Xiaohe Ren , Mengxuan Sun , Ziwei Gan , Yongxiu Sun , Nengze Wang , Lei Hu , Zongkai Yan , Chunyang Jia , Zhijie Li
{"title":"三重工程技术推动高性能风琴状氧化钒在水性锌离子电池中的应用","authors":"Xiaohe Ren , Mengxuan Sun , Ziwei Gan , Yongxiu Sun , Nengze Wang , Lei Hu , Zongkai Yan , Chunyang Jia , Zhijie Li","doi":"10.1016/j.cej.2024.152994","DOIUrl":null,"url":null,"abstract":"<div><p>Vanadium oxide is one of promising cathode materials for aqueous zinc-ion batteries (ZIBs), but the low electrical conductivity and slow ion diffusion kinetics of vanadium oxide lead to low practical capacity and poor cycling life, which limits further commercialization development. Herein, this study proposes a triple engineering strategy of N-doping, oxygen vacancies and crystal water to achieve the high-performance of V<sub>2</sub>O<sub>5</sub> by a simple stirring method. N doping can improve the electrical conductivity of the materials, oxygen vacancies can modulate the electronic structure, and the crystal water can effectively shield the electrostatic effect. First-principles calculations confirmed that the incorporation of the triple engineering strategies can effectively reduce of the energy band gap and Zn<sup>2+</sup> diffusion barrier of V<sub>2</sub>O<sub>5</sub>, and promote the intercalation dynamics of Zn<sup>2+</sup>. As a result, the prepared N-doped V<sub>2</sub>O<sub>5-x</sub>·nH<sub>2</sub>O achieves an outstanding specific capacity of 607.74 mAh/g at 0.1 A/g, and cycling stability. Moreover, based on the above advantages, the practical 21700-type cylindrical battery assembled with this N-doped V<sub>2</sub>O<sub>5-x</sub>·nH<sub>2</sub>O cathode and Zn foil anode, presenting a maximum capacity of 393.5 mAh at 0.4 A. This high performance of vanadium oxide cathode shows a good practical prospect in aqueous cylindrical ZIBs.</p></div>","PeriodicalId":270,"journal":{"name":"Chemical Engineering Journal","volume":"494 ","pages":"Article 152994"},"PeriodicalIF":13.3000,"publicationDate":"2024-06-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Triple engineering boosts high-performance accordion-like vanadium oxide for practical aqueous zinc-ion batteries\",\"authors\":\"Xiaohe Ren , Mengxuan Sun , Ziwei Gan , Yongxiu Sun , Nengze Wang , Lei Hu , Zongkai Yan , Chunyang Jia , Zhijie Li\",\"doi\":\"10.1016/j.cej.2024.152994\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>Vanadium oxide is one of promising cathode materials for aqueous zinc-ion batteries (ZIBs), but the low electrical conductivity and slow ion diffusion kinetics of vanadium oxide lead to low practical capacity and poor cycling life, which limits further commercialization development. Herein, this study proposes a triple engineering strategy of N-doping, oxygen vacancies and crystal water to achieve the high-performance of V<sub>2</sub>O<sub>5</sub> by a simple stirring method. N doping can improve the electrical conductivity of the materials, oxygen vacancies can modulate the electronic structure, and the crystal water can effectively shield the electrostatic effect. First-principles calculations confirmed that the incorporation of the triple engineering strategies can effectively reduce of the energy band gap and Zn<sup>2+</sup> diffusion barrier of V<sub>2</sub>O<sub>5</sub>, and promote the intercalation dynamics of Zn<sup>2+</sup>. As a result, the prepared N-doped V<sub>2</sub>O<sub>5-x</sub>·nH<sub>2</sub>O achieves an outstanding specific capacity of 607.74 mAh/g at 0.1 A/g, and cycling stability. Moreover, based on the above advantages, the practical 21700-type cylindrical battery assembled with this N-doped V<sub>2</sub>O<sub>5-x</sub>·nH<sub>2</sub>O cathode and Zn foil anode, presenting a maximum capacity of 393.5 mAh at 0.4 A. 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引用次数: 0
摘要
氧化钒是很有前景的水性锌离子电池(ZIBs)正极材料之一,但氧化钒的低导电性和缓慢的离子扩散动力学导致其实际容量低、循环寿命短,从而限制了其进一步商业化发展。在此,本研究提出了掺杂 N、氧空位和晶体水的三重工程策略,通过简单的搅拌方法实现 V2O5 的高性能。掺杂 N 可以提高材料的导电性,氧空位可以调节电子结构,而晶体水则可以有效屏蔽静电效应。第一性原理计算证实,三重工程策略的加入能有效降低 V2O5 的能带隙和 Zn2+ 扩散阻垒,促进 Zn2+ 的闰化动力学。因此,所制备的掺杂 N 的 V2O5-x-nH2O 在 0.1 A/g 时的比容量达到了 607.74 mAh/g,而且循环稳定性极佳。此外,基于上述优点,用这种掺杂 N 的 V2O5-x-nH2O 阴极和锌箔阳极组装的实用 21700 型圆柱电池在 0.4 A 时的最大容量为 393.5 mAh。
Vanadium oxide is one of promising cathode materials for aqueous zinc-ion batteries (ZIBs), but the low electrical conductivity and slow ion diffusion kinetics of vanadium oxide lead to low practical capacity and poor cycling life, which limits further commercialization development. Herein, this study proposes a triple engineering strategy of N-doping, oxygen vacancies and crystal water to achieve the high-performance of V2O5 by a simple stirring method. N doping can improve the electrical conductivity of the materials, oxygen vacancies can modulate the electronic structure, and the crystal water can effectively shield the electrostatic effect. First-principles calculations confirmed that the incorporation of the triple engineering strategies can effectively reduce of the energy band gap and Zn2+ diffusion barrier of V2O5, and promote the intercalation dynamics of Zn2+. As a result, the prepared N-doped V2O5-x·nH2O achieves an outstanding specific capacity of 607.74 mAh/g at 0.1 A/g, and cycling stability. Moreover, based on the above advantages, the practical 21700-type cylindrical battery assembled with this N-doped V2O5-x·nH2O cathode and Zn foil anode, presenting a maximum capacity of 393.5 mAh at 0.4 A. This high performance of vanadium oxide cathode shows a good practical prospect in aqueous cylindrical ZIBs.
期刊介绍:
The Chemical Engineering Journal is an international research journal that invites contributions of original and novel fundamental research. It aims to provide an international platform for presenting original fundamental research, interpretative reviews, and discussions on new developments in chemical engineering. The journal welcomes papers that describe novel theory and its practical application, as well as those that demonstrate the transfer of techniques from other disciplines. It also welcomes reports on carefully conducted experimental work that is soundly interpreted. The main focus of the journal is on original and rigorous research results that have broad significance. The Catalysis section within the Chemical Engineering Journal focuses specifically on Experimental and Theoretical studies in the fields of heterogeneous catalysis, molecular catalysis, and biocatalysis. These studies have industrial impact on various sectors such as chemicals, energy, materials, foods, healthcare, and environmental protection.