热力学抑制剂的影响和机器学习模型对水合物形成压力和温度的预测能力的综合综述

IF 2.1 3区 工程技术 Q3 CHEMISTRY, MULTIDISCIPLINARY
Mohammad Amin Behnam Motlagh, , , Rohallah Hashemi*, , , Zahra Taheri Rizi, , , Mohsen Mohammadi, , , Mahbobeh Mohammadtaheri, , and , Behnam Zarei Eslam, 
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引用次数: 0

摘要

天然气水合物的形成给石油和天然气工业带来了挑战,如管道堵塞。该研究评估了热力学抑制剂,包括氨基酸、离子液体、盐和商业抑制剂,使用了213个数据条目,涵盖了压力从0.13到200 MPa,温度从238.15到333.15 K的一系列气体和抑制剂。甘氨酸被认为是最有效的氨基酸抑制剂,特别是当与甲醇结合时。离子液体的缓蚀效率取决于官能团(如OH, NH2)和侧链长度,而像MgCl2这样的盐由于离子电荷密度高而表现良好。甲醇和单乙二醇在高流量系统中仍然有效。采用随机森林(RF)、支持向量机(SVM)、深度神经网络(DNN)和卷积神经网络(CNN)等机器学习模型预测水合物形成条件。该模型对压力的R2为0.96,均方根误差(RMSE)为1.51 MPa;对温度的R2为0.92,RMSE为2.66 K。与基于物理的模型相比,这些机器学习方法在不同成分和抑制剂类型中表现出更好的泛化性,特别是在涉及复杂非线性相互作用的情况下,为优化作业中的水合物控制策略提供了强有力的方法。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Comprehensive Review of the Impact of Thermodynamic Inhibitors and the Predictive Power of Machine Learning Models on Hydrate Formation Pressure and Temperature

Comprehensive Review of the Impact of Thermodynamic Inhibitors and the Predictive Power of Machine Learning Models on Hydrate Formation Pressure and Temperature

Gas hydrate formation presents challenges in the petroleum and gas industry, such as pipeline blockages. This study evaluates thermodynamic inhibitors, including amino acids, ionic liquids, salts, and commercial inhibitors, using 213 data entries covering a range of gases and inhibitors over pressures from 0.13 to 200 MPa and temperatures from 238.15 to 333.15 K. Glycine is identified as the most effective amino acid inhibitor, especially when combined with methanol. The inhibition efficiency of ionic liquids depends on functional groups (e.g., OH, NH2) and side chain lengths, while salts like MgCl2 perform well due to high ionic charge densities. Methanol and monoethylene glycol remain effective in high-flow systems. Machine learning models, including random forest (RF), support vector machines (SVM), deep neural networks (DNN), and convolutional neural networks (CNN), were applied to predict hydrate formation conditions. The RF model showed the best accuracy with an R2 of 0.96 and a root-mean-square error (RMSE) of 1.51 MPa for pressure, and an R2 of 0.92 and an RMSE of 2.66 K for temperature. Compared to physically based models, these machine learning methods demonstrated better generalization across varied compositions and inhibitor types, particularly in cases involving complex nonlinear interactions, offering a powerful approach to optimize hydrate control strategies in operations.

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来源期刊
Journal of Chemical & Engineering Data
Journal of Chemical & Engineering Data 工程技术-工程:化工
CiteScore
5.20
自引率
19.20%
发文量
324
审稿时长
2.2 months
期刊介绍: The Journal of Chemical & Engineering Data is a monthly journal devoted to the publication of data obtained from both experiment and computation, which are viewed as complementary. It is the only American Chemical Society journal primarily concerned with articles containing data on the phase behavior and the physical, thermodynamic, and transport properties of well-defined materials, including complex mixtures of known compositions. While environmental and biological samples are of interest, their compositions must be known and reproducible. As a result, adsorption on natural product materials does not generally fit within the scope of Journal of Chemical & Engineering Data.
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