Micro-mechanism Influence of Vegetable Oil and Mineral Oil on Thermal Decomposition of Insulating Paper Based on ReaxFF-MD

Xuefeng Hu, Haoxi Cong, Yuxin Wang, Huiming Shao, Qingmin Li, Hu Jin, Changan Lu, Xiaoqing Qi
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Abstract

Compared with mineral oil, vegetable oil has the advantages of high ignition point, high flash point, renewable and easy to degrade, which also plays a better role in the protection of insulating paper. At present, the microscopic mechanism of thermal decomposition of insulating paper is still unclear, and the microscopic influence law of mineral oil and vegetable oil on insulating paper has not been proved. In this paper, molecular dynamics simulations based on the reactive force field (ReaxFF) are performed. The reaction paths and characteristic products of the degradation process of insulating paper are obtained and statistical analysis of the bond breaking probability of pyran rings in insulating paper is carried out. It is found that the first step in the cleavage of insulating paper was the glycosidic bond, followed by the opening of the pyran ring and the cleavage of the hydroxyl group. In addition, the degradation of insulating paper in mineral oil is more severe than that in vegetable oil. The above research revealed the microscopic mechanism of the cracking process of insulating paper, and proposed the influence rule of mineral oil and vegetable oil on insulating paper.
植物油和矿物油对基于ReaxFF-MD的绝缘纸热分解的微观机理影响
与矿物油相比,植物油具有燃点高、闪点高、可再生、易降解等优点,对绝缘纸的保护也起到了更好的作用。目前,绝缘纸热分解的微观机理尚不清楚,矿物油和植物油对绝缘纸的微观影响规律尚未得到证实。本文基于反作用力场(ReaxFF)进行了分子动力学模拟。得到了绝缘纸降解过程的反应路径和特征产物,并对绝缘纸中吡喃环断键概率进行了统计分析。发现绝缘纸的解理首先是糖苷键的解理,其次是吡喃环的打开和羟基的解理。此外,绝缘纸在矿物油中的降解比在植物油中的降解更为严重。上述研究揭示了绝缘纸开裂过程的微观机理,并提出了矿物油和植物油对绝缘纸的影响规律。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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