Reactive transport modeling of subsurface environments plays an important role in addressing critical problems of geochemical processes, such as dissolution and precipitation of minerals. Current transport models for porous media span various scales, ranging from pore-scale to continuum-scale. In this study, we established an upscaling method connecting pore-scale and continuum-scale models by employing a deep learning methodology of Convolutional Neural Networks (CNNs). We applied Darcy-Brinkmann-Stokes (DBS) method to simulate the fluid flow and reactive transport in pore-scale models, which would act as constituents of a continuum-scale model. The datasets of spatial pore distribution of subvolume samples were used as the input for the deep learning model, and the continuum (Darcy)-scale parameters such as permeability, effective surface area, and effective diffusion coefficient were figured out as outputs (i.e., labels). By applying the trained models of the subvolumes in the entire sample volume, we generated the initial field of porosity, permeability, effective diffusion coefficient, and effective surface area for continuum-scale simulation of a mineral dissolution problem. We took an acid dissolution case as an example to utilize the outcomes of trained deep learning models as input data in the continuum-scale simulation. This work presents a comprehensive upscaling workflow, as bridging the findings of microscale simulations to the continuum-scale simulations of a reactive transport problem. 
                        more » 
                        « less   
                    
                            
                            Bridging the gap: Connecting pore-scale and continuum-scale simulations for immiscible multiphase flow in porous media
                        
                    
    
            This study aims to bridge length scales in immiscible multiphase flow simulation by connecting two published governing equations at the pore-scale and continuum-scale through a novel validation framework. We employ Niessner and Hassnaizadeh's [“A model for two-phase flow in porous media including fluid-fluid interfacial area,” Water Resour. Res. 44(8), W08439 (2008)] continuum-scale model for multiphase flow in porous media, combined with the geometric equation of state of McClure et al. [“Modeling geometric state for fluids in porous media: Evolution of the Euler characteristic,” Transp. Porous Med. 133(2), 229–250 (2020)]. Pore-scale fluid configurations simulated with the lattice-Boltzmann method are used to validate the continuum-scale results. We propose a mapping from the continuum-scale to pore-scale utilizing a generalized additive model to predict non-wetting phase Euler characteristics during imbibition, effectively bridging the continuum-to-pore length scale gap. Continuum-scale simulated measures of specific interfacial area, saturation, and capillary pressure are directly compared to up-scaled pore-scale simulation results. This research develops a numerical framework capable of capturing multiscale flow equations establishing a connection between pore-scale and continuum-scale simulations. 
        more » 
        « less   
        
    
                            - Award ID(s):
- 2324787
- PAR ID:
- 10589104
- Publisher / Repository:
- American Institute of Physics
- Date Published:
- Journal Name:
- Physics of Fluids
- Volume:
- 36
- Issue:
- 3
- ISSN:
- 1070-6631
- Format(s):
- Medium: X
- Sponsoring Org:
- National Science Foundation
More Like this
- 
            
- 
            Abstract We present a new computational fluid dynamics approach for simulating two‐phase flow in hybrid systems containing solid‐free regions and deformable porous matrices. Our approach is based on the derivation of a unique set of volume‐averaged partial differential equations that asymptotically approach the Navier‐Stokes Volume‐of‐Fluid equations in solid‐free regions and multiphase Biot Theory in porous regions. The resulting equations extend our recently developed Darcy‐Brinkman‐Biot framework to multiphase flow. Through careful consideration of interfacial dynamics (relative permeability and capillary effects) and extensive benchmarking, we show that the resulting model accurately captures the strong two‐way coupling that is often exhibited between multiple fluids and deformable porous media. Thus, it can be used to represent flow‐induced material deformation (swelling, compression) and failure (cracking, fracturing). The model's open‐source numerical implementation,hybridBiotInterFoam, effectively marks the extension of computational fluid mechanics into modeling multiscale multiphase flow in deformable porous systems. The versatility of the solver is illustrated through applications related to material failure in poroelastic coastal barriers and surface deformation due to fluid injection in poro‐visco‐plastic systems.more » « less
- 
            Blunt, MJ (Ed.)Multiphase fluid flow in porous media is important to a wide variety of processes of fundamental scientific and practical importance. Developing a model for the pore space of porous media represents the first step for simulating such flows. With rapid increase in the computation power and advances in instrumentation and imaging processes, it has become feasible to carry out simulation of multiphase flow in two- and three-dimensional images of porous media, hence dispensing with development of models of pore space that are based on approximating their morphology. Image-based simulations are, however, very time consuming. We describe an approach for speeding-up image-based simulation of multiphase flow in porous media based on curvelet transformations, which are specifically designed for processing of images that contain complex curved surfaces. Most porous media contain correlations in their morphology and, therefore, their images carry redundant information that, in the curvelet transform space, can be removed efficiently and accurately in order to obtain a coarser image with which the computations are far less intensive. We utilize the methodology to simulate two-phase flow of oil and water in two-dimensional digital images of sandstone and carbonate samples, and demonstrate that while the results with the curvelet-processed images are as accurate as those with the original ones, the computations are speeded up by a factor of 110–150. Thus, the methodology opens the way toward achieving the ultimate goal of simulation of multiphase flow in porous media, namely, making image-based computations a standard practice.more » « less
- 
            Abstract Dynamic shearing banding and fracturing in unsaturated porous media are significant problems in engineering and science. This article proposes a multiphase micro‐periporomechanics (PPM) paradigm for modeling dynamic shear banding and fracturing in unsaturated porous media. Periporomechanics (PPM) is a nonlocal reformulation of classical poromechanics to model continuous and discontinuous deformation/fracture and fluid flow in porous media through a single framework. In PPM, a multiphase porous material is postulated as a collection of a finite number of mixed material points. The length scale in PPM that dictates the nonlocal interaction between material points is a mathematical object that lacks a direct physical meaning. As a novelty, in the coupled PPM, a microstructure‐based material length scale is incorporated by considering micro‐rotations of the solid skeleton following the Cosserat continuum theory for solids. As a new contribution, we reformulate the second‐order work for detecting material instability and the energy‐based crack criterion and J‐integral for modeling fracturing in the PPM paradigm. The stabilized Cosserat PPM correspondence principle that mitigates the multiphase zero‐energy mode instability is augmented to include unsaturated fluid flow. We have numerically implemented the novel PPM paradigm through a dual‐way fractional‐step algorithm in time and a hybrid Lagrangian–Eulerian meshfree method in space. Numerical examples are presented to demonstrate the robustness and efficacy of the proposed PPM paradigm for modeling shear banding and fracturing in unsaturated porous media.more » « less
- 
            Multiphase flows in porous media are important in many natural and industrial processes. Pore-scale models for multiphase flows have seen rapid development in recent years and are becoming increasingly useful as predictive tools in both academic and industrial applications. However, quantitative comparisons between different pore-scale models, and between these models and experimental data, are lacking. Here, we perform an objective comparison of a variety of state-of-the-art pore-scale models, including lattice Boltzmann, stochastic rotation dynamics, volume-of-fluid, level-set, phase-field, and pore-network models. As the basis for this comparison, we use a dataset from recent microfluidic experiments with precisely controlled pore geometry and wettability conditions, which offers an unprecedented benchmarking opportunity. We compare the results of the 14 participating teams both qualitatively and quantitatively using several standard metrics, such as fractal dimension, finger width, and displacement efficiency. We find that no single method excels across all conditions and that thin films and corner flow present substantial modeling and computational challenges.more » « less
 An official website of the United States government
An official website of the United States government 
				
			 
					 
					
