Computational microfluidics of reactive transport processes with solid dissolution and self-induced multiphase flow

IF 4 2区 环境科学与生态学 Q1 WATER RESOURCES Advances in Water Resources Pub Date : 2024-07-16 DOI:10.1016/j.advwatres.2024.104771
Chuangde Zhang , Li Chen , Xin Sha , Qinjun Kang , Zhenxue Dai , Wen-Quan Tao
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Abstract

There are still many unclear mechanisms in the multiphase reactive flow with solid dissolution processes. In this study, the reactive transport processes coupled with solid dissolution and self-induced multiphase flow in three-dimensional (3D) structures with increasing complexity is studied by developing a 3D computational microfluidic method, which considers multiphase flow, interfacial mass transport, heterogeneous chemical reactions, and solid structure evolution. Solid dissolution diagram in a simple channel in the framework of multiphase flow is proposed, with six coupled multiphase flow and solid dissolution patterns identified and the transition between different patterns discussed. Then, multiphase reactive flow in a porous chip is further studied, and the interesting 3D phenomena are discovered, including enhanced solid dissolution in the middle and enriched bubble generation at the corner along the thickness direction. Considering the importance of reactive surface area, correlations of reactive surface area-porosity-saturation with different dissolution patterns are proposed based on the pore-scale results. Finally, the computational microfluidic model is extended to investigate the multiphase reactive flow in a 3D digital core. Different dissolution patterns are recognized using the local porosity evolution character, and the corresponding pore size distribution and bubble characteristics are deciphered. These findings advance understanding of multiphase reactive transport processes and contribute to improve continuum-scale reactive transport modeling.

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含固体溶解和自诱导多相流的反应传输过程的计算微流体学
在多相反应流与固体溶解过程中,仍有许多机制尚不清楚。本研究通过建立三维计算微流控方法,综合考虑多相流、界面质量输运、异相化学反应和固体结构演化等因素,研究了在复杂度不断增加的三维(3D)结构中与固体溶解和自诱导多相流耦合的反应输运过程。提出了多相流框架下简单通道中的固体溶解图,确定了六种多相流和固体溶解耦合模式,并讨论了不同模式之间的过渡。然后,进一步研究了多孔芯片中的多相反应流,发现了有趣的三维现象,包括沿厚度方向中间的固体溶解增强和角落的气泡生成丰富。考虑到反应表面积的重要性,基于孔隙尺度结果提出了反应表面积-孔隙率-饱和度与不同溶解模式的相关性。最后,将计算微流体模型扩展到研究三维数字岩芯中的多相反应流。利用局部孔隙度演变特征识别了不同的溶解模式,并破译了相应的孔径分布和气泡特征。这些发现加深了对多相反应传输过程的理解,有助于改进连续尺度反应传输模型。
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来源期刊
Advances in Water Resources
Advances in Water Resources 环境科学-水资源
CiteScore
9.40
自引率
6.40%
发文量
171
审稿时长
36 days
期刊介绍: Advances in Water Resources provides a forum for the presentation of fundamental scientific advances in the understanding of water resources systems. The scope of Advances in Water Resources includes any combination of theoretical, computational, and experimental approaches used to advance fundamental understanding of surface or subsurface water resources systems or the interaction of these systems with the atmosphere, geosphere, biosphere, and human societies. Manuscripts involving case studies that do not attempt to reach broader conclusions, research on engineering design, applied hydraulics, or water quality and treatment, as well as applications of existing knowledge that do not advance fundamental understanding of hydrological processes, are not appropriate for Advances in Water Resources. Examples of appropriate topical areas that will be considered include the following: • Surface and subsurface hydrology • Hydrometeorology • Environmental fluid dynamics • Ecohydrology and ecohydrodynamics • Multiphase transport phenomena in porous media • Fluid flow and species transport and reaction processes
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