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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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All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

Impacts of hybridization and forecast errors on the probabilistic capacity credit of batteries

Battery storage is increasingly identified as being among the least-cost mix of technologies in the evolving U.S. electricity mix. This study explores the marginal capacity credit of batteries using a probabilistic, reliability-based, effective firm capacity method, which we apply for multiple battery power ratings, durations, coupling types, deployment locations, and dispatch profiles within a test system that is based on the Texas Interconnection in the year 2024. We find that the capacity credits for all battery durations depend on their ability to predict the timing of reliability events. Even 1-2 h forecast errors - resulting in early or delayed battery discharging relative to the onset of a reliability event - lead pronounced capacity credit reductions, especially for 4-h duration batteries. Coupling batteries with solar mitigates the uncertainty associated with a shorter-duration battery's availability during reliability events, primarily due to the relatively high solar capacity credit in our test system. Coupled (or hybrid) system designs with oversized solar arrays, the ability to charge the coupled battery with grid energy, and larger batteries lead to the greatest capacity credit benefits of hybridization. We do not see evidence that the hybrid capacity credit exceeds the sum of the separate battery and solar capacity credits.

24 POWER TRANSMISSION AND DISTRIBUTION↗
DOE OSTI2019

Early Career Award: An Enabling Computational Framework for Uncertainty Assimilation and Propagation in Complex PDE Systems: Sparse and Low-rank Techniques (Final Report)

This project aims to develop a set of new theories, algorithms, and computational tools that enable ultra-scalable representation and propagation of high-dimensional uncertainties to circumvent the issue of curse-of-dimensionality. The research components are motivated by the fact that highly scalable algorithms are needed to achieve exascale performance for uncertainty quantification and predictive simulation at extreme scales. Although these developments are generic and applicable to a wide range of high-dimensional, complex, stochastic, partial-differential-equation (PDE) systems, this research effort will focus on predictive simulation of high-energy-density lithium batteries. To create knowledge about the precise failure mechanisms of these batteries and ultimately predict their performance and reliability, a truly data-driven, multi-scale, multi-physics framework is needed that allows studying (i) dominant sources of uncertainty in the governing physical models at all scales of relevance and (ii) the interface between the interchanging physics and scales. The impact of the planned mathematical and numerical advancements in prediction of high-dimensional uncertain systems will be broad across areas of engineering and science such as climate modeling, fusion energy, combustion, and nanoscience, among others.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2024

High pressure rinse simulations for PIP-II SRF cavities

The implementation of High Pressure Rinse (HPR) not only ensures thorough cleaning of the inner high purity niobium surface of Superconducting Radio Frequency (SRF) cavities but also unlocks their full potential for achieving peak performance. By effectively removing contaminants and impurities, HPR sets the stage for enhanced superconducting properties, improved energy efficiency, and superior operational stability. A simulation tool has been developed, facilitating the accurate prediction of both the quality and effectiveness of the rinsing process before its execution in the cleanroom. This tool, the focus of this paper, stands as a pivotal advancement in optimizing Superconducting Radio Frequency (SRF) cavity preparation. Furthermore, our paper will also present correlations with cavity cold testing results, demonstrating the practical applicability and reliability of the simulation predictions in real-world scenarios.

43 PARTICLE ACCELERATORS↗
DOE OSTI2022

Preliminary Results for Using Uncertainty and Out-of-distribution Detection to Identify Unreliable Predictions.

As machine learning (ML) models are deployed into an ever-diversifying set of application spaces, ranging from self-driving cars to cybersecurity to climate modeling, the need to carefully evaluate model credibility becomes increasingly important. Uncertainty quantification (UQ) provides important information about the ability of a learned model to make sound predictions, often with respect to individual test cases. However, most UQ methods for ML are themselves data-driven and therefore susceptible to the same knowledge gaps as the models themselves. Specifically, UQ helps to identify points near decision boundaries where the models fit the data poorly, yet predictions can score as certain for points that are under-represented by the training data and thus out-of-distribution (OOD). One method for evaluating the quality of both ML models and their associated uncertainty estimates is out-of-distribution detection (OODD). We combine OODD with UQ to provide insights into the reliability of the individual predictions made by an ML model.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2026

Structure-aware Initialization via Numerical Continuation and Informed Priors

Scientific machine learning (SciML) often operates in ill-conditioned, weakly identifiable regimes due to limited data or indirect observations. In such settings, optimization and inference are highly sensitive to the starting point, making initialization--often under-reported--a consequential degree of freedom. Random initialization is not a neutral default as it induces an implicit prior over candidate solutions and can systematically bias the result, producing large run-to-run variability. Here, we formalize this view by treating initialization as a hidden confounder in SciML and develop a unifying theory for structure-aware initialization via numerical continuation, constructing warm starts from related problem instances. Across representative tasks, including physics-informed neural networks, maximum likelihood estimation, and variational inference, warm starts have been shown to consistently reduce optimization effort and improve reliability.

Data integrity↗
DOE OSTI2022

QRF4P-NRT: Probabilistic Post-Processing of Near-Real-Time Satellite Precipitation Estimates Using Quantile Regression Forests

Accurate and reliable near-real-time satellite precipitation estimation is of great importance for operational large-scale flood forecasting and drought monitoring. The state-of-the-art precipitation post-processing model is based on a deterministic approach to construct relationships between satellites estimates and ground observations. We propose a probabilistic postprocessor, the Probabilistic Post-Processing of Near-Real-Time Satellite Precipitation Estimates using Quantile Regression Forests (QRF4P-NRT), based on quantile modeling, yielding both deterministic and probabilistic predictions. The experimental design incorporates different solutions of near-real-time predictors to further improve the model performance. Using the Integrated Multi-satellitE Retrievals Early Run for Global Precipitation Measurement Mission (IMERG-E) product as an example, we illustrate that the proposed method significantly improves the overall quality of the raw IMERG-E and is also superior to the bias-corrected product (IMERG Final Run, IMERG-F) at daily scale in a complex mountain basin. Evaluations of the corrected IMERG-E, raw IMERG-E, and IMERG-F using ground observation show that the corrected IMERG-E improves correlation coefficients (0.7), mean error (-0.14 mm/day) and root mean square error (3.3 mm/day) relative to the raw IMERG-E (0.31, -0.72 and 5.5 mm/day) and IMERG-F (0.34, -0.09 and 6.0 mm/day). The error decomposition further confirms that the QRF4P-NRT improves on the various deficiencies of the raw IMERG-E product. The ensemble assessment also demonstrates that the quantile outputs provide reliable prediction spread and sharp prediction intervals. The promising results indicate the great potential of the proposed method for probabilistic post-processing for near-real-time satellite precipitation estimates, and for further applications such as hydrological ensemble forecasting.

54 ENVIRONMENTAL SCIENCES↗
NASA NTRS1991

Transonic cascade flow prediction using the Navier-Stokes equations

This paper presents results which summarize the work carried out during the last three years to improve the efficiency and accuracy of numerical predictions in turbomachinery flow calculations. A new kind of nonperiodic c-type grid is presented and a Runge-Kutta scheme with accelerating strategies is used as a flow solver. The code capability is presented by testing four different blades at different exit Mach numbers in transonic regimes. Comparison with experiments shows the very good reliability of the numerical prediction. In particular, the loss coefficient seems to be correctly predicted by using the well-known Baldwin-Lomax turbulence model.

Arnone, A.↗
NASA NTRS1995

Pilot opinions on high level flight deck automation issues: Toward the development of a design philosophy

There has been much concern in recent years about the rapid increase in automation on commercial flight decks. The survey was composed of three major sections. The first section asked pilots to rate different automation components that exist on the latest commercial aircraft regarding their obtrusiveness and the attention and effort required in using them. The second section addressed general 'automation philosophy' issues. The third section focused on issues related to levels and amount of automation. The results indicate that pilots of advanced aircraft like their automation, use it, and would welcome more automation. However, they also believe that automation has many disadvantages, especially fully autonomous automation. They want their automation to be simple and reliable and to produce predictable results. The biggest needs for higher levels of automation were in pre-flight, communication, systems management, and task management functions, planning as well as response tasks, and high workload situations. There is an irony and a challenge in the implications of these findings. On the one hand pilots would like new automation to be simple and reliable, but they need it to support the most complex part of the job--managing and planning tasks in high workload situations.

Tenney, Yvette J.↗
NASA NTRSDate not supplied

NAIRAS Model Nowcasting and Forecasting of the Aviation Radiation Environment

The Nowcast of Aerospace Ionizing RAdiation System (NAIRAS) predicts dosimetric quantities for quantifying human radiation exposure and differential/integral flux/fluence quantities for assessing single event effects (SEE) in avionic systems from galactic cosmic rays (GCR), trapped inner belt protons, and solar energetic particle (SEP) events from the Earth’s surface to the space environment. Real-time predictions of the aviation radiation environment are available at NASA Goddard Space Flight Center’s Community Coordinated Modeling Center (CCMC) integrated Space Weather Analysis (iSWA) data feeds and cygnets, and a run-on-request (RoR) capability has also been deployed at CCMC. Recent model improvements include a more accurate atmospheric ionizing radiation transport methodology and more robust and reliable SEP nowcast dose predictions. In addition, preliminary results of SEP dose forecasts are shown by coupling the University of Malaga Solar Energetic Particle (UMASEP) model of integral proton flux forecasts with the NAIRAS model. These model updates and improvements are presented, and results are shown for aircraft, high-latitude balloon, and low-Earth orbit flights during quiescent and solar-geomagnetic disturbed conditions. Model comparisons with flight measurements are also shown.

NAIRAS↗
DOE OSTI2019

A Prognostics and Health Management Framework for Wind

Operation and maintenance costs are a major driver for levelized cost of energy of wind power plants and can be reduced through optimized operation and maintenance practices accomplishable by various prognostics and health management (PHM) technologies. In recent years, the wind industry has become more open to adopting PHM solutions, especially those focusing on diagnostics. However, prognostics activities are, in general, still at the research and development stage. On the other hand, the industry has a request to estimate a component's remaining useful life (RUL) when it has faulted, and this is a key output of prognostics. Systematically presenting PHM technologies to the wind industry by highlighting the RUL prediction need potentially helps speed up its acceptance and provides more benefits from PHM to the industry. In this paper, we introduce a PHM for wind framework. It highlights specifics unique to wind turbines and features integration of data and physics domain information and models. The output of the framework focuses on RUL prediction. To demonstrate its application, a data domain method for wind turbine gearbox fault diagnostics is presented. It uses supervisory control and data acquisition system time series data, normalizes gearbox temperature measurements with reference to environmental temperature and turbine power, and leverages big data analytics and machine-learning techniques to make the model scalable and the diagnostics process automatic. Another physics-domain modeling method for RUL prediction of wind turbine gearbox high-speed-stage bearings failed by axial cracks is also discussed. Bearing axial cracking has been shown to be the prevalent wind turbine gearbox failure mode experienced in the field and is different from rolling contact fatigue, which is targeted during the bearing design stage. The method uses probability of failure as a component reliability assessment and RUL prediction metric, which can be expanded to other drivetrain components or failure modes. The presented PHM for wind framework is generic and applicable to both land-based and offshore wind turbines.

17 WIND ENERGY↗
NASA NTRS1993

Probabilistic and structural reliability analysis of laminated composite structures based on the IPACS code

Probabilistic predictions based on the Integrated Probabilistic Assessment of Composite Structures (IPACS) code are presented for the material and structural response of unnotched and notched, 1M6/3501-6 Gr/Ep laminates. Comparisons of predicted and measured modulus and strength distributions are given for unnotched unidirectional, cross-ply, and quasi-isotropic laminates. The predicted modulus distributions were found to correlate well with the test results for all three unnotched laminates. Correlations of strength distributions for the unnotched laminates are judged good for the unidirectional laminate and fair for the cross-ply laminate, whereas the strength correlation for the quasi-isotropic laminate is deficient because IPACS did not yet have a progressive failure capability. The paper also presents probabilistic and structural reliability analysis predictions for the strain concentration factor (SCF) for an open-hole, quasi-isotropic laminate subjected to longitudinal tension. A special procedure was developed to adapt IPACS for the structural reliability analysis. The reliability results show the importance of identifying the most significant random variables upon which the SCF depends, and of having accurate scatter values for these variables.

Sobel, Larry↗
DOE OSTI2025

Scalable Bayesian Physics-Informed Kolmogorov-Arnold Networks

Uncertainty quantification (UQ) plays a pivotal role in scientific machine learning, especially when surrogate models are used to approximate complex systems. Although multilayer perceptions (MLPs) are commonly employed as surrogates, they often suffer from overfitting due to their large number of parameters. Kolmogorov-Arnold networks (KANs) offer an alternative solution with fewer parameters. However, gradient-based inference methods, such as Hamiltonian Monte Carlo (HMC), may result in computational inefficiency when applied to KANs, especially for large-scale datasets, due to the high cost of back-propagation. To address these challenges, we propose a novel approach, combining the dropout Tikhonov ensemble Kalman inversion (DTEKI) with Chebyshev KANs. This gradient-free method effectively mitigates overfitting and enhances numerical stability. In addition, we incorporate the active subspace method to reduce the parameter-space dimensionality, allowing us to improve the accuracy of predictions and obtain more reliable uncertainty estimates. Extensive experiments demonstrate the efficacy of our approach in various test cases, including scenarios with large datasets and high noise levels. Our results show that the new method achieves comparable or better accuracy, much higher efficiency as well as stability compared to HMC, in addition to scalability. Moreover, by leveraging the low-dimensional parameter subspace, our method preserves prediction accuracy while substantially reducing further the computational cost.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS2014

Investigation of HZETRN 2010 as a Tool for Single Event Effect Qualification of Avionics Systems

NASA's future missions are focused on long-duration deep space missions for human exploration which offers no options for a quick emergency return to Earth. The combination of long mission duration with no quick emergency return option leads to unprecedented spacecraft system safety and reliability requirements. It is important that spacecraft avionics systems for human deep space missions are not susceptible to Single Event Effect (SEE) failures caused by space radiation (primarily the continuous galactic cosmic ray background and the occasional solar particle event) interactions with electronic components and systems. SEE effects are typically managed during the design, development, and test (DD&T) phase of spacecraft development by using heritage hardware (if possible) and through extensive component level testing, followed by system level failure analysis tasks that are both time consuming and costly. The ultimate product of the SEE DD&T program is a prediction of spacecraft avionics reliability in the flight environment produced using various nuclear reaction and transport codes in combination with the component and subsystem level radiation test data. Previous work by Koontz, et al.1 utilized FLUKA, a Monte Carlo nuclear reaction and transport code, to calculate SEE and single event upset (SEU) rates. This code was then validated against in-flight data for a variety of spacecraft and space flight environments. However, FLUKA has a long run-time (on the order of days). CREME962, an easy to use deterministic code offering short run times, was also compared with FLUKA predictions and in-flight data. CREME96, though fast and easy to use, has not been updated in several years and underestimates secondary particle shower effects in spacecraft structural shielding mass. Thus, this paper will investigate the use of HZETRN 20103, a fast and easy to use deterministic transport code, similar to CREME96, that was developed at NASA Langley Research Center primarily for flight crew ionizing radiation dose assessments. HZETRN 2010 includes updates to address secondary particle shower effects more accurately, and might be used as another tool to verify spacecraft avionics system reliability in space flight SEE environments.

Rojdev, Kristina↗
NASA NTRS2006

The Art and Science of Long-Range Space Weather Forecasting

Long-range space weather forecasts are akin to seasonal forecasts of terrestrial weather. We don t expect to forecast individual events but we do hope to forecast the underlying level of activity important for satellite operations and mission pl&g. Forecasting space weather conditions years or decades into the future has traditionally been based on empirical models of the solar cycle. Models for the shape of the cycle as a function of its amplitude become reliable once the amplitude is well determined - usually two to three years after minimum. Forecasting the amplitude of a cycle well before that time has been more of an art than a science - usually based on cycle statistics and trends. Recent developments in dynamo theory -the theory explaining the generation of the Sun s magnetic field and the solar activity cycle - have now produced models with predictive capabilities. Testing these models with historical sunspot cycle data indicates that these predictions may be highly reliable one, or even two, cycles into the future.

Hathaway, David H.↗
NASA NTRS1991

Development of a calibrated software reliability model for flight and supporting ground software for avionic systems

The object of this project was to develop and calibrate quantitative models for predicting the quality of software. Reliable flight and supporting ground software is a highly important factor in the successful operation of the space shuttle program. The models used in the present study consisted of SMERFS (Statistical Modeling and Estimation of Reliability Functions for Software). There are ten models in SMERFS. For a first run, the results obtained in modeling the cumulative number of failures versus execution time showed fairly good results for our data. Plots of cumulative software failures versus calendar weeks were made and the model results were compared with the historical data on the same graph. If the model agrees with actual historical behavior for a set of data then there is confidence in future predictions for this data. Considering the quality of the data, the models have given some significant results, even at this early stage. With better care in data collection, data analysis, recording of the fixing of failures and CPU execution times, the models should prove extremely helpful in making predictions regarding the future pattern of failures, including an estimate of the number of errors remaining in the software and the additional testing time required for the software quality to reach acceptable levels. It appears that there is no one 'best' model for all cases. It is for this reason that the aim of this project was to test several models. One of the recommendations resulting from this study is that great care must be taken in the collection of data. When using a model, the data should satisfy the model assumptions.

Lawrence, Stella↗
NASA NTRS2003

Superalloy Disk With Dual-Grain Structure Spin Tested

Advanced nickel-base disk alloys for future gas turbine engines will require greater temperature capability than current alloys, but they must also continue to deliver safe, reliable operation. An advanced, nickel-base disk alloy, designated Alloy 10, was selected for evaluation in NASA s Ultra Safe Propulsion Project. Early studies on small test specimens showed that heat treatments that produced a fine grain microstructure promoted high strength and long fatigue life in the bore of a disk, whereas heat treatments that produced a coarse grain microstructure promoted optimal creep and crack growth resistance in the rim of a disk. On the basis of these results, the optimal combination of performance and safety might be achieved by utilizing a heat-treatment technology that could produce a fine grain bore and coarse grain rim in a nickel-base disk. Alloy 10 disks that were given a dual microstructure heat treatment (DMHT) were obtained from NASA s Ultra-Efficient Engine Technology (UEET) Program for preliminary evaluation. Data on small test specimens machined from a DMHT disk were encouraging. However, the benefit of the dual grain structure on the performance and reliability of the entire disk still needed to be demonstrated. For this reason, a high temperature spin test of a DMHT disk was run at 20 000 rpm and 1500 F at the Balancing Company of Dayton, Ohio, under the direction of NASA Glenn Research Center personnel. The results of that test showed that the DMHT disk exhibited significantly lower crack growth than a disk with a fine grain microstructure. In addition, the results of these tests could be accurately predicted using a two-dimensional, axisymmetric finite element analysis of the DMHT disk. Although the first spin test demonstrated a significant performance advantage associated with the DMHT technology, a second spin test on the DMHT disk was run to determine burst margin. The disk burst in the web at a very high speed, over 39 000 rpm, in line with the predicted location and speed. Furthermore, significant growth of the disk was observed before failure, in line with predictions, clearly demonstrating the reliability and safety of the DMHT technology. Although successful spin testing in Ultra Safe's Nickel Disk Program represents a significant milestone for DMHT technology, realistic engine operation will require repeated loading of a DMHT nickel disk. For this reason, a cyclic spin test study of DMHT nickel disk technology has been proposed to start in fiscal year 2003 under NASA's Aviation Safety Program. The goal of this program will be to determine the fatigue failure mechanism in DMHT nickel disks, thereby demonstrating the reliability and safety of DMHT technology under repetitive loading conditions encountered in realistic engine operation.

Gayda, John↗
DOE OSTI2025

Physics-Based Analysis of Cell Imbalances and Aging in Lithium-Ion Battery Modules and Packs

Lithium-ion battery (LIB) packs are a key solution for grid-scale energy storage, enabling grid resilience and supporting critical infrastructure. LIB modules and packs experience current imbalances and uneven cell aging due to various design and operational factors, and require a battery management system (BMS) to continuously monitor and control. In this context, a physics-based modeling framework for LIB modules and packs (liionpack) was enhanced to identify design and control strategies that minimize current imbalance and improve module/pack operation. Simulations of an 8-cell parallel-connected module demonstrate that reducing current imbalance leads to more uniform cell aging and improved module/pack-level degradation predictions. The analysis shows that current imbalance are affected by the electrical resistances. Terminal location significantly affects imbalance, with opposite-end terminal connections at intermediate branches minimizing the imbalance, and the pack circuit construction influences the accuracy of physics-based analysis at the pack scale. This framework enables design optimization of modules and packs through a fast and easy evaluation of pack performance and aging, and supports the development of aging-informed balancing strategies compatible with BMS implementation. Thereby, offering practical pathways to improve reliability and cycle life predictions in large-scale battery energy storage systems.

Ayalasomayajula, Surya Mitra [Oak Ridge National L↗
DOE OSTI2019

Cp* Noninnocence Leads to a Remarkably Weak C–H Bond via Metallocene Protonation

Metallocenes, including their permethylated variants, are extremely important in organometallic chemistry. In particular, many are synthetically useful either as oxidants (e.g., Cp 2 Fe + ) or as reductants (e.g., Cp 2 Co, Cp* 2 Co, and Cp* 2 Cr). The latter have proven to be useful reagents in the reductive protonation of small-molecule substrates, including N 2 . As such, understanding the behavior of these metallocenes in the presence of acids is paramount. In the present study, we undertake the rigorous characterization of the protonation products of Cp* 2 Co using pulse electron paramagnetic resonance (EPR) techniques at low temperature. We provide unequivocal evidence for the formation of the ring-protonated isomers Cp*(exo/endo-η 4 -C 5 Me 5 H)Co + . Variable temperature Q-band (34 GHz) pulse EPR spectroscopy, in conjunction with density functional theory (DFT) predictions, are key to reliably assigning the Cp*(exo/endo-η 4 -C 5 Me 5 H)Co + species. We also demonstrate that exo-protonation selectivity can be favored by using a bulkier acid and suggest this species is thus likely a relevant intermediate during catalytic nitrogen fixation given the bulky anilinium acids employed. Of further interest, we provide physical data to experimentally assess the C–H bond dissociation free energy (BDFE C–H ) for Cp*(exo-η 4 -C 5 Me 5 H)Co + . These experimental data support our prior DFT predictions of an exceptionally weak C–H bond (<29 kcal mol –1 ), making this system among the most reactive (with respect to C–H bond strength) to be thoroughly characterized. Furthermore, these data also point to the propensity of Cp*(exo-η 4 -C 5 Me 5 H)Co to mediate hydride (H – ) transfer. Our findings are not limited to the present protonated metallocene system. Accordingly, we outline an approach to rationalizing the reactivity of arene-protonated metal species, using decamethylnickelocene as an additional example.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗