Molecular Simulation on a New Type of Two-Element Mixed Natural Ester Insulating Oil with Upgraded Fluidity and Oxidative Stability

Natural ester is an environmentally friendly insulating medium, which is regarded as a potential alternative to mineral oil. Improving the fluidity and oxidative stability of natural ester is essential for its application in power equipment. Mixed modification can ameliorate the performance shortcomings of natural esters and, in comparison to methods such as nanomodification or antioxidants, it does not suffer from issues like agglomeration or environmental contamination. Therefore, the best-modified short-chain saturated triglyceride is selected by molecular dynamics, and then the oxidative stability of the mixed-insulating oil is evaluated by quantum chemistry. Results exhibit that glyceryl triacetate has the best viscosity-reducing effect, which can improve the free volume and diffusion ability of the mixed-insulating oil and decrease the entanglement and friction between the carbon chains of the oil molecules. DFT calculations indicate that the oxidative stability of mixed insulating oil can be improved with glyceryl triacetate. This study can contribute to the development of high-performance insulating oil for power equipment by providing theoretical references and computational support.

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Journal
ACS Omega
Published
2025-04-18
DOI
https://doi.org/10.1021/acsomega.5c00119
Primary Topic
Petroleum Processing and Analysis
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article
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article

Molecular Simulation on a New Type of Two-Element Mixed Natural Ester Insulating Oil with Upgraded Fluidity and Oxidative Stability

Dexu Zou, Jingyi Yan, Weiju Dai, Chao Tang et al.
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ACS Omega
Petroleum Processing and Analysis
article

Molecular Simulation on a New Type of Two-Element Mixed Natural Ester Insulating Oil with Upgraded Fluidity and Oxidative Stability

Dexu Zou, Jingyi Yan, Weiju Dai, Chao Tang, He Sun
article en

Abstract

Natural ester is an environmentally friendly insulating medium, which is regarded as a potential alternative to mineral oil. Improving the fluidity and oxidative stability of natural ester is essential for its application in power equipment. Mixed modification can ameliorate the performance shortcomings of natural esters and, in comparison to methods such as nanomodification or antioxidants, it does not suffer from issues like agglomeration or environmental contamination. Therefore, the best-modified short-chain saturated triglyceride is selected by molecular dynamics, and then the oxidative stability of the mixed-insulating oil is evaluated by quantum chemistry. Results exhibit that glyceryl triacetate has the best viscosity-reducing effect, which can improve the free volume and diffusion ability of the mixed-insulating oil and decrease the entanglement and friction between the carbon chains of the oil molecules. DFT calculations indicate that the oxidative stability of mixed insulating oil can be improved with glyceryl triacetate. This study can contribute to the development of high-performance insulating oil for power equipment by providing theoretical references and computational support.

ACS OmegaVol. 10(16)
Electric Power Research Institute (US), Southwest University (CN), AAA College of Engineering and Technology
Openalex Percentile: Top 92%
Petroleum Processing and Analysis
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Molecular Simulation on a New Type of Two-Element Mixed Natural Ester Insulating Oil with Upgraded Fluidity and Oxidative Stability — Dexu Zou, Jingyi Yan, et al. · ACS Omega (2025) | TGRS Research Map | TGRS