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DOE OSTI2021

Method for sealing a void in a well using a smart gel sealant

Embodiments of the disclosure include swellable smart gel sealants. In certain embodiments, the smart gel sealants reversibly swell when exposed to a certain trigger, such as temperature or pH. In specific embodiments, the smart gel is disposed within voids in a well and triggered to swell in order to seal the voids. One application of the smart gel sealant is to seal the casing of a well against the leakage of gas, such as CO2.

Goodman, Harvey Edwin↗

DOE OSTI2022

Method for sealing a void in a well using smart gels

Embodiments of the disclosure include swellable smart gel sealants and methods of using smart gel sealants. In certain embodiments, the smart gel sealants reversibly swell when exposed to a certain trigger, such as temperature or pH. In specific embodiments, the smart gel is disposed within voids in a well and triggered to swell in order to seal the voids. One application of the smart gel sealant is to seal the casing of a well against the leakage of gas, such as H2S.

Roback, Robert Clifford↗

DOE OSTI2023

The neutral hydrogen mass in galaxies estimated via optical spectroscopy

ABSTRACT We propose to employ emission line luminosities obtained via optical spectroscopy to estimate the content of neutral hydrogen (H i) in galaxies. We use the optical spectroscopy data from the Mapping of Nearby Galaxies at APO (MaNGA) survey released in the frames of public DR17 of the Sloan Digital Sky Survey (SDSS). We compare the H i mass estimated by us for a large sample of SDSS/MaNGA galaxies with direct H i measurements from the Arecibo Legacy Fast ALFA survey and find a tight correlation between the masses with the correlation coefficient (CC) of 0.91 and the rms scatter of 0.15 dex for the logarithmic mass. The obtained relationship is verified via another sample of MaNGA galaxies with H i masses measured with the Green Bank Telescope. Despite the coarser angular resolution of the radio data, the relation between the estimated and measured directly H i mass is tight as well – in this case CC = 0.74 and the rms is 0.29 dex. The established relations allow us to estimate the total mass of neutral hydrogen as well as the spatial distribution of H i surface density in galaxies from optical spectroscopic observations only in a simple and efficient way.

Bizyaev, Dmitry (ORCID:000000023601133X)↗

NASA NTRS1984

An Earth longwave radiation climate model

An Earth outgoing longwave radiation (OLWR) climate model was constructed for radiation budget study. Required information is provided by on empirical 100mb water vapor mixing ratio equation of the mixing ratio interpolation scheme. Cloud top temperature is adjusted so that the calculation would agree with NOAA scanning radiometer measurements. Both clear sky and cloudy sky cases are calculated and discussed for global average, zonal average and world-wide distributed cases. The results agree well with the satellite observations. The clear sky case shows that the OLWR field is highly modulated by water vapor, especially in the tropics. The strongest longitudinal variation occurs in the tropics. This variation can be mostly explained by the strong water vapor gradient. Although in the zonal average case the tropics have a minimum in OLWR, the minimum is essentially contributed by a few very low flux regions, such as the Amazon, Indonesian and the Congo.

Yang, S. K.↗

DOE OSTI2024

Modeling and Assessment of Integrated Hydroelectric Power and Hydrogen Energy Storage

Environmental and regulatory constraints are increasingly posing challenges to the optimal operation of hydroelectric facilities. Hydrogen energy storage (HES) is well-suited to address these challenges.Using excess or low-cost hydroelectric power during off-peak hours to produce hydrogen can help reduce water spills and unlock opportunities for energy arbitrage. Moreover, the oxygen byproduct of electrolysis can be used to improve the dissolved oxygen (DO) levels in tailrace water. %, a key water quality metric for hydroelectric facilities.This paper presents an innovative framework for modeling and assessing the integrated hydroelectric-hydrogen system, considering subsystem constraints and coupling, benefits in spill water reduction and DO mitigation, as well as diverse hydrogen utilization, including re-electrification, blending with natural gas, and direct sales. Comprehensive case studies were conducted to assess the techno-economic performance of the integrated system in different deployment scenarios.

Energy storage, Hydrogen, Hydropower, Optimization↗

NASA NTRS2022

Planetary Protection Policy and Technology Developments for the Crewed Exploration of Mars

As part of planning for potential future crewed exploration of Mars, NASA is developing its planetary protection policy for crewed missions, building on concepts developed within the international space exploration community. COSPAR (The Committee on Space Research), together with participating space agencies, has over the last several years organized and held interdisciplinary meetings to consider next steps in addressing knowledge gaps for planetary protection for the first human missions to Mars. Beginning with these workshop discussions as a base, NASA has held follow-on planning activities to identify the necessary steps to be accomplished to close those knowledge gaps. Significant overlap was identified between the planetary protection needs, including; microbial monitoring requirements for crew health and medical systems; studies of the microbiome of the built environment; environmental control and life support system (ECLSS) venting and disinfection strategies; waste management, and; planetary surface operations. In many cases, efforts to mature exploration systems for Mars that are occurring in other technology domains can be leveraged with minor changes to address planetary protection gaps as well. In other cases, work planned for testing on ISS as an analog for Mars transit, or on the lunar surface as an analog for Mars surface operations, can be used to close gaps in current planetary protection capabilities. This presentation provides a status update on the findings of the COSPAR Meetings on this topic to date, together with NASA’s responses in terms of agency-level plans and activities.

James N Benardini↗

NASA NTRS1990

Modelling the transitional boundary layer

Recent developments in the modelling of the transition zone in the boundary layer are reviewed (the zone being defined as extending from the station where intermittency begins to depart from zero to that where it is nearly unity). The value of using a new non-dimensional spot formation rate parameter, and the importance of allowing for so-called subtransitions within the transition zone, are both stressed. Models do reasonably well in constant pressure 2-dimensional flows, but in the presence of strong pressure gradients further improvements are needed. The linear combination approach works surprisingly well in most cases, but would not be so successful in situations where a purely laminar boundary layer would separate but a transitional one would not. Intermittency-weighted eddy viscosity methods do not predict peak surface parameters well without the introduction of an overshooting transition function whose connection with the spot theory of transition is obscure. Suggestions are made for further work that now appears necessary for developing improved models of the transition zone.

Narasimha, R.↗

DOE OSTI2026

Novel and Rugged Electromagnetic Wireless System for Long-Term Subsurface CO₂ Plume Monitoring and Saturation Mapping

Novel and rugged electromagnetic wireless system for long-term subsurface CO₂ plume monitoring and saturation mapping is a Phase I SBIR project led by Cyentech Consulting LLC to develop a permanently installed, outside-casing electromagnetic monitoring system for long-term carbon storage monitoring. The project addresses a major challenge in carbon capture and storage: the need for reliable, cable-free downhole monitoring that can detect CO₂ plume movement and saturation changes without compromising well integrity through casing perforations or external umbilical cables.

58 GEOSCIENCES↗

DOE OSTI2022

Examination of stiff ion temperature gradient mode physics in simulations of DIII-D H-mode transport

A systematic evaluation of gyrokinetic and gyrofluid model predictions of ion temperature gradient (ITG) stability and transport using parameters from DIII-D high confinement mode (H-mode) plasmas has been performed. The nonlinear CGYRO code is used to make the gyrokinetic predictions, and the quasilinear TGLF model for the corresponding gyrofluid predictions. The assessments are made at three radii (normalized toroidal flux ρtor = 0.4, 0.55, and 0.7) in three different plasma scenarios with varying levels of neutral beam heating and torque. For each of the nine cases (3 radii × 3 scenarios) considered, ITG turbulence is found to be the dominant long-wavelength instability and transport mechanism. The inclusions of both transverse magnetic fluctuations and dynamic fast beam ions are stabilizing for all cases considered, with strongest effects seen at ρor = 0.4 where the fast ion population and normalized plasma pressure β = 2μ0nT/B2 are highest. The further inclusion of parallel magnetic fluctuations does not have a meaningful impact on the ITG turbulence in these scenarios, but does destabilize (in combination with fast ions) new high-frequency instabilities at ρtor = 0.4 in the high power scenarios. In each case the linear and nonlinear ITG critical gradients are predicted to be lower than the measured ITG scale lengths and their associated uncertainties. Inclusion of equilibrium flow shear in the transport predictions generally leads to an upshift in effective critical gradient rather than a qualitative change in the predicted stiffness, with stronger responses typically seen in the gyrokinetic predictions than in the gyrofluid results. However, in most cases these upshifted gradients still remain below the measured values and their uncertainties. Although the predicted critical gradients are below the measured gradients, both models predicted flux-matching gradients consistent with measured values in six of the nine cases considered, with no clear systematic over- or underprediction. Thus, while the experimental ion temperature profiles do not appear to be closely pinned to the ITG critical gradient, both gyrokinetic and gyrofluid models are able to accurately match the measured gradients reasonably well in most cases.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2020

Blind Modeling Validation Exercises Using the Horizontal Dry Cask Simulator

The U.S. Department of Energy (DOE) established a need to understand the thermal-hydraulic properties of dry storage systems for commercial spent nuclear fuel (SNF) in response to a shift towards the storage of high-burnup (HBU) fuel (> 45 gigawatt days per metric ton of uranium, or GWd/MTU). This shift raises concerns regarding cladding integrity, which faces increased risk at the higher temperatures within spent fuel assemblies present within HBU fuel compared to low-burnup fuel (≤ 45 GWd/MTU). A dry cask simulator (DCS) was built at Sandia National Laboratories (SNL) in Albuquerque, New Mexico to produce validation-quality data that can be used to test the accuracy of the modeling used to predict cladding temperatures. These temperatures are critical to evaluating cladding integrity throughout the storage cycle of commercial spent nuclear fuel. A model validation exercise was previously carried out for the DCS in a vertical configuration. Lessons learned during the previous validation exercise have been applied to a new, blind study using a horizontal dry cask simulator (HDCS). Three modeling institutions – the Nuclear Regulatory Commission (NRC), Pacific Northwest National Laboratory (PNNL), and Empresa Nacional del Uranio, S.A., S.M.E. (ENUSA) – were granted access to the input parameters from the DCS Handbook, SAND2017-13058R, and results from a limited data set from the horizontal BWR dry cask simulator tests reported in the HDCS update report, SAND2019-11688R. With this information, each institution was tasked to calculate peak cladding temperatures and air mass flow rates for ten HDCS test cases. Axial as well as vertical and horizontal transverse temperature profiles were also calculated. These calculations were done using modeling codes (ANSYS/Fluent, STAR-CCM+, or COBRA-SFS), each with their own unique combination of modeling assumptions and boundary conditions. For this validation study, the ten test cases of the horizontal dry cask simulator were defined by three independent variables – fuel assembly decay heat (0.5 kW, 1 kW, 2.5 W, and 5 kW), internal backfill pressure (100 kPa and 800 kPa), and backfill gas (helium and air). The plots provided in Chapter 3 of this report show the axial, vertical, and horizontal temperature profiles obtained from the dry cask simulator experiments in the horizontal configuration and the corresponding models used to describe the thermal-hydraulic behavior of this system. The tables provided in Chapter 3 illustrate the closeness of fit of the model data to the experiment data through root mean square (RMS) calculations of the error in peak cladding temperatures (PCTs), PCT axial locations, axial temperature profiles, vertical and horizontal temperature profiles at two different axial locations, and air mass flow rates for the ten test cases, normalized by the experimental results. The model results are assigned arbitrary model numbers to retain anonymity. Due to the relatively flat axial temperature profiles, small temperature gradients resulted in large deviations of all models’ PCT axial location from the experimental PCT axial location. When the PCT axial location error is excluded in the calculation of the combined RMS of the normalized errors that considers PCT, the temperature profiles, and the air mass flow rates, the model data fits the experimental data to within 5%. When the vault information is excluded, the model data fits the experimental data to within 2.5%. An error analysis was developed further for one model, using the model and experimental uncertainties in each validation parameter to calculate validation uncertainties. The uncertainties for each parameter were used to define quantifiable validation criteria. For this analysis, the model was considered validated for a given comparison metric if the normalized error in that metric divided by the validation uncertainty was less than or equal to 1. When considering the combined RMS of the normalized errors of all metrics divided by their validation uncertainties, the model was found to have satisfied the criterion for model validation.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

DOE OSTI2022

Multiobjective optimization of nuclear microreactor reactivity control system operation with swarm and evolutionary algorithms

To improve the marketability of novel microreactor designs, there is a need for automated and optimal control of these reactors. This paper presents a methodology for performing multiobjective optimization of control drum operation for a microreactor under normal and off-nominal conditions. Here, two different case studies are used where the control drum configuration is optimized for the reactor to be critical with some desired power distribution that would satisfy peaking limits. A surrogate model for power distribution is developed based on a feedforward neural network. The process for determining weights for scalarization of the multiobjective optimization problem is also detailed. Six optimization algorithms: evolutionary strategies, differential evolution, grey wolf optimization, Harris hawks optimization, moth flame optimization and particle swarm optimization, are all applied to these cases and the results analyzed. Although all these algorithms will demonstrate optima-seeking behavior, for real-time control it is necessary to identify the best algorithm to efficiently provide reasonable optima without operator interference. The moth flame optimization algorithm was found to perform particularly well on both cases. Overall, it was found that the algorithms capable of supplying the best optima were also the most consistent. Finally, the found optima were verified with the original model used to train surrogates.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

DOE OSTI2021

Measurement of Fission Product Concentration Profiles in AGR-3/4 TRISO Fuel Graphitic Matrix and Nuclear Graphites

The third Advanced Gas Reactor (AGR) irradiation experiment, AGR-3/4, was designed to investigate the migration of fission products in fuel compact graphitic matrix and reactor graphite components. Using destructive methods, radial fission product concentration profiles were measured for gamma-emitting fission products (e.g., Ag-110m, Cs-134, and Eu-154) and beta-emitting Sr-90 in irradiated graphitic and graphite components from six different AGR-3/4 irradiation capsules. These new measured concentration profiles can now be compared to non-destructive measurements and fission product transport simulations and will be used to derive new diffusivities and sorptivities to support refinement of fission product transport models and high-temperature gas-cooled reactor (HTGR) source-term analyses. Each capsule in the AGR-3/4 experiment had four fuel compacts in the middle of two concentric rings of graphitic matrix material, PCEA graphite, or IG-110 graphite. In addition to the approximately 1898 tristructural isotropic (TRISO) coated particles in each compact, there were 20 designed to fail (DTF) particles coated only in pyrocarbon so that they released fission products into the surrounding cylindrical rings of carbonaceous materials. Destructive sampling of the rings involved machining/milling material from around the circumference of the rings, collecting that material, and performing radiochemical analyses on it. Milling operations were performed in multiple steps or segments, and each segment was generally 0.508 mm (0.020 in) thick. Knowing the radial position at which each segment was milled, the volume of the milled material at each segment, and the fission product content in each segment, the radial fission product concentrations were constructed for select isotopes in each ring. Ag-110m profiles had the most variation. Some profiles were peaked at an inner or outer surface. Some were peaked at the middle of the ring wall thickness. Some increased radially outward, and some decreased radially outward. These types of variations and the fact that the measured profiles do not generally compare favorably with the transport model employed for AGR-3/4 may adversely impact the ability to extract reasonable transport parameters for this isotope. In many cases, the Cs-134 profiles decreased somewhat linearly in the outward radial direction, and in cursory comparisons, the shapes of these profiles appeared similar to those from model predictions. The step changes in concentration across the inner-outer ring gap were generally consistent with the model predictions as well. In some cases, there were local maxima in concentration at the outer surface of the rings. This suggests that fission products could have transported in the small gaps between the inner ring and the outer ring and between the outer ring and the sink ring such that some portion of a given fission product can bypass diffusion through the ring itself. The analysis of the small nubs on the outer surfaces of some of the outer rings revealed fission product concentrations in the nubs that were often higher than in the outermost segments of the rings. This further supports the hypothesis that short-circuit, gap transport occurred, causing relatively high surface concentrations on the outer surfaces of the rings. Eu-154 and Sr-90 profiles tend to have very similar shapes, suggesting that they transport via the same mechanisms. The observed profiles were indicative of a transport process where the isotopes are sorbed on the inner surface of the ring, but diffusion into the ring from that surface is quite slow. Some elevated concentrations of Sr-90 (relative to Eu-154) on the outer surface of a ring suggested that rapid, gas-gap transport of gaseous precursor Kr-90 and volatile Rb-90 could have occurred prior to their decaying to Sr-90. Overall, the Eu 154 and Sr-90 profiles were still very similar, which indicates that the transport of short-lived Sr-90 precursors is not a major effect. In some capsules, the qualitative Sr-90 behavior across the ring gaps was consistent with the model (using the available legacy Sr-90 transport parameters), but in other capsules the model was inconsistent with the measurements and seems to underestimate the amount of Sr-90 in the outer rings. The total ring Sr-90 inventories were estimated for all the rings that were subject to physical sampling. These results will be used to adjust the predicted particle and/or compact releases used in the AGR-3/4 fission product transport model. Given the different irradiation temperatures among the capsules and the rings, it was not possible to discern fundamental differences in the transport of isotopes within the different carbon materials, i.e., graphitic matrix, IG-110, or PCEA. It may be possible to do this in the course of determining transport from the concentration profiles in future work.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

NASA NTRS1994

Computation of iodine species concentrations in water

During an evaluation of the use of iodine as a water disinfectant and the development of methods for measuring various iodine species in water onboard Space Freedom, it became necessary to compute the concentration of the various species based on equilibrium principles alone. Of particular concern was the case when various amounts of iodine, iodide, strong acid, and strong base are added to water. Such solutions can be used to evaluate the performance of various monitoring methods being considered. The authors of this paper present an overview of aqueous iodine chemistry, a set of nonlinear equations which can be used to model the above case, and a computer program for solving this system of equations using the Newton-Raphson method. The program was validated by comparing results over a range of concentrations and pH values with those previously presented by Gottardi for a given pH. Use of this program indicated that there are multiple roots to many cases and selecting an appropriate initial guess is important. Comparison of program results with laboratory results for the case when only iodine is added to water indicates the program gives high pH values for the iodine concentrations normally used for water disinfection. Extending the model to include the effects of iodate formation results in the computer pH values being closer to those observed, but the model with iodate does not agree well for the case in which base is added in addition to iodine to raise the pH. Potential explanations include failure to obtain equilibrium conditions in the lab, inaccuracies in published values for the equilibrium constants, and inadequate model of iodine chemistry and/or the lack of adequate analytical methods for measuring the various iodine species in water.

Schultz, John R.↗

NASA NTRS2012

Shuttle Case Study Collection Website Development

As a continuation from summer 2012, the Shuttle Case Study Collection has been developed using lessons learned documented by NASA engineers, analysts, and contractors. Decades of information related to processing and launching the Space Shuttle is gathered into a single database to provide educators with an alternative means to teach real-world engineering processes. The goal is to provide additional engineering materials that enhance critical thinking, decision making, and problem solving skills. During this second phase of the project, the Shuttle Case Study Collection website was developed. Extensive HTML coding to link downloadable documents, videos, and images was required, as was training to learn NASA's Content Management System (CMS) for website design. As the final stage of the collection development, the website is designed to allow for distribution of information to the public as well as for case study report submissions from other educators online.

Ransom, Khadijah S.↗

DOE OSTI2026

Magnus method for electronic structure calculations at extreme conditions

We present the application of Magnus based methods to the solution of first order coupled ordinary differential equations in High Energy Density (HED) physics applications. Our focus is on the application to quantum mechanical methods, specifically on the solution of the radial Dirac equation for real and complex energies. HED applications require accurate solutions across a wide range of spatial and energy domains, including regimes where the solutions exhibit pronounced oscillatory behavior. Such cases pose significant computational challenges. We demonstrate that Magnus-based integrators can efficiently and accurately address these challenges. We discuss the implementation of the Magnus method for the solution of the radial Dirac equation, including practical considerations such as the evaluation of matrix exponentials, numerical integration, error estimation, and adaptive step size control. We also discuss the application of these methods to complex energy Green’s function techniques and the efficient approximation of integrals of the solutions relevant to HED electronic structure calculations. Here, we demonstrate the accuracy and robustness of the resulting method in applications to the free-particle case, for which analytic solutions are available for comparison, as well as the challenging case of gold at HED conditions.

general physics↗

NASA NTRS1981

Periodic solutions about the collinear Lagrangian solution in the general problem of three bodies

The article describes the solutions near Lagrange's circular collinear configuration in the planar problem of three bodies with three finite masses. The article begins with a detailed review of the properties of Lagrange's collinear solution. Lagrange's quintic equation is derived and several expressions are given for the angular velocity of the rotating frame. The equations of motion are then linearized near the circular collinear solution, and the characteristic equation is also derived in detail. The different types of roots and their corresponding solutions are discussed. The special case of two equal outer masses receives special attention, as well as the special case of two small outer masses. Finally, the fundamental family of periodic solutions is extended by numerical integration all the way up to and past a binary collision orbit. The stability and the bifurcations of this family are briefly enumerated.

Broucke, R.↗

NASA NTRS1994

Green's formula and variational principles for cosmic-ray transport with application to rotating and shearing flows

Green's theorem and Green's formula for the diffusive cosmic-ray transport equation in relativistic flows are derived. Green's formula gives the solution of the transport equation in terms of the Green's function of the adjoint transport equation, and in terms of distributed sources throughout the region R of interest, plus terms involving the particle intensity and streaming on the boundary. The adjoint transport equation describes the time-reversed particle transport. An Euler-Lagrange variational principle is then obtained for both the mean scattering frame distribution function f, and its adjoint f(dagger). Variations of the variational functional with respect to f(dagger) yield the transport equation, whereas variations of f yield the adjoint transport equation. The variational principle, when combined with Noether's theorem, yields the conservation law associated with Green's theorem. An investigation of the transport equation for steady, azimuthal, rotating flows suggests the introduction of a new independent variable H to replace the comoving frame momentum variable p'. For the case of rigid rotating flows, H is conserved and is shown to be analogous to the Hamiltonian for a bead on a rigidly rotating wire. The variable H corresponds to a balance between the centrifugal force and the particle inertia in the rotating frame. The physical interpretation of H includes a discussion of nonrelativistic and special relativistic rotating flows as well as the cases of aziuthal, differentially rotating flows about Schwarzs-child and Kerr black holes. Green's formula is then applied to the problem of the acceleration of ultra-high-energy cosmic rays by galactic rotation. The model for galactic rotation assumes an angular velocity law Omega = Omega(sub 0)(omega(sub 0)/omega), where omega denotes radial distance from the axis of rotation. Green's functions for the galactic rotation problem are used to investigate the spectrum of accelerated particles arising from monoenergetic and truncated power-law sources. We conclude that it is possible to accelerate particles beyond the knee by galactic rotation, but not in sufficient number to adequately explain the observed spectrum.

Webb, G. M.↗

DOE OSTI2021

Lattice simulations of inflation

The scalar field theory of cosmological inflation constitutes nowadays one of the preferred scenarios for the physics of the early universe. In this paper we aim at studying the inflationary universe making use of a numerical lattice simulation. Various lattice codes have been written in the last decades and have been extensively used for understating the reheating phase of the universe, but they have never been used to study the inflationary phase itself far from the end of inflation (i.e. about 50 e-folds before the end of inflation). In this paper we use a lattice simulation to reproduce the well-known results of some simple models of single-field inflation, particularly for the scalar field perturbation. The main model that we consider is the standard slow-roll inflation with an harmonic potential for the inflaton field. We explore the technical aspects that need to be accounted for in order to reproduce with precision the nearly scale invariant power spectrum of inflaton perturbations. We also consider the case of a step potential, and show that the simulation is able to correctly reproduce the oscillatory features in the power spectrum of this model. Even if a lattice simulation is not needed in these cases, that are well within the regime of validity of linear perturbation theory, this sets the basis to future work on using lattice simulations to study more complicated models of inflation.

79 ASTRONOMY AND ASTROPHYSICS↗