材料科学
电化学
空位缺陷
离子
密度泛函理论
电极
三元运算
解吸
化学工程
吸附
纳米技术
物理化学
结晶学
计算化学
有机化学
工程类
化学
计算机科学
程序设计语言
作者
Youcun Bai,Heng Zhang,Huijun Song,Chong Zhu,Lijin Yan,Qin Hu,Chang Ming Li
出处
期刊:Nano Energy
[Elsevier]
日期:2023-11-17
卷期号:120: 109090-109090
被引量:8
标识
DOI:10.1016/j.nanoen.2023.109090
摘要
In this work, a novel stainless-steel (SS) supported lattice-mismatched V-S-Se layered compound (VSySe2−x-SS) with high selenium (Se) vacancy was synthesized by tailoring the molar ratio of S to Se. The difference between the radii of Se and S results in lattice mismatches for a large number of Se vacancies, and the highest vacancy with the ultrafast zinc (Zn) storage performance are achieved by tuning a molar ratio of sulfur (S) to Se. More interestingly, with the introduction of Se vacancies, additional redox peaks of S appear, and creates more mass-transport channels as well as active sites for Zn2+ toward fast reaction kinetics. Density functional theory (DFT) calculations confirm that the Se defects can also effectively reduce the adsorption energy of Zn2+ ions on VS0.5Se2−x-SS for more reversible adsorption/desorption process of Zn2+ ions. Consequently, the specific capacity of the VS0.5Se2−x-SS electrode is as high as 188.1 mAh g−1 after 70 cycles at 0.6 A g−1, while accomplishing an excellent rate capability and satisfactory cycle stability. In addition, an assembled flexible quasi-solid state VS0.5Se2−x-SS//Zn battery also display good cycle stability, excellent electrochemical performance, and good environmental adaptability under different malignant environments including bending, soaking, hammering, weighing, washing and cutting. This work demonstrates a facile approach for electrode modifications used in Zn2+ ion batteries, holding great promise for practical applications and shedding lights on fundamentals of defects effects on battery performance.
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