空位缺陷
材料科学
微球
阳极
钠
化学工程
带隙
密度泛函理论
纳米技术
硫代乙酰胺
化学
光电子学
结晶学
物理化学
计算化学
电极
冶金
工程类
生物化学
作者
Jianbiao Wang,Jiajia Huang,Shuping Huang,Hiroo Notohara,Koki Urita,Isamu Moriguchi,Mingdeng Wei
出处
期刊:ACS Sustainable Chemistry & Engineering
[American Chemical Society]
日期:2020-06-02
卷期号:8 (25): 9519-9525
被引量:53
标识
DOI:10.1021/acssuschemeng.0c02535
摘要
SnS2-based materials have been intensively explored as an anode for sodium-ion batteries. In the present study, hierarchical SnS2 microspheres with S vacancy have been successfully synthesized via a one-step solvothermal process, and it is found that the amount of thioacetamide in the synthetic process plays an important role in morphology and amounts of S vacancies. A series of results calculated from density functional theory has indicated that the introduction of S vacancies could effectively decrease the band gap. As a consequence, the hierarchical SnS2 microspheres exhibit an excellent sodium storage performance, and a large capacity of 486.2 mA h g–1 can be achieved after 1000 cycles at 1 A g–1.
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