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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 991 records · Page 55

Flight Experiment to Study Double-Diffusive Instabilities in Silver-Dopped Lead Bromide Crystals

The main objective of the present program is to understand thermosolutal convection during crystal growth of PbBr2-AgBr alloys. This involves identification of the growth conditions for microgravity experiments delineating the microsegregation, observation of convecto-diffusive instabilities and comparison with theoretical models. The overall objectives can be summarized as follows: 1. Observe and study the double diffusive and morphological instabilities in controlled conditions and to compare with theoretically predicted convective and morphological instability curves. 2. Study the three-dimensional morphological instabilities and resulting cellular growth that occur near the onset of morphological instability in the bulk samples under purely diffusive conditions. 3. Understand the micro-and macro-segregation of silver dopant in lead bromide crystals in microgravity. 4. Provide basic data on convective behavior in alloy crystals grown by the commercially important Bridgman crystal growth process.

Singh, N. B.↗

Neural Scaling Laws for Jet Generation

Recently observed empirical scaling laws describe the performance of foundation-type models as three independent key quantities -- dataset size, compute, and model parameters -- are modified. Extracting these scaling laws informs the training of large complex models for which the tuning of hyperparameters in traditional ways is not feasible. This work for the first time explores if scaling laws can also be observed for the task of particle jet generation -- both relevant as a pre-training objective for foundation models and as in-situ simulation by itself. We indeed replicate the key logarithmic scaling law behavior for model-size scaling. Beyond studying the next token prediction validation loss of the generative model, we also study the sliced Wasserstein distance of five physical quantities that are not immediately available to the model during training. Our study shows that this quantity is monotonically related to the next token prediction validation loss, meaning that this loss is indeed a good proxy for the physics performance. For the scaling with dataset size and compute, we observe substantially weaker scaling behavior of both the loss and the sliced Wasserstein distance. We analyze this behavior by introducing the concept of a learnable window, and argue that autoregressive next token prediction on jet constituents exhibits comparatively rapid saturation relative to language-model studies. We discuss possible origins of this behavior, including the stochastic nature of QCD radiation and differences between generative and supervised learning tasks in collider physics.

Amram, Oz [Fermilab]↗

Advanced Geomechanical Model to Predict the Impact of CO2-Induced Microstructural Alterations on the Cohesive-Frictional Behavior of Mt. Simon Sandstone

We investigated the influence of CO2-induced geochemical reactions on the cohesive-frictional properties of host rock within the context of CO2 storage in a saline aquifer and focused on the Mt. Simon sandstone. The research objective was to model geo-mechanical changes due to host rock exposure to CO2-saturated brine while accounting for heterogeneity, double-scale porosity, and granular structure. We formulated a three-level multi-scale model for host rocks. We conducted scanning electron microscopy analyses to probe the microstructure and grid nanoindentation to measure the mechanical response. We derived new nonlinear strength upscaling solutions to correlate the effective strength characteristics and the macroscopic yield surface to the micro-structure at the nano-, micro-, and meso-scales. Specifically, our theoretical model links CO2-induced microstructural alterations to a reduction in the size of the yield surface, and a drop in the value of the friction coefficient. In turn, regarding the Illinois Basin Decatur Project, the CO2-induced drop in friction coefficient is linked to an increase in the risk of fault slip and a higher probability of induced microseismicity during and after the end of CO2 underground injection operations. The theoretical model presented is essential for the geo-mechanical modeling of CO2 underground injection operations at multiple length-scales.

58 GEOSCIENCES↗

GrainPaint: A multi-scale diffusion-based generative model for microstructure reconstruction of large-scale objects

Simulation-based approaches to microstructure generation can suffer from a variety of limitations, such as high memory usage, long computational times, and difficulties in generating complex geometries. Generative machine learning models present a way around these issues, but they have previously been limited by the fixed size of their generation area. Here, we present a new microstructure generation methodology leveraging advances in inpainting using denoising diffusion models to overcome this generation area limitation. We show that microstructures generated with the presented methodology are statistically similar to grain structures generated with a kinetic Monte Carlo simulator, SPPARKS.

36 MATERIALS SCIENCE↗

Transient Postclosure Criticality Model Development

A key objective of the United States Department of Energy’s (DOE) Office of Nuclear Energy’s Spent Fuel and Waste Science and Technology (SFWST) Campaign is to better understand the technical basis, risks, and uncertainty associated with the safe and secure disposition of spent nuclear fuel (SNF) and high-level radioactive waste. Commercial nuclear power generation in the United States has resulted in thousands of metric tons of SNF, the disposal of which is the responsibility of the DOE (Nuclear Waste Policy Act of 1982, as amended). Any repository licensed to dispose of SNF must meet requirements regarding the long-term performance of that repository. For an evaluation of the long-term performance of the repository, one of the events that may need to be considered is the SNF achieving a critical configuration during the postclosure period. Of particular interest is the potential behavior of SNF in dualpurpose canisters (DPCs), which are currently licensed and being used to store and transport SNF but were not designed for permanent geologic disposal.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Turbulence modeling for hypersonic flight

The objective of the present work is to develop, verify, and incorporate two equation turbulence models which account for the effect of compressibility at high speeds into a three dimensional Reynolds averaged Navier-Stokes code and to provide documented model descriptions and numerical procedures so that they can be implemented into the National Aerospace Plane (NASP) codes. A summary of accomplishments is listed: (1) Four codes have been tested and evaluated against a flat plate boundary layer flow and an external supersonic flow; (2) a code named RANS was chosen because of its speed, accuracy, and versatility; (3) the code was extended from thin boundary layer to full Navier-Stokes; (4) the K-omega two equation turbulence model has been implemented into the base code; (5) a 24 degree laminar compression corner flow has been simulated and compared to other numerical simulations; and (6) work is in progress in writing the numerical method of the base code including the turbulence model.

Bardina, Jorge E.↗

Validation of two-equation turbulence models for propulsion flowfields

The objective of the study is to assess the capability of two-equation turbulence models for simulating propulsion-related flowfields. The standard kappa-epsilon model with Chien's low Reynolds number formulation for near-wall effects is used as the baseline turbulence model. Several experimental test cases, representative of rocket combustor internal flowfields, are used to catalog the performance of the baseline model. Specific flowfields considered here include recirculating flow behind a backstep, mixing between coaxial jets and planar shear layers. Since turbulence solutions are notoriously dependent on grid and numerical methodology, the effects of grid refinement and artificial dissipation on numerical accuracy are studied. In the latter instance, computational results obtained with several central-differenced and upwind-based formulations are compared. Based on these results, improved turbulence modes such as enhanced kappa-epsilon models as well as other two-equation formulations (e.g., kappa-omega) are being studied. In addition, validation of swirling and reacting flowfields are also currently underway.

Deshpande, Manish↗

Radiation Pressure-Driven Magnetic Disk Winds in Broad Absorption Line Quasi-Stellar Objects

We explore a model in which QSO broad absorption lines (BALS) are formed in a radiation pressure-driven wind emerging from a magnetized accretion disk. The magnetic field threading the disk material is dragged by the flow and is compressed by the radiation pressure until it is dynamically important and strong enough to contribute to the confinement of the BAL clouds. We construct a simple self-similar model for such radiatively driven magnetized disk winds, in order to explore their properties. It is found that solutions exist for which the entire magnetized flow is confined to a thin wedge over the surface of the disk. For reasonable values of the mass-loss rate, a typical magnetic field strength such that the magnetic pressure is comparable to the inferred gas pressure in BAL clouds, and a moderate amount of internal soft X-ray absorption, we find that the opening angle of the flow is approximately 0.1 rad, in good agreement with the observed covering factor of the broad absorption line region.

DeKool, Martin↗

Numerical Optimization Using Computer Experiments

Engineering design optimization often gives rise to problems in which expensive objective functions are minimized by derivative-free methods. We propose a method for solving such problems that synthesizes ideas from the numerical optimization and computer experiment literatures. Our approach relies on kriging known function values to construct a sequence of surrogate models of the objective function that are used to guide a grid search for a minimizer. Results from numerical experiments on a standard test problem are presented.

Trosset, Michael W.↗

The Unidentified Infrared Emission Bands: Identified

The so-called Unidentified Infrared or simply UIR bands, the infrared emission band spectrum associated with a wide variety of interstellar objects, can be modeled in detail by laboratory spectra of neutral and positively charged polycyclic aromatic hydrocarbon (PAH) mixtures. Fits are presented for the UIR emission from the protoplanetary nebula IRAS 22272+5435, the diffuse galactic medium, and the Orion HII/photodissociation front - a selection of objects which span the evolutionary range of interstellar material. These data directly address the spectroscopic criticisms previously leveled at the PAH hypothesis and demonstrate that PAH-related molecular species are indeed responsible for this widespread emission. Furthermore, these fits reflect the structure, abundance, and ionization state of the interstellar PAHs and, in turn, provide direct insight into the processes of carbon nucleation, growth and evolution in circumstellar shells and the interstellar medium. To date, no other candidate material which has been proposed to account for the UIR emission can as readily and specifically reproduce these spectral variations. Given the ubiquity of these species, this work demonstrates the tremendous potential of these species as probes of a new and heretofore largely unexplored facet of astrochemistry - potential which should make PAHs the probe of the next millennium much as CO has been for the last quarter century.

Hudgins, Douglas M.↗

Computational Fluid Dynamics Uncertainty Analysis for Payload Fairing Spacecraft Environmental Control Systems

Spacecraft thermal protection systems are at risk of being damaged due to airflow produced from Environmental Control Systems. There are inherent uncertainties and errors associated with using Computational Fluid Dynamics to predict the airflow field around a spacecraft from the Environmental Control System. This proposal describes an approach to validate the uncertainty in using Computational Fluid Dynamics to predict airflow speeds around an encapsulated spacecraft. The research described here is absolutely cutting edge. Quantifying the uncertainty in analytical predictions is imperative to the success of any simulation-based product. The method could provide an alternative to traditional"validation by test only'' mentality. This method could be extended to other disciplines and has potential to provide uncertainty for any numerical simulation, thus lowering the cost of performing these verifications while increasing the confidence in those predictions. Spacecraft requirements can include a maximum airflow speed to protect delicate instruments during ground processing. Computationaf Fluid Dynamics can be used to veritY these requirements; however, the model must be validated by test data. The proposed research project includes the following three objectives and methods. Objective one is develop, model, and perform a Computational Fluid Dynamics analysis of three (3) generic, non-proprietary, environmental control systems and spacecraft configurations. Several commercially available solvers have the capability to model the turbulent, highly three-dimensional, incompressible flow regime. The proposed method uses FLUENT and OPEN FOAM. Objective two is to perform an uncertainty analysis of the Computational Fluid . . . Dynamics model using the methodology found in "Comprehensive Approach to Verification and Validation of Computational Fluid Dynamics Simulations". This method requires three separate grids and solutions, which quantify the error bars around Computational Fluid Dynamics predictions. The method accounts for all uncertainty terms from both numerical and input variables. Objective three is to compile a table of uncertainty parameters that could be used to estimate the error in a Computational Fluid Dynamics model of the Environmental Control System /spacecraft system. Previous studies have looked at the uncertainty in a Computational Fluid Dynamics model for a single output variable at a single point, for example the re-attachment length of a backward facing step. To date, the author is the only person to look at the uncertainty in the entire computational domain. For the flow regime being analyzed (turbulent, threedimensional, incompressible), the error at a single point can propagate into the solution both via flow physics and numerical methods. Calculating the uncertainty in using Computational Fluid Dynamics to accurately predict airflow speeds around encapsulated spacecraft in is imperative to the success of future missions.

Groves, Curtis E.↗

Algorithm Plans Collision-Free Path for Robotic Manipulator

An algorithm has been developed to enable a computer aboard a robot to autonomously plan the path of the manipulator arm of the robot to avoid collisions between the arm and any obstacle, which could be another part of the robot or an external object in the vicinity of the robot. In simplified terms, the algorithm generates trial path segments and tests each segment for potential collisions in an iterative process that ends when a sequence of collision-free segments reaches from the starting point to the destination. The main advantage of this algorithm, relative to prior such algorithms, is computational efficiency: the algorithm is designed to make minimal demands upon the limited computational resources available aboard a robot. This path-planning algorithm utilizes a modified version of the collision-detection method described in "Improved Collision-Detection Method for Robotic Manipulator" (NPO-30356), NASA Tech Briefs, Vol. 27, No. 3 (June 2003), page 72. The method involves utilization of mathematical models of the robot constructed prior to operation and similar models of external objects constructed automatically from sensory data acquired during operation. This method incorporates a previously developed method, known in the art as the method of oriented bounding boxes (OBBs), in which an object is represented approximately, for computational purposes, by a box that encloses its outer boundary. Because many parts of a robotic manipulator are cylindrical, the OBB method has been extended in this method to enable the approximate representation of cylindrical parts by use of octagonal or other multiple-OBB assemblies denoted oriented bounding prisms (OBPs). A multiresolution OBB/OBP representation of the robot and its manipulator arm and a multiresolution OBB representation of external objects (including terrain) are constructed and used in a process in which collisions at successively finer resolutions are detected through computational detection of overlaps between the corresponding OBB and OBP models. For computational efficiency, the process is started at the coarsest resolution and stopped as soon as possible, preferably before reaching the finest resolution. At the coarsest resolution, there is a single OBB enclosing all relevant external objects and a single OBB enclosing the entire robot. At the next finer level of resolution, the coarsest-resolution OBB is divided into two OBBs, and so forth. If no collision is detected at the coarsest resolution, then there is no need for further computation to detect collisions. If a collision is detected at the coarsest resolution, then tests for collisions are performed at the next finer level of resolution. This process is continued to successively finer resolutions until either no more collisions are detected or the finest resolution is reached.

Backes, Paul↗

Start-On-The-Part Transient Model for In-Situ Automated Tape Placement of Thermoplastic Composites

Fabrication of a complex part by automated tape placement (ATP) can require starting up a new tape-end in the part interior, termed start-on-the-part. Careful thermal management of the starting transient is needed to achieve uniform crystallinity and inter-laminar weld strength - which is the objective of this modeling effort. The transient is modeled by a Fourier-Laplace transform solution of the time-dependent thermal transport equation in two spatial dimensions. The solution is subject to a quasi-steady approximation for the speed and length of the consolidation head. Sample calculations are done for the Langley ATP robot applying PEEK/carbon fiber composite and for two upgrades in robot performance. The head starts out almost at rest which meets an engineering requirement for accurate placement of the new tape-end. The head then rapidly accelerates until it reaches its steady state speed. This rapid acceleration, however, violates the quasi-steady approximation, so uniform weld strength and crystallinity during the starting transient are not actually achieved. The solution does give the elapsed time and distance from start-up to validity of the quasi-steady approximation - which quantifies the length of the non-uniform region. The elapsed time was always less than 0.1 s and the elapsed distance less than 1 cm. This quantification would allow the non-uniform region to be either trimmed away or compensated for in the design of a part. Such compensation would require experiments to measure the degree of non-uniformity, because the solution does not provide this information. The rapid acceleration suggests that the consolidation roller or belt be actively synchronized to avoid abrading the tape.

Costen, Robert c.↗

Architecture for spacecraft operations planning

A system which generates plans for the dynamic environment of space operations is discussed. This system synthesizes plans by combining known operations under a set of physical, functional, and temperal constraints from various plan entities, which are modeled independently but combine in a flexible manner to suit dynamic planning needs. This independence allows the generation of a single plan source which can be compiled and applied to a variety of agents. The architecture blends elements of temperal logic, nonlinear planning, and object oriented constraint modeling to achieve its flexibility. This system was applied to the domain of the Intravehicular Activity (IVA) maintenance and repair aboard Space Station Freedom testbed.

Davis, William S.↗

Thermal Modeling Study for Geologic Borehole Conceptual Design - 17148

Instituto de Pesquisas Energeticas e Nucleares (IPEN-CNEN/SP) is developing a strategy for safe, permanent disposal of disused sealed radioactive sources (DSRS) from industrial and medical applications within Brazil. The Institute is proposing modifications to the International Atomic Energy Agency (IAEA) Borehole Disposal of Sealed Radioactive Sources (BOSS) concept originally developed by the Nuclear Energy Corporation of South Africa. The current Brazilian modified design differs from the IAEA design in that the disposal zone is below 300 m versus 30 m of the boss concept, and will be used to dispose of a much larger number of DSRS. These modifications result in a considerable departure from the generic safety case established by IAEA. Therefore, a new safety case is required to assess radiological and thermal impacts among other considerations. Predictive modeling and simulations were performed to address impacts of the proposed borehole concept at the early design stage in order to provide timely improvements to the concept and a traceable rationale for decisions made throughout the program as required by the safety case. Preliminary objectives of the modeling effort were focused on evaluating the mechanical and thermal loads anticipated within the current Brazilian borehole disposal concept in order to assess potential material and design issues. This paper presents the thermal modeling predictions and performance results for the proposed BOSS design. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

A Guideline for the Assessment of Uniaxial Creep and Creep-Fatigue Data and Models

Of primary concern to FE practitioners is a determination of which constitutive models are the “best”, capable of reproducing the mechanisms expected in an intended design accurately; as well as what experimental datasets are proper or “best” to use for fitting the constitutive parameters needed for the model(s) of interest. In addition, the inherent uncertainty in experiments and the repeatability and stability of extrapolations (for long-lived FE components) is a major concern. The goal of this project is to develop a guideline for the assessment of uniaxial creep and creep-fatigue data and models. The research objectives are RO1) develop an aggregated database of creep and creep-fatigue data for P91 steel and 316 stainless steel and perform a systematic assessment of the uncertainty and integrity of the datasets. RO2) employ the database to benchmark existing creep and creep-fatigue models to evaluate the model’s ability to predict standard and nonstandard boundary conditions.

20 FOSSIL-FUELED POWER PLANTS↗