硫化氢在钠盐水溶液中的溶解度模拟

IF 6.7 2区 环境科学与生态学 Q1 BIOTECHNOLOGY & APPLIED MICROBIOLOGY Environmental Technology & Innovation Pub Date : 2023-08-17 DOI:10.1016/j.eti.2023.103334
Li Sun , Jierong Liang
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引用次数: 0

摘要

准确预测硫化氢在电解质水溶液中的溶解度对于天然气开采和地质储存至关重要。然而,缺乏能够准确计算硫化氢在宽范围的温度、压力和盐摩尔浓度下在电解质水溶液中的溶解度的电解质状态方程模型。本文对硫化氢在纯水和几种钠盐水溶液中的溶解度进行了模拟研究。这项工作中使用的热力学框架是立方+缔合状态方程的电解质版本。通过回归电解质水溶液中的实验溶解度,获得了该模型的温度相关离子-气体二元相互作用参数。模拟结果表明,电解质的立方+缔合状态方程可以令人满意地关联硫化氢在电解质水溶液中在宽温度、压力和盐摩尔浓度范围内的溶解度。对于典型的水-氯化钠-硫化氢体系,该模型可以令人满意地关联气体溶解度,平均相对偏差为6.2%,温度高达593.95K,压力高达32.30MPa,盐摩尔浓度高达6.0mol·kg−1水。此外,还对盐析效应和模型适应性进行了分析和讨论。
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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Solubility modeling of hydrogen sulfide in aqueous sodium salt solutions

Accurate solubility prediction of hydrogen sulfide in aqueous electrolyte solutions is critical for gas exploitation and geological storage. However, there is a lack of electrolyte Equation of State model that can accurately calculate the solubilities of hydrogen sulfide in aqueous electrolyte solutions over wide ranges of temperature, pressure, and salt molality. This work presents a modeling study on the solubilities of hydrogen sulfide in pure water and several aqueous sodium salt solutions. The thermodynamic framework used in this work is an electrolyte version of Cubic-Plus-Association Equation of State. The model’s temperature-dependent ion-gas binary interaction parameters are obtained by regressing the experimental solubilities in the aqueous electrolyte solutions. The modeling results show that the electrolyte Cubic-Plus-Association Equation of State can satisfactorily correlate the solubilities of hydrogen sulfide in aqueous electrolyte solutions over wide ranges of temperature, pressure, and salt molality. For the typical water–sodium chloride–hydrogen sulfide system, the model can satisfactorily correlate the gas solubilities with the mean relative deviation being 6.2%, with the temperature up to 593.95 K, pressure up to 32.30 MPa, and salt molality up to 6.0 molkg−1 water. Moreover, the salting-out effects and model adaptability are analyzed and discussed.

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来源期刊
Environmental Technology & Innovation
Environmental Technology & Innovation Environmental Science-General Environmental Science
CiteScore
14.00
自引率
4.20%
发文量
435
审稿时长
74 days
期刊介绍: Environmental Technology & Innovation adopts a challenge-oriented approach to solutions by integrating natural sciences to promote a sustainable future. The journal aims to foster the creation and development of innovative products, technologies, and ideas that enhance the environment, with impacts across soil, air, water, and food in rural and urban areas. As a platform for disseminating scientific evidence for environmental protection and sustainable development, the journal emphasizes fundamental science, methodologies, tools, techniques, and policy considerations. It emphasizes the importance of science and technology in environmental benefits, including smarter, cleaner technologies for environmental protection, more efficient resource processing methods, and the evidence supporting their effectiveness.
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