{"title":"Learning and predicting dynamics of compositional multiphase mixtures using Graph Neural Networks","authors":"Duc Thach Son Vu, Tan M. Nguyen, Weiqing Ren","doi":"10.1016/j.jcp.2025.113851","DOIUrl":null,"url":null,"abstract":"<div><div>In this paper, we investigate the time evolution of compositional multiphase flows in porous media using Graph Neural Networks (GNN). A recent approach to this problem is the unified formulation introduced by Lauser et al. (2011) <span><span>[2]</span></span>, which incorporates the complementarity conditions. The advantage of this formulation is its ability to automatically handle the appearance and disappearance of phases. To solve the system of equations numerically, Ben Gharbia and Flauraud (2019) <span><span>[13]</span></span> employed the Newton-min method. More recently, Vu et al. (2021) <span><span>[14]</span></span> proposed a new strategy called NPIPM (NonParametric Interior-Point Method). However, these existing methods still face challenges, particularly with convergence when using large time steps during iterations. Inspired by the relationships between a cell and its neighborhood cells in the mesh when applying the finite volume method (FVM) to solve the problem, we recognize that these connections can be represented as a graph of nodes and edges in a Graph Neural Network. This GNN approach provides a promising framework for predicting long-term phenomena in porous media flows, especially when integrated into a hybrid algorithm along with other numerical solvers.</div></div>","PeriodicalId":352,"journal":{"name":"Journal of Computational Physics","volume":"529 ","pages":"Article 113851"},"PeriodicalIF":3.8000,"publicationDate":"2025-02-18","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Computational Physics","FirstCategoryId":"101","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0021999125001342","RegionNum":2,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS","Score":null,"Total":0}
引用次数: 0
Abstract
In this paper, we investigate the time evolution of compositional multiphase flows in porous media using Graph Neural Networks (GNN). A recent approach to this problem is the unified formulation introduced by Lauser et al. (2011) [2], which incorporates the complementarity conditions. The advantage of this formulation is its ability to automatically handle the appearance and disappearance of phases. To solve the system of equations numerically, Ben Gharbia and Flauraud (2019) [13] employed the Newton-min method. More recently, Vu et al. (2021) [14] proposed a new strategy called NPIPM (NonParametric Interior-Point Method). However, these existing methods still face challenges, particularly with convergence when using large time steps during iterations. Inspired by the relationships between a cell and its neighborhood cells in the mesh when applying the finite volume method (FVM) to solve the problem, we recognize that these connections can be represented as a graph of nodes and edges in a Graph Neural Network. This GNN approach provides a promising framework for predicting long-term phenomena in porous media flows, especially when integrated into a hybrid algorithm along with other numerical solvers.
期刊介绍:
Journal of Computational Physics thoroughly treats the computational aspects of physical problems, presenting techniques for the numerical solution of mathematical equations arising in all areas of physics. The journal seeks to emphasize methods that cross disciplinary boundaries.
The Journal of Computational Physics also publishes short notes of 4 pages or less (including figures, tables, and references but excluding title pages). Letters to the Editor commenting on articles already published in this Journal will also be considered. Neither notes nor letters should have an abstract.