Abstract: A microstructure is upscaled to generate a coarsened heterogeneous spatial distribution of porosity and a set of porosity dependent constitutive relationships. A three dimensional (3D) microstructure model, bulk material properties, and/or porosity is received for anode, cathode, and separator battery components. A coarsened porosity model with emergent properties is calculated from the battery component microstructures as a function of the porosity. Bruggeman coefficients for each battery component sub region are calculated from the effective ionic conductivity, electric and thermal conductivity, and ionic diffusivity. A heterogeneous mesoscale 3D battery model is created by combining the anode, cathode, and separator materials into a single cell structure and separately partitioning each into coarse voxels to create a 3D model of porosity.

Abstract: Disclosed are computer implemented techniques for conducting a simulation of physical properties of a porous medium. The features include receiving a micro-CT 3D image that captures a representative elemental volume of the porous medium, the porous medium defined as having mineral types and fluid types with individual grains and grain to grain contacts, labeling the micro-CT 3D image as individual voxels according to mineral and fluid types and labeling the mineral type voxels as belonging to separated and fixed individual grains. The features also include transforming the labeled voxels into an unstructured conformal mesh representation for all grains and applying the unstructured conformal mesh representation to a parametric cohesive contact engine, with the parametric cohesive contact engine executing a parametric cohesive contact model that has an adjustable parameter, a critical separation ?0 conditioned according to consolidation level.

Abstract: Embodiments determine behavior of reactive flow systems. One such embodiment defines a plurality of models of the reactive flow system, wherein each defined model represents the reactive flow system at a respective scale. A velocity field for the reactive flow system is determined using a first model, at a first respective scale, of the defined plurality of models and a diffusivity for the reactive flow system is determined using a second model, at a second respective scale, of the defined plurality of models. In turn, a plurality of reaction parameters for the reactive flow system are defined. Then, behavior of the reactive flow system is automatically determined by using the determined velocity field, the determined diffusivity, and the defined plurality of reaction parameters as inputs to a reactive transport solver.

Abstract: A method analyzes physical transport in a proton exchange membrane fuel cell (PEMFC) having three adjacent layers L1, L2, L3, each with a distinct porous structure. A first small scale multiphase simulation S1 of a first portion of the L1/L2 interface is used to characterize the L1/L2 interface. The S1 results are statistically extended to a larger second portion of the L1/L2 interface. The statistically extended L1/L2 interface is used as a boundary condition for a second multiphase simulation S2 to characterize the L2/L3 interface. S1 is repeated using the characterized L2/L3 interface as a boundary condition. S1 and S2 respectively simulate of one or more of momentum, energy, species, and charge transport across the L1/L2 and L2/L3 interface.

Abstract: Disclosed are computer implemented techniques for conducting a simulation of physical properties of a porous medium. The features include receiving a micro-CT 3D image that captures a representative elemental volume of the porous medium, the porous medium defined as having mineral types and fluid types with individual grains and grain to grain contacts, labeling the micro-CT 3D image as individual voxels according to mineral and fluid types and labeling the mineral type voxels as belonging to separated and fixed individual grains. The features also include transforming the labeled voxels into an unstructured conformal mesh representation for all grains and applying the unstructured conformal mesh representation to a parametric cohesive contact engine, with the parametric cohesive contact engine executing a parametric cohesive contact model that has an adjustable parameter, a critical separation ?0 conditioned according to consolidation level.

Abstract: Systems, methods, and computer program products can be used for determining the amount of oil removed by a miscible gas flood. One of the methods includes identifying locations of oil within a volume representing a reservoir rock sample. The method includes identifying locations of gas within the volume. The method also includes determining the amount of oil removed based on locations within the volume where oil is either coincident with the gas or is connected to the gas by a continuous oil path.

Abstract: Systems, methods, and computer program products can be used for visualizing the behavior of flow of two or more fluid phases, wherein a fluid phase behavior is represented in a visualization. One of the methods includes determining an occupation time, which is the amount of elapsed time from when a fluid phase first occupies a particular location until a second time. The method includes generating data for a visualization, with a location in the visualization corresponding to the particular location, and with the generated data for that location in the visualization indicating the occupation time.

Abstract: Disclosed are computer implemented techniques for conducting a fluid simulation of a porous medium. These techniques involve retrieving a representation of a three dimensional porous medium, the representation including pore space corresponding to the porous medium, with the representation including at least one portion of under-resolved pore structure in the porous medium, defining a representative flow model that includes the under-resolved pore structure in the representation, and constructing by the computer system fluid force curves that correspond to fluid forces in the under-resolved pore structure in the representation.

Abstract: Systems, methods, and computer program products can be used for determining the amount of oil removed by a miscible gas flood. One of the methods includes identifying locations of oil within a volume representing a reservoir rock sample. The method includes identifying locations of gas within the volume. The method also includes determining the amount of oil removed based on locations within the volume where oil is either coincident with the gas or is connected to the gas by a continuous oil path.

Abstract: Techniques including methods, apparatus and computer program products are disclosed. These techniques include computer instructions that are encoded on computer storage media for determining wettability. The techniques use a numerical aging computation process to provide a representation of a wettability alteration of a physical rock sample in the presence of at least two fluids is disclosed. The techniques include retrieving a representation of a physical rock sample, the representation including pore space and grain space data corresponding to the physical rock sample, calculating local curvature for each surface in the pore space, determining from the calculated local curvature whether water-film breakage will occur, and classifying the wettability of the physical rock based on the determination of water-film breakage.

Abstract: Systems, methods, and computer program products can be used for determining the amount of oil removed by a miscible gas flood. One of the methods includes identifying locations of oil within a volume representing a reservoir rock sample. The method includes identifying locations of gas within the volume. The method also includes determining the amount of oil removed based on locations within the volume where oil is either coincident with the gas or is connected to the gas by a continuous oil path.

Abstract: Techniques including methods, apparatus and computer program products are disclosed for determining an amount of hydrocarbon recoverable from porous reservoir rock by a miscible gas flood.

Abstract: Systems, methods, and computer program products can be used for determining the amount of oil removed by a miscible gas flood. One of the methods includes identifying locations of oil within a volume representing a reservoir rock sample. The method includes identifying locations of gas within the volume. The method also includes determining the amount of oil removed based on locations within the volume where oil is either coincident with the gas or is connected to the gas by a continuous oil path.

Abstract: Systems, methods, and computer program products can be used for visualizing the behavior of flow of two or more fluid phases, wherein a fluid phase behavior is represented in a visualization. One of the methods includes determining an occupation time, which is the amount of elapsed time from when a fluid phase first occupies a particular location until a second time.

Abstract: Systems, methods, and computer program products can be used for determining the amount of oil removed by a miscible gas flood. One of the methods includes identifying locations of oil within a volume representing a reservoir rock sample. The method includes identifying locations of gas within the volume. The method also includes determining the amount of oil removed based on locations within the volume where oil is either coincident with the gas or is connected to the gas by a continuous oil path.

Abstract: Disclosed are computer implemented techniques for conducting a simulation of physical properties of a porous medium. The features include receiving a micro-CT 3D image that captures a representative elemental volume of the porous medium, the porous medium defined as having mineral types and fluid types with individual grains and grain to grain contacts, labeling the micro-CT 3D image as individual voxels according to mineral and fluid types and labeling the mineral type voxels as belonging to separated and fixed individual grains. The features also include transforming the labeled voxels into an unstructured conformal mesh representation for all grains and applying the unstructured conformal mesh representation to a parametric cohesive contact engine, with the parametric cohesive contact engine executing a parametric cohesive contact model that has an adjustable parameter, a critical separation ?0 conditioned according to consolidation level.

Abstract: Systems, methods, and computer program products can be used for visualizing the behavior of flow of two or more fluid phases, wherein a fluid phase behavior is represented in a visualization. One of the methods includes determining an occupation time, which is the amount of elapsed time from when a fluid phase first occupies a particular location until a second time. The method includes generating data for a visualization, with a location in the visualization corresponding to the particular location, and with the generated data for that location in the visualization indicating the occupation time.

Abstract: Disclosed are computer implemented techniques for conducting a fluid simulation of a porous medium. These techniques involve retrieving a representation of a three dimensional porous medium, the representation including pore space corresponding to the porous medium, with the representation including at least one portion of under-resolved pore structure in the porous medium, defining a representative flow model that includes the under-resolved pore structure in the representation, and constructing by the computer system fluid force curves that correspond to fluid forces in the under-resolved pore structure in the representation.

Abstract: This description relates to computer simulation of physical processes, such as computer simulation of multi-species flow through porous media including the determination/estimation of relative permeabilities for the multi-species flow through the porous media.

Abstract: Techniques including methods, apparatus and computer program products are disclosed for determining an amount of hydrocarbon recoverable from porous reservoir rock by a miscible gas flood.