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DOE OSTI2022

Crust and Upper Mantle Structure Beneath the Eastern United States

Abstract The Eastern United States (EUS) has a complex geological history and hosts several seismic active regions. We investigate the subsurface structure beneath the broader EUS. To produce reliable images of the subsurface, we simultaneously invert smoothed P‐wave receiver functions, Rayleigh‐wave phase and group velocity measurements, and Bouguer gravity observations for the 3D shear‐wave speed. Using surface‐wave observations (3–250 s) and spatially smoothed receiver functions, our velocity models are robust, reliable, and rich in detail. The shear‐wave velocity models fit all three types of observations well. The resulting velocity model for the eastern U.S. shows thinner crust beneath New England, the east coast, and the Mississippi Embayment (ME). A relatively thicker crust was found beneath the stable North America craton. A relatively slower upper mantle was imaged beneath New England, the east coast, and western ME. A comparison of crust thickness derived from our model against four recent published models shows first‐order consistency. A relatively small upper mantle low‐speed region correlates with a published P‐wave analysis that has associated the anomaly with a 75 Ma kimberlite volcanic site in Kentucky. We also explored the relationship between the subsurface structure and seismicity in the eastern U.S. We found that earthquakes often locate near regions with seismic velocity variations, but not universally. Not all regions of significant subsurface wave speed changes are loci of seismicity. A weak correlation between upper mantle shear velocity and earthquake focal mechanism has been observed.

58 GEOSCIENCES↗

DOE OSTI2023

2D Seismic Surveys as an Alternative for CO 2 Monitoring in the North Dakota CarbonSAFE Project

Conference presentation for International Meeting for Applied Geoscience & Energy (IMAGE), Houston, TX, August 28 – September 1, 2023. As part of the North Dakota CarbonSAFE project, seismic, controlled-source electromagnetic, and microgravity baseline monitoring surveys were collected to assess the safe, permanent, commercial-scale geologic storage of CO 2 generated by the Milton R. Young coal-fired power plant. Data from five 2D seismic lines were assessed as an alternative to 3D seismic for CO 2 monitoring. 2D and 3D surveys were compared using wave equation-based (WEB)-AVO inversion. The encouraging WEB-AVO results demonstrated that 2D surveys could be included in CO 2 monitoring programs as a cost-effective method.

20 FOSSIL-FUELED POWER PLANTS↗

DOE OSTI2019

Comprehensive study of the interactions between the critical dimensionless numbers associated with multiphase flow in 3D porous media

Multiphase flow in porous media is of signifcant interest in many engineering applications, such as geologic carbon sequestration, enhanced oil recovery, and groundwater contamination and remediation. In order to advance the fundamental understanding of multiphase flow in complex three-dimensional (3D) porous media, the interactions between the critical dimensionless numbers, including the contact angle, viscosity ratio, and capillary (Ca) number, were explored using X-ray micro-computed tomography (micro-CT) scanning and lattice Boltzmann (LB) modeling. In this study, the 3D pore structure information was extracted from micro-CT images and then used as interior boundary conditions of flow modeling in a pore-scale LB simulator to simulate multiphase flow within the pore space. A Berea sandstone sample was scanned and then two-phase flow LB simulations were performed based on the micro-CT images. The LB-simulated water/CO 2 distributions agreed well with the micro-CT scanned images. Simulation findings showed that a decreasing contact angle causes a decrease in wetting-fluid relative permeability and an increase in non-wetting fluid relative permeability. A rising Ca number increases both wetting and non-wetting fluid relative permeabilities. An increasing viscosity ratio (the ratio of non-wetting fluid viscosity to wetting fluid viscosity) facilitates the increase of non-wetting fluid relative permeability and mitigates the reduction of wetting fluid relative permeability, when the contact angle decreases continuously. The primary novel finding of this study is that the viscosity ratio affects the rate of change of the relative permeability curves for both phases when the contact angle changes continuously. To date, we believe it is the first time that comprehensive interactions between these dimensionless numbers are demonstrated in a sandstone sample based on real 3D structures. We also investigated the role of the changes of flow direction and sample location on relative permeability curves. Simulation results showed that the change in non-wetting fluid relative permeability was larger when the flow direction was switched from vertical to horizontal, which indicated that there was stronger anisotropy in larger pore networks that were primarily occupied by the non-wetting fluid.

42 ENGINEERING↗

DOE OSTI2023

Estimation of hydraulic conductivity in a watershed using sparse multi-source data via Gaussian process regression and Bayesian experimental design

Enhanced water management systems depend on accurate estimation of subsurface hydraulic properties. However, geologic formations can vary significantly, so information from a single source (e.g., widely spaced boreholes) is insufficient in characterizing subsurface aquifer properties. Therefore, multiple sources of information are needed to complement the hydrogeology understanding of a region. Here, this study presents a numerical framework in which information from different measurement sources is combined to characterize the 3D random field in a multi-fidelity prediction model. Coupled with the model, a Bayesian experimental design was used to determine the best future sampling locations. The Upper Sangamon watershed in east-central Illinois was selected as the case study site, where the multi-fidelity Gaussian process model was used to estimate the hydraulic conductivity in the region of interest. Multi-source observation data were obtained from electrical resistivity and borehole pumping tests. The accuracy of the model prediction is dependent on the locations and the distribution of both high- and low-fidelity data. Furthermore, the multi-fidelity model was compared with the single-fidelity model. The uncertainties and confidence in the measurements and parameter estimates were quantified and used to design future cycles of data collection to further improve the confidence intervals.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2017

Coupling LaGrit unstructured mesh generation and model setup with TOUGH2 flow and transport: A case study

Furthermore, there are many applications in science and engineering modeling where an accurate representation of a complex model geometry in the form of a mesh is important. In applications of flow and transport in subsurface porous media, this is manifest in models that must capture complex geologic stratigraphy, structure (faults, folds, erosion, deposition) and infrastructure (tunnels, boreholes, excavations). Model setup, defined as the activities of geometry definition, mesh generation (creation, optimization, modification, refine, de-refine, smooth), assigning material properties, initial conditions and boundary conditions requires specialized software tools to automate and streamline the process. In addition, some model setup tools will provide more utility if they are designed to interface with and meet the needs of a particular flow and transport software suite. A control volume discretization that uses a two point flux approximation is for example most accurate when the underlying control volumes are 2D or 3D Voronoi tessellations. In this paper we will present the coupling of LaGriT, a mesh generation and model setup software suite and TOUGH2 to model subsurface flow problems and we show an example of how LaGriT can be used as a model setup tool for the generation of a Voronoi mesh for the simulation program TOUGH2. To generate the MESH file for TOUGH2 from the LaGriT output a standalone module Lagrit2Tough2 was developed, which is presented here and will be included in a future release of LaGriT. Here in this paper an alternative method to generate a Voronoi mesh for TOUGH2 with LaGriT is presented and thanks to the modular and command based structure of LaGriT this method is well suited to generating a mesh for complex models.

58 GEOSCIENCES↗

DOE OSTI2023

CCUS Plume Monitoring: Verifying Surface CSEM Measurements to Log Scale Available

Conference presentation at Society of Petrophysicists and Well Log Analysts (SPWLA) 64th Annual Symposium, Lake Conroe, Texas, June 10–14, 2023. In carbon capture, utilization, and storage (CCUS) monitoring, dynamic plume monitoring and reservoir seal are key issues. Plume monitoring is best addressed with electromagnetics (sensitive to the resistivity contrast) and reservoir leakage with microseismics. A case history from North Dakota illustrates how we can tie surface-controlled source electromagnetic (CSEM) measurements to the three-dimensional (3D) anisotropic models derived from the available logs. This allows us to certify baseline measurements within the context of the borehole information.

20 FOSSIL-FUELED POWER PLANTS↗

DOE OSTI2022

3D Simulations of gas injection on callovo-oxfordian claystone assuming spatial heterogeneity and anisotropy

A series of gas injection tests on Callovo-Oxfordian (COx) claystone from the Bure underground research laboratory (URL) in France were carried out at the British Geological Survey (BGS). The tests were performed using a triaxial apparatus specifically designed to capture small volumetric strains induced by the injected gas flow and consequent material dilatancy. The long-duration experiments were monitored throughout. Measurements also included pressure, stresses (axial and radial stresses prescribed for each test stage), rate of gas inflow, gas outflow volume as well as pore-pressures observed at various points of the sample. A coupled hydro-gas-mechanical 3D numerical model has been developed to simulate the tests. Initial permeability is assumed heterogeneous throughout the specimen and embedded fractures are incorporated in the formulation. Gas pressure-induced deformations during the test lead to variations of permeability due to changes in matrix porosity and, especially, fracture aperture as well as fracture orientation due to material anisotropy. A programme of sensitivity analyses involving the variation of different aspects and parameters of the model contributes to a better understanding of the phenomena and highlights its complexity. The model is able to reproduce the observed behaviour of the tests.

58 GEOSCIENCES↗

DOE OSTI2026

One Earth Energy Seismic Interpretation

The objectives of the Illinois Storage Corridor (ISC) project are to accelerate commercial deployment of carbon capture utilization and storage at two individual sites and receive approvals for Underground Injection Control (UIC) Class VI permits for construction at each site (ISC Project Narrative, 2020). As part of this project, and as part of the subsurface geologic characterization, 2D seismic data was acquired at both sites. This report summarizes the findings from the 2D and 3D seismic interpretation at the One Earth Energy site near Gibson City, Illinois. The seismic data confirms the stratigraphic continuity of the Mt. Simon Arkose Zone storage interval and the Eau Claire confining unit across the project area. The seismic data also indicates that there are faults that transect the Mt. Simon Arkose Zone Sandstone storage reservoir within the modeled CO 2 plume (for more detailed information, see Faults and Fractures section of One Earth Energy Class VI Permit applications). However, the seismic data also shows that there are no faults within the modeled CO 2 plume that transect the confining unit Eau Claire Formation. The faults that transect the Mt. Simon Arkose Zone Sandstone storage reservoir all tip out in the Lower Mt. Simon Formation and do not reach the overlying Eau Claire confining unit. A small 3D survey acquired around the One Earth Energy #1 characterization well confirms these findings.

20 FOSSIL-FUELED POWER PLANTS↗

DOE OSTI2017

3D Cosmic Ray Muon Tomography from an Underground Tunnel

Here, we present an underground cosmic ray muon tomographic experiment imaging 3D density of overburden, part of a joint study with differential gravity. Muon data were acquired at four locations within a tunnel beneath Los Alamos, New Mexico, and used in a 3D tomographic inversion to recover the spatial variation in the overlying rock–air interface, and compared with a priori knowledge of the topography. Densities obtained exhibit good agreement with preliminary results of the gravity modeling, which will be presented elsewhere, and are compatible with values reported in the literature. The modeled rock–air interface matches that obtained from LIDAR within 4 m, our resolution, over much of the model volume. This experiment demonstrates the power of cosmic ray muons to image shallow geological targets using underground detectors, whose development as borehole devices will be an important new direction of passive geophysical imaging.

3-D inversion↗

DOE OSTI2019

EGS Collab Earth Modeling: Integrated 3D Model of the Testbed

The EGS Collab project is conducting a series of stimulation and interwell flow tests in an intermediate scale (~10-20 m) testbed located on the 4850 level in the Sanford Underground Research Facility (SURF) in Lead, South Dakota. The testbed consists of eight ~200 ft (~60 m) HQ-diameter (9.6 cm) boreholes that are drilled into the Poorman Formation from the western rib of the West Access Drift. Of the eight boreholes, one borehole is used as an injection/stimulation well, another sub-parallel borehole located about 10 m away from the injection well is used as a production well, and rest of the other boreholes are used as monitoring wells. For 3D visualization of the testbed as well as to provide spatially accurate and consistent parameter data for geomechanical and geophysical process modeling tasks, we are using Leapfrog Software (Seequent Limited). For analysis of fractures and creation of conditioned stochastic discrete fracture network (CS-DFN) model of the testbed, we are using FracMan (Golder Associates Inc.). As of mid-May 2019, the EGS Collab Leapfrog database contains the general layout of the drifts/shafts at the 4850 and 4100 levels; generalized geologic framework model of a domain that spans both the 4850 and 4100 levels; the CS-DFN of the testbed; and layouts of the EGS Collab testbed boreholes, kISMET testbed boreholes, and other existing boreholes at the 4850 level. This information has been obtained from the SURF Vulcan database, detailed laser scan and point surveys of borehole collar locations, directional surveys of borehole trajectories, and mapping of features in the drifts, boreholes, and cores. Similarly, other types of data that have been incorporated into the Leapfrog database include static features of the testbed such as natural discontinuities (e.g., fractures, weeps), location of monitoring instruments, and stimulation notches. Baseline geophysical characterization results (e.g., seismic, ERT, temperature, etc.) are also imported into the Leapfrog database. The location and size of packers, various point-source signals detected during stimulation and flow tests (e.g., temperature anomalies, micro-earthquake events, etc.) are also compiled in the database. All feature locations are reported using the local Homestake Mine coordinate system. In this paper, we present some of the geostructural characteristics as well as the status of the testbed as represented by Leapfrog/FracMan database/visualizations.

15 GEOTHERMAL ENERGY↗

DOE OSTI2026

Geologic stress modulates fluid mixing at fracture intersections

Fracture intersections are critical links that enable flow and transport in subsurface fracture networks, and their behavior strongly influences fluid mixing in a network. Although all subsurface fractures are subjected to geological stress, we lack a fundamental understanding of how fracture intersection geometry evolves under stress and how these changes influence fluid mixing. Here, we combine 3D printing, 3D X-ray tomographic imaging, and 3D pore-scale numerical simulations to reveal stress-induced changes in intersection geometry and their impact on mixing. Mixing is found to be strongly affected by partial closure of an intersection under stress. As an intersection closes, the void area for fluid flow and diffusion decreases leading to substantial deviations between conventional mixing models and full pore-scale modeling. To address this, we propose a modified mixing model that accounts for intersection deformation, which is essential for accurate modeling of solute transport and mixing through fracture networks.

15 GEOTHERMAL ENERGY↗

NASA NTRSDate not supplied

Utilizing Earth Observations to Model Probable Coastal Wetland Extent, Sea-Level Rise Inundation Risk, and Assess Impacts on Historic Hawaiian Lands

Climate induced sea-level rise poses a risk to coastal areas on the Island of Hawai’i, and many of the island’s historic cultural lands are in danger of becoming overtaken by wetlands or inundation. In partnership with the County of Hawai’i, State of Hawai’i Department of Land and Natural Resources, and Arizona State University, NASA DEVELOP mapped wetland extent and short-term sea-level rise inundation risk. We utilized Earth observations over a 10-year span (2013 – 2022) that included the NASA MEaSUREs Gridded Sea Surface Height Anomalies and MEaSUREs Group for High Resolution Sea Surface Temperature datasets, United States Geological Survey (USGS) Hawaii Digital Elevation Models (DEM), and in situ tidal gauge data. Flood risk index values were acquired for 5 known Hawai’i flood events between 2019 – 2021 from the Global Flood Mapper tool on Google Earth Engine. We used a random forest model to predict short-term sea-level rise inundation risk along the entire coast of Hawai’i. Current wetland extents and probabilistic locations of new wetlands were modeled with the most recently available data from PlanetScope Surface Reflectance optical imagery (2022), USGS 3D Elevation Program (3DEP) 10m DEM (2020), temperature and precipitation data from the Hawai’i Climate Atlas, and soils data from the Hawai’i Soil Atlas (2014) using the Wetland Intrinsic Potential tool. Results indicated locations that had the highest probability of wetland creation. The end products aimed to help the partners prioritize efforts to meeting regulation requirements for wetlands protection, evaluate the inundation risk to historical features, and support decision-making for their Shoreline Setback and Climate Adaption plans.

Lisa Tanh↗

DOE OSTI2020

Hydrogeologic Model Based on Reduced Complexity

This data set provides the basic hydrogeologic model used for development of the TOUGH2 reservoir modeling results for the Kimberlina site. The hydrogeologic model is based on the static geologic model provided as a separate data set but has some simplifications regarding the geologic layers. Some geologic layers have been merged for the hydrogeologic model because the hydrogeologic properties were very similar. The data set contains several files. The word file explains the structure of the data files. The pdf contains a table with the hydrogeologic properties. The data set also includes 15 thickness files for 15 geological layers (including 3 Vedder sand layers and 3 Vedder shale layers), three elevations files (with reference elevation at ground surface/model top at 9000 m), and one fault trace file for seven faults. Most users may only need 2-3 faults close to the injection well (also see the figure). The arrangement of these layer thickness and elevations files can be see from the three layer files (for Tecplot). To develop a grid structure, start with the Vedder top elevation (REFVedderTop.dat) and add/subtract the thicknesses of layers above/below.

3D Groundwater Model↗

DOE OSTI2021

2D-to-3D image translation of complex nanoporous volumes using generative networks

Image-based characterization offers a powerful approach to studying geological porous media at the nanoscale and images are critical to understanding reactive transport mechanisms in reservoirs relevant to energy and sustainability technologies such as carbon sequestration, subsurface hydrogen storage, and natural gas recovery. Nanoimaging presents a trade off, however, between higher-contrast sample-destructive and lower-contrast sample-preserving imaging modalities. Furthermore, high-contrast imaging modalities often acquire only 2D images, while 3D volumes are needed to characterize fully a source rock sample. In this work, we present deep learning image translation models to predict high-contrast focused ion beam-scanning electron microscopy (FIB-SEM) image volumes from transmission X-ray microscopy (TXM) images when only 2D paired training data is available. We introduce a regularization method for improving 3D volume generation from 2D-to-2D deep learning image models and apply this approach to translate 3D TXM volumes to FIB-SEM fidelity. We then segment a predicted FIB-SEM volume into a flow simulation domain and calculate the sample apparent permeability using a lattice Boltzmann method (LBM) technique. Results show that our image translation approach produces simulation domains suitable for flow visualization and allows for accurate characterization of petrophysical properties from non-destructive imaging data.

58 GEOSCIENCES↗

NASA NTRS2004

Starting Conditions for Hydrothermal Systems Underneath Martian Craters: Hydrocode Modeling

Mars is the most Earth-like of the Solar System s planets, and the first place to look for any sign of present or past extraterrestrial life. Its surface shows many features indicative of the presence of surface and sub-surface water, while impact cratering and volcanism have provided temporary and local surface heat sources throughout Mars geologic history. Impact craters are widely used ubiquitous indicators for the presence of sub-surface water or ice on Mars. In particular, the presence of significant amounts of ground ice or water would cause impact-induced hydrothermal alteration at Martian impact sites. The realization that hydrothermal systems are possible sites for the origin and early evolution of life on Earth has given rise to the hypothesis that hydrothermal systems may have had the same role on Mars. Rough estimates of the heat generated in impact events have been based on scaling relations, or thermal data based on terrestrial impacts on crystalline basements. Preliminary studies also suggest that melt sheets and target uplift are equally important heat sources for the development of a hydrothermal system, while its lifetime depends on the volume and cooling rate of the heat source, as well as the permeability of the host rocks. We present initial results of two-dimensional (2D) and three-dimensional (3D) simulations of impacts on Mars aimed at constraining the initial conditions for modeling the onset and evolution of a hydrothermal system on the red planet. Simulations of the early stages of impact cratering provide an estimate of the amount of shock melting and the pressure-temperature distribution in the target caused by various impacts on the Martian surface. Modeling of the late stage of crater collapse is necessary to characterize the final thermal state of the target, including crater uplift, and distribution of the heated target material (including the melt pool) and hot ejecta around the crater.

Pierazzo, E.↗

DOE OSTI2026

A robust framework for frictional fault contact in geological formations using a stabilized augmented Lagrangian approach

Numerical simulations are essential to evaluate the performance and safety of engineered subsurface systems such as geological carbon storage sites, enhanced geothermal fields, and oil and gas reservoirs. A key challenge lies in accurately modeling the frictional contact behavior along fault surfaces. This problem involves inequality constraints that arise from the physics of frictional slip, requiring specialized numerical methods to handle the resulting highly nonlinear and path-dependent behavior. Here, in this work, we address this challenge using an Augmented Lagrangian Method (ALM) implemented via the Uzawa algorithm. The formulation employs mixed finite element spaces, combining low-order piecewise linear displacements within the 3D domain cells with piecewise constant tractions defined on the fault surfaces. Furthermore, to ensure stability and satisfy the inf-sup condition, the discrete displacement space is enriched with face bubble functions on both sides of the contact interfaces. This approach offers several advantages over other stabilization techniques that rely on additional terms, and it integrates naturally in the Uzawa framework.

58 GEOSCIENCES↗

DOE OSTI2016

TOGA: A TOUGH code for modeling three-phase, multi-component, and non-isothermal processes involved in CO 2 -based Enhanced Oil Recovery

TOGA is a numerical reservoir simulator for modeling non-isothermal flow and transport of water, CO 2 , multicomponent oil, and related gas components for applications including CO 2 -enhanced oil recovery (CO 2 -EOR) and geologic carbon sequestration in depleted oil and gas reservoirs. TOGA uses an approach based on the Peng-Robinson equation of state (PR-EOS) to calculate the thermophysical properties of the gas and oil phases including the gas/oil components dissolved in the aqueous phase, and uses a mixing model to estimate the thermophysical properties of the aqueous phase. The phase behavior (e.g., occurrence and disappearance of the three phases, gas + oil + aqueous) and the partitioning of non-aqueous components (e.g., CO 2 , CH 4 , and n-oil components) between coexisting phases are modeled using K-values derived from assumptions of equal-fugacity that have been demonstrated to be very accurate as shown by comparison to measured data. Models for saturated (water) vapor pressure and water solubility (in the oil phase) are used to calculate the partitioning of the water (H 2 O) component between the gas and oil phases. All components (e.g., CO 2 , H 2 O, and n hydrocarbon components) are allowed to be present in all phases (aqueous, gaseous, and oil). TOGA uses a multiphase version of Darcy’s Law to model flow and transport through porous media of mixtures with up to three phases over a range of pressures and temperatures appropriate to hydrocarbon recovery and geologic carbon sequestration systems. Transport of the gaseous and dissolved components is by advection and Fickian molecular diffusion. New methods for phase partitioning and thermophysical property modeling in TOGA have been validated against experimental data published in the literature for describing phase partitioning and phase behavior. Flow and transport has been verified by testing against related TOUGH2 EOS modules and CMG. The code has also been validated against a CO 2 -EOR experimental core flood involving flow of three phases and 12 components. Results of simulations of a hypothetical 3D CO 2 -EOR problem involving three phases and multiple components are presented to demonstrate the field-scale capabilities of the new code. This user guide provides instructions for use and sample problems for verification and demonstration.

97 MATHEMATICS AND COMPUTING↗

DOE OSTI2017

Improved image of intrusive bodies at Newberry Volcano, Oregon, based on 3D gravity modelling

Beneath Newberry Volcano is one of the largest geothermal heat reservoirs in the western United States and it has been extensively studied for the last 40 years. Several magmatic intrusions have been recognized at depths between 2.5 and 8 km and some of them identified as suitable targets for enhanced geothermal energy and tested during two previous EGS campaigns. These subsurface structures have been intersected by three deep wells and imaged by various geophysical methods including seismic tomography and magnetotellurics. Although three high quality gravity surveys were completed between 2006 and 2010 as part of various projects, a complete synthesis and interpretation of the gravity data has not yet been performed. Regional gravity data also exist in the vicinity of the Newberry volcano and have been added to these surveys to constitute a dataset with a total of 1418 gravity measurements. When coupled with existing geologic and geophysical data and models, this new gravity dataset provides important constraints on the depth and contours of the magmatic bodies previously identified by other methods and thus greatly contributing to facilitate any future drilling and stimulation works. Using the initial structures discovered by seismic tomography, inversion of gravity data has been performed. Shape, density values and depths of various bodies were allowed to vary and three main bodies have been identified. Densities of the middle and lower intrusive bodies (~2.6-2.7 g/cm3) are consistent with rhyolite, basalt or granites. Modeled density of the near-surface caldera body match that of a low density tephra material and the density of the shallow ring structures contained in the upper kilometer correspond to that of welded tuff or low-density rhyolites. Modeled bodies are in reality a composite of thin layers; however, average densities of the modeled gravity bodies are in good agreement with the density log obtained in one well located on the western flank (well 55-29). Final gravity data residuals show that most of the observed gravity anomalies at the surface can be explained by the modeled gravity bodies and are consistent with other site characterization information.

Cascade Range↗