Influence of sorbitol as a green and inexpensive corrosion inhibitor for Al-air batteries: An experimental and theoretical study

IF 13.3 1区 工程技术 Q1 ENGINEERING, CHEMICAL
Lili Li, Yiwen Zhu, Liping Xiong, Zhongyi He, Yaoxuan Zhang
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Abstract

The Al-air battery (AAB) is a promising new energy source as an effective supplement to existing energy sources. However, hydrogen evolution reaction (HER) severely limits their application and development. In this paper, an inexpensive green additive, sorbitol, is introduced, and its inhibition effect on HER and its inhibition principle is investigated in experiments, quantum chemistry calculations and molecular dynamics (MD) simulations. The electrochemical experimental results show that the corrosion inhibition efficiency of sorbitol to pure Al anode significantly increases with increasing concentration of sorbitol, which is up to 54.2 % and 90.16 % with 20 % and 30 % sorbitol, respectively. It is calculated that, in the 4 mol/L NaOH solution with 20 % sorbitol, the capacity density and energy density of AAB significantly increase by 171.4 % and 147.4 %, respectively. This work demonstrates that sorbitol can form a strong hydrogen bond (H-bond) network with water molecules, which can reduce the activity of water and the hydrogen evolution of Al anode. Compared with glycerol and inositol, which possesses the same number of hydroxyl (–OH) groups, sorbitol presents the highest comprehensive HER resistance and battery performance, indicating that molecular backbone length of inhibitor can effectively influence the inhibition properties.

Abstract Image

山梨醇作为一种绿色、廉价的铝空气电池缓蚀剂的影响:实验和理论研究
作为现有能源的有效补充,铝空气电池(AAB)是一种前景广阔的新能源。然而,氢进化反应(HER)严重限制了其应用和发展。本文介绍了一种廉价的绿色添加剂山梨醇,并通过实验、量子化学计算和分子动力学(MD)模拟研究了其对氢进化反应的抑制作用及其抑制原理。电化学实验结果表明,山梨醇对纯铝阳极的缓蚀效率随着山梨醇浓度的增加而显著提高,山梨醇浓度为 20% 和 30% 时,缓蚀效率分别达到 54.2% 和 90.16%。据计算,在含有 20% 山梨醇的 4 mol/L NaOH 溶液中,AAB 的容量密度和能量密度分别大幅提高了 171.4% 和 147.4%。这项研究表明,山梨醇能与水分子形成强氢键(H-bond)网络,从而降低水的活性和铝阳极的氢进化。与具有相同数量羟基(-OH)的甘油和肌醇相比,山梨醇的抗氢化反应综合能力和电池性能最高,这表明抑制剂的分子骨架长度能有效影响抑制性能。
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来源期刊
Chemical Engineering Journal
Chemical Engineering Journal 工程技术-工程:化工
CiteScore
21.70
自引率
9.30%
发文量
6781
审稿时长
2.4 months
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.
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