图分类号
TB3 [工程材料学];
学科分类号
0805 ; 080502 ;
摘要
Fluoroethylene carbonate (FEC) is an effective additive to improve the performance of Na-ion batteries (NIB). A recent experimental study has shown that a small amount of FEC enhances the NIB performance, whereas increasing the FEC amount deteriorates the performance. Toward understanding the microscopic mechanism of this observation, the dependency of the solid electrolyte interphase (SEI) film formation on the FEC concentration has been investigated in a propylene carbonate (PC)-based electrolyte solution by using the Red Moon method. This method was able to reproduce successfully the experimental observations where a small amount of FEC makes SEI film stable. Further, the increase in FEC amounts decreased the stability of the SEI film and should lead to the decrease in the NIB lifetime during charge-discharge cycles. It was revealed that this is because of the insufficient organic dimer formation between the monomer products at the higher FEC concentration. Finally, it was reconfirmed theoretically that the appropriate adjustment of FEC additive amount is essential to develop the high-performance of NIB.
引用
收藏
页码:28525 / 28532
页数:8
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