Dielectric relaxation analysis of asphaltene polarity and aggregation behavior

IF 7.5 1区 工程技术 Q2 ENERGY & FUELS Fuel Pub Date : 2025-03-20 DOI:10.1016/j.fuel.2025.135099
Haotian Wang , Yu Zhang , Jiqian Wang , Zhaoyu Ma , Jun Gao , Longli Zhang
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Abstract

The associative behavior of asphaltenes significantly affects the fluidity of petroleum, which influences petroleum production, transport, and refining processes. However, the existing methods for characterizing associative behavior are complicated. Based on dielectric relaxation theory, the relationship between asphaltene polarity and its associative behavior was elucidated through experimental studies, molecular dynamics simulations. And a novel method for characterizing the association behavior was proposed. Initially, asphaltene was separated from crude oil using polar chromatography columns, and their fundamental physical properties were comprehensively analysed using X-ray diffraction, proton nuclear magnetic resonance, and infrared spectroscopy. This served as a benchmark for comprehending their polar and associative behaviour. Additionally, the runflow time of the adsorption effect of the asphaltene-toluene solution was measured by viscosity method, revealing that the association behavior began to increase within the concentration range of 1 to 3 g/L. Consequently, given that the viscosity method is time-consuming, we propose a novel characterization method based on the dielectric relaxation theory, which is characterized by an impedance analyzer. The spectroscopy showed that, as the logarithm of frequency corresponding to the ratio of dielectric loss to dielectric reserves increases from 1.3 to 2.2, the polarization rate and association behavior of asphaltene in toluene solution also increase. Notably, the concentration range determined using this method aligns with the results obtained from the viscosity method. Finally, the experimental results were theoretically confirmed through molecular dynamics simulations. In conclusion, the easily operable dielectric relaxation spectroscopy provides a viable method for characterizing the associative behavior of asphaltene-toluene solutions.

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沥青质极性和聚集行为的介电弛豫分析
沥青质的结合行为显著影响石油的流动性,从而影响石油的生产、运输和精炼过程。然而,现有的表征联想行为的方法是复杂的。基于介电弛豫理论,通过实验研究和分子动力学模拟,阐明了沥青质极性与其缔合行为之间的关系。提出了一种表征关联行为的新方法。最初,使用极性色谱柱从原油中分离沥青质,并使用x射线衍射、质子核磁共振和红外光谱综合分析其基本物理性质。这是理解它们的极性和联想行为的基准。此外,用粘度法测定了沥青-甲苯溶液吸附效果的运行时间,发现在1 ~ 3 g/L的浓度范围内,缔合行为开始增加。因此,鉴于粘度法耗时长,我们提出了一种基于介电弛豫理论的表征方法,该方法采用阻抗分析仪表征。光谱分析表明,当介质损耗与介质储量之比对应的频率对数从1.3增加到2.2时,沥青质在甲苯溶液中的极化率和缔合行为也随之增加。值得注意的是,用这种方法确定的浓度范围与从粘度法得到的结果一致。最后,通过分子动力学模拟对实验结果进行了理论验证。总之,易于操作的介电弛豫光谱为表征沥青-甲苯溶液的结合行为提供了一种可行的方法。
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来源期刊
Fuel
Fuel 工程技术-工程:化工
CiteScore
12.80
自引率
20.30%
发文量
3506
审稿时长
64 days
期刊介绍: The exploration of energy sources remains a critical matter of study. For the past nine decades, fuel has consistently held the forefront in primary research efforts within the field of energy science. This area of investigation encompasses a wide range of subjects, with a particular emphasis on emerging concerns like environmental factors and pollution.
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