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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 OSTI2018

Multi-Timescale Three-Phase Unbalanced Distribution System Operation With Variable Renewable Generations

This paper proposes a multi-timescale operational approach for a three-phase unbalanced distribution system, which contains hourly scheduling at substation level and minutes power flow operation at feeder level. In the substation scheduling model, the objective is to minimize the system cost with variable renewable generations. The given error distribution model of renewable generation is formulated as a chance constraint, and derived into a deterministic form by Gaussian mixture model (GMM) with genetic algorithm-based expectation-maximization (GAEM). In the feeder scheduling model, the system cost is further reduced with the optimal power flow (OPF) at a timescale of minutes. Considering the nonconvexity of the three-phase unbalanced OPF problem in distribution systems, the semidefinite programming (SDP) is used to relax the problem into a convex problem, and a distributed computation approach is built based on alternating direction method of multiplier (ADMM). The IEEE 123-bus distribution system, DU (University of Denver) campus distribution system, and the IEEE 8500-bus distribution system are used as the test bench for the proposed approach. And the numerical results demonstrate the effectiveness and validity of the proposed method.

24 POWER TRANSMISSION AND DISTRIBUTION↗
DOE OSTI2018

Development of a characterization methodology for post-irradiation examination of miniature fuel specimens

The miniature fuel (MiniFuel) irradiation experimental design at Oak Ridge National Laboratory (ORNL) enables benchmark testing and separate effects testing of novel fuel types in the High Flux Isotope Reactor (HFIR) in support of the Advanced Fuels Campaign (AFC). The first round of MiniFuel sub-capsules will be available for post-irradiation examination at the end of 2018. This report establishes the procedure for disassembly, fuel retrieval, post-irradiation analysis of the fission product behavior (fission gas release and fuel swelling), and microstructural characterization of the irradiated MiniFuel specimens. All methods were tested and validated out-of-cell and are ready to be implemented in-cell for use on the first set of irradiated MiniFuel specimens. The path forward regarding further characterization techniques is presented, which will involve analyzing other specimen geometries using the methods presented in this report and expanding the post-irradiation analysis of MiniFuel specimens to include additional properties.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2016

Cone-Beam Computed Tomography Internal Motion Tracking Should Be Used to Validate 4-Dimensional Computed Tomography for Abdominal Radiation Therapy Patients

Purpose: To demonstrate that fiducial tracking during pretreatment Cone-Beam CT (CBCT) can accurately measure tumor motion and that this method should be used to validate 4-dimensional CT (4DCT) margins before each treatment fraction. Methods and Materials: For 31 patients with abdominal tumors and implanted fiducial markers, tumor motion was measured daily with CBCT and fluoroscopy for 202 treatment fractions. Fiducial tracking and maximum-likelihood algorithms extracted 3-dimensional fiducial trajectories from CBCT projections. The daily internal margin (IM) (ie, range of fiducial motion) was calculated for CBCT and fluoroscopy as the 5th-95th percentiles of displacement in each cardinal direction. The planning IM from simulation 4DCT (IM{sub 4DCT}) was considered adequate when within ±1.2 mm (anterior–posterior, left–right) and ±3 mm (superior–inferior) of the daily measured IM. We validated CBCT fiducial tracking as an accurate predictive measure of intrafraction motion by comparing the daily measured IM{sub CBCT} with the daily IM measured by pretreatment fluoroscopy (IM{sub pre-fluoro}); these were compared with pre- and posttreatment fluoroscopy (IM{sub fluoro}) to identify those patients who could benefit from imaging during treatment. Results: Four-dimensional CT could not accurately predict intrafractional tumor motion for ≥80% of fractions in 94% (IM{sub CBCT}), 97% (IM{sub pre-fluoro}), and 100% (IM{sub fluoro}) of patients. The IM{sub CBCT} was significantly closer to IM{sub pre-fluoro} than IM{sub 4DCT} (P<.01). For patients with median treatment time t < 7.5 minutes, IM{sub CBCT} was in agreement with IM{sub fluoro} for 93% of fractions (superior–inferior), compared with 63% for the t > 7.5 minutes group, demonstrating the need for patient-specific intratreatment imaging. Conclusions: Tumor motion determined from 4DCT simulation does not accurately predict the daily motion observed on CBCT or fluoroscopy. Cone-beam CT could replace fluoroscopy for pretreatment verification of simulation IM{sub 4DCT}, reducing patient setup time and imaging dose. Patients with treatment time t > 7.5 minutes could benefit from the addition of intratreatment imaging.

62 RADIOLOGY AND NUCLEAR MEDICINE↗
DOE OSTI2015

Two-body potential model based on cosine series expansion for ionic materials

There is a method to construct a two-body potential model for ionic materials with a Fourier series basis and we examine it. For this method, the coefficients of cosine basis functions are uniquely determined by solving simultaneous linear equations to minimize the sum of weighted mean square errors in energy, force and stress, where first-principles calculation results are used as the reference data. As a validation test of the method, potential models for magnesium oxide are constructed. The mean square errors appropriately converge with respect to the truncation of the cosine series. This result mathematically indicates that the constructed potential model is sufficiently close to the one that is achieved with the non-truncated Fourier series and demonstrates that this potential virtually provides minimum error from the reference data within the two-body representation. The constructed potential models work appropriately in both molecular statics and dynamics simulations, especially if a two-step correction to revise errors expected in the reference data is performed, and the models clearly outperform two existing Buckingham potential models that were tested. Moreover, the good agreement over a broad range of energies and forces with first-principles calculations should enable the prediction of materials behavior away from equilibrium conditions, such as a system under irradiation.

36 MATERIALS SCIENCE↗
DOE OSTI2022

Deep-learning-guided high-resolution subsurface reflectivity imaging with application to ground-penetrating radar data

Subsurface reflectivity imaging is one of the most important geophysical characterization methods for revealing subsurface structures. In many cases, accurate subsurface reflectivity imaging is challenging because of, for example, random or coherent noise in the data and sparse source-receiver observation geometry. Here, we develop a deep-learning-guided iterative imaging method to improve subsurface structure imaging. Specifically, we train a supervised neural network to infer a noise-free, high-resolution image from a noisy, low-resolution image and use this estimated image as guidance to regularize least-squares imaging. We develop a systematic method to generate high-quality synthetic training data (data-label pairs) to train the guidance neural network. The trained neural network can provide high-fidelity predictions even for field-data images that are not in the training data. We validate our new imaging method using one synthetic and two field ground-penetrating radar data examples, and find that our method can produce clean, high-resolution subsurface reflectivity images where existing single-pass and least-squares imaging methods fail due to noise and insufficient data coverage.

58 GEOSCIENCES↗
DOE OSTI2025

Learning-Based Quantum Compilation: Translating QASM to QIR with CodeBERT

We propose a learning-based approach to quantum compilation by translating OpenQASM to Quantum Intermediate Representation (QIR) using a fine-tuned CodeBERT model. Trained on 10,000 synthetic QASM-QIR pairs, the model captures code semantics while addressing QIR verbosity and the 512-token limit via a custom token compression scheme. Finetuning was performed on the Frontier supercomputer, with results showing syntactic correctness and stable validation loss reduction. Our method moves toward enabling flexible, language-modeldriven quantum software tools. It also introduces syntax error handling and the possibility of incorporating classical control constructs, addressing limitations in existing rule-based compilers like qBraid-QIR. While the current model has been validated on quantum-only circuits, we propose future evaluations on hybrid quantum-classical examples. This poster will provide architecture insights, compression examples, training loss plots, and QIR outputs. Our work highlights the potential for scalable, adaptable compilation in future quantum toolchains.

Afrose, Sharmin [ORNL]↗
DOE OSTI2021

New methods to improve the vertical extrapolation of near-surface offshore wind speeds

Accurate characterization of the offshore wind resource has been hindered by a sparsity of wind speed observations that span offshore wind turbine rotor-swept heights. Although public availability of floating lidar data is increasing, most offshore wind speed observations continue to come from buoy-based and satellite-based near-surface measurements. The aim of this study is to develop and validate novel vertical extrapolation methods that can accurately estimate wind speed time series across rotor-swept heights using these near-surface measurements. We contrast the conventional logarithmic profile against three novel approaches: a logarithmic profile with a long-term stability correction, a single-column model, and a machine-learning model. These models are developed and validated using 1 year of observations from two floating lidars deployed in US Atlantic offshore wind energy areas. We find that the machine-learning model significantly outperforms all other models across all stability regimes, seasons, and times of day. Machine-learning model performance is considerably improved by including the air–sea temperature difference, which provides some accounting for offshore atmospheric stability. Finally, we find no degradation in machine-learning model performance when tested 83 km from its training location, suggesting promising future applications in extrapolating 10 m wind speeds from spatially resolved satellite-based wind atlases.

17 WIND ENERGY↗
DOE OSTI2018

Automated Separation of Uranium and Plutonium from Environmental Swipe Samples for Multiple Collector Inductively Coupled Plasma Mass Spectrometry

A fully automated method for the separation of low-concentration uranium from plutonium in environmental swipe samples has been developed. The offline chromatography system features renewable 1 mL Eichrom TEVA and UTEVA column generation from bulk resin slurry. Discrete fractions of the separated actinides are delivered into user defined vials for future analysis. Clean room background levels were achieved outside of a cleanroom environment with this method. Purification of uranium and plutonium from various sample matrixes and at various concentrations was successful. Major and minor isotope ratios for both elements were measured via multiple collector inductively coupled plasma mass spectrometry and were in good agreement with certified reference values. Lastly, validation of the separation method was conducted on archived environmental samples and agreed with values previously reported using standard column chemistry.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

An Integrated Study on a Novel High Temperature High Entropy Alloy

This report summarizes our recent works of theoretical modeling, simulation, and experimental validation of the simulation results on the new refractory high entropy alloy (HEA) design and oxide doped refractory HEA research. The simulation of the stability and thermal dynamics simulation on potential thermal stable candidates were performed and related HEA with oxide doped samples were synthesized and characterized. The HEA ab initio density functional theory and molecular dynamics physical property simulation methods and experimental texture validation techniques development, achievements already reached, course work development, students and postdoc training, and future improvement research directions are briefly introduced.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Simulation-aided occupant-centric building design: A critical review of tools, methods, and applications

Occupants are active participants in their built environment, affecting its performance while simultaneously being affected by its design and indoor environmental conditions. With recent advances in computer modeling, simulation tools, and analysis techniques, topics such as human-building interactions and occupant behavior have gained significant interest in the literature given their premise of improving building design processes and operating strategies. In practice, the focus of occupant-centric literature has been mostly geared towards the latter (i.e., operation), leaving the implications on building design practices underexplored. This paper fills the gap by providing a critical review of existing studies applying computer-based modeling and simulation to guide occupant-centric building design. The reviewed papers are organized along four main themes, namely occupant-centric: (i) metrics of building performance, (ii) modeling and simulation approaches, (iii) design methods and applications, and (iv) supporting practices and mechanisms. Important barriers are identified for a more effective application of occupant-centric building design practices, including the limited consideration of metrics beyond energy efficiency (e.g., occupant well-being and space planning), the limited implementation and validation of the proposed methods, and the lack of integration of occupant behavior modeling in existing building performance simulation tools. Finally, future research directions are discussed, covering large-scale international data collection efforts to move from generic assumptions about occupant behavior to specific/localized knowledge, improved metrics of measuring building performance, and improved industry practices, such as building codes, to promote an occupant-in-the-loop approach to the building design process.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2017

Electromagnetic pulse excitation of finite- and infinitely-long lossy conductors over a lossy ground plane

This study details a model for the response of a finite- or an infinite-length wire interacting with a conducting ground to an electromagnetic pulse excitation. We develop a frequency–domain method based on transmission line theory that we name ATLOG – Analytic Transmission Line Over Ground. This method is developed as an alternative to full-wave methods, as it delivers a fast and reliable solution. It allows for the treatment of finite or infinite lossy, coated wires, and lossy grounds. The cases of wire above ground, as well as resting on the ground and buried beneath the ground are treated. The reported method is general and the time response of the induced current is obtained using an inverse Fourier transform of the current in the frequency domain. The focus is on the characteristics and propagation of the transmission line mode. Comparisons with full-wave simulations strengthen the validity of the proposed method.

25 ENERGY STORAGE↗
DOE OSTI2025

A Climatology and Life‐Cycle Characteristics of Atmospheric Fronts and Their Associated Precipitation

Abstract Atmospheric fronts are one of the main sources of mid‐latitude variability. We employ a novel method for identifying and tracking fronts and frontal precipitation. Thermal and dynamical variables are used to identify fronts as areal objects in space, which are tracked in time using the open‐source TempestExtremes software package. Precipitation objects are co‐located to identify frontal precipitation. The method is subjected to validation and sensitivity tests using manually curated data from the National Weather Service. Climatologies of fronts and frontal precipitation are computed from reanalysis and observations; fronts are present upwards of 14% of the time in the storm tracks, and represent the majority (up to 90%) of total and extreme precipitation. Novel aspects of the method are showcased through the lifetime characteristics of fronts across North America. Three sets of warm and cold fronts were discovered, and their duration, distance‐traveled, and translation velocity are examined. Plain Language Summary Mid‐latitude low‐pressure systems and weather fronts are important for our day‐to‐day experience of weather events, particularly in the mid‐latitudes. This work makes use of standardized atmospheric data and creates a method of automatically tracking these important atmospheric features and their precipitation to quantify their relative role in global precipitation. Weather fronts are persistent in the mid‐latitudes and are associated with the majority of precipitation–particularly the most intense precipitation. Trajectories of fronts over North America are categorized to create a set of archetypal fronts that occur in that region. The differences between these types of fronts are characterized. Key Points An automated, efficient, and skillful frontal detection algorithm is developed and validated Fronts contribute a larger fraction of extreme precipitation than all precipitation in mid‐latitude storm tracks Fronts across North America have substantial variation in characteristics depending on their origin location

extratropical cyclone↗
DOE OSTI2017

A novel approach to evaluate soil heat flux calculation: An analytical review of nine methods

Abstract There are no direct methods to evaluate calculated soil heat flux (SHF) at the surface ( G 0 ). Instead, validation and cross evaluation of methods for calculating G 0 usually rely on the conventional calorimetric method or the degree of the surface energy balance closure. However, there is uncertainty in the calorimetric method itself, and factors apart from G 0 also contribute to nonclosure of the surface energy balance. Here we used a novel approach to evaluate nine different methods for calculating SHF, including the calorimetric method and methods based on analytical solutions of the heat diffusion equation. The SHF ( G z ) measured by a self‐calibrating SHF plate at a depth of z = 5 cm below the surface (hereafter G m _5 cm ) was deployed as a reference. Each SHF calculation method was assessed by comparing the calculated G z at the same depth (hereafter G c _5 cm ) with G m _5 cm . The calorimetric method and simple measurement method performed best in determining G c _5 cm but still underestimated G m _5 cm by 19% during the daytime. Possible causes for this underestimation include errors and uncertainties in SHF measurements and soil thermal properties, as well as the phase lag between G c _5 cm and G m _5 cm . Our results indicate that the calorimetric method achieves the most accurate SHF estimates if self‐calibrating SHF plates are deployed at two depths (e.g., 5 cm and 10 cm), soil temperature and water content measurements are made in a few depths between the two plates, and soil thermal properties are accurately quantified.

Gao, Zhongming↗
DOE OSTI2013

Algorithmic scatter correction in dual-energy digital mammography

Purpose: Small calcifications are often the earliest and the main indicator of breast cancer. Dual-energy digital mammography (DEDM) has been considered as a promising technique to improve the detectability of calcifications since it can be used to suppress the contrast between adipose and glandular tissues of the breast. X-ray scatter leads to erroneous calculations of the DEDM image. Although the pinhole-array interpolation method can estimate scattered radiations, it requires extra exposures to measure the scatter and apply the correction. The purpose of this work is to design an algorithmic method for scatter correction in DEDM without extra exposures.Methods: In this paper, a scatter correction method for DEDM was developed based on the knowledge that scattered radiation has small spatial variation and that the majority of pixels in a mammogram are noncalcification pixels. The scatter fraction was estimated in the DEDM calculation and the measured scatter fraction was used to remove scatter from the image. The scatter correction method was implemented on a commercial full-field digital mammography system with breast tissue equivalent phantom and calcification phantom. The authors also implemented the pinhole-array interpolation scatter correction method on the system. Phantom results for both methods are presented and discussed. The authors compared the background DE calcification signals and the contrast-to-noise ratio (CNR) of calcifications in the three DE calcification images: image without scatter correction, image with scatter correction using pinhole-array interpolation method, and image with scatter correction using the authors' algorithmic method.Results: The authors' results show that the resultant background DE calcification signal can be reduced. The root-mean-square of background DE calcification signal of 1962 μm with scatter-uncorrected data was reduced to 194 μm after scatter correction using the authors' algorithmic method. The range of background DE calcification signals using scatter-uncorrected data was reduced by 58% with scatter-corrected data by algorithmic method. With the scatter-correction algorithm and denoising, the minimum visible calcification size can be reduced from 380 to 280 μm.Conclusions: When applying the proposed algorithmic scatter correction to images, the resultant background DE calcification signals can be reduced and the CNR of calcifications can be improved. This method has similar or even better performance than pinhole-array interpolation method in scatter correction for DEDM; moreover, this method is convenient and requires no extra exposure to the patient. Although the proposed scatter correction method is effective, it is validated by a 5-cm-thick phantom with calcifications and homogeneous background. The method should be tested on structured backgrounds to more accurately gauge effectiveness.

62 RADIOLOGY AND NUCLEAR MEDICINE↗
DOE OSTI2015

On the accuracy of Hipparcos using binary stars as a calibration tool

Stellar binary systems, specifically those that present the most accurate available orbital elements, are a reliable tool to test the accuracy of astrometric observations. We selected all 35 binaries with these characteristics. Our objective is to provide standard uncertainties for the positions and parallaxes measured by Hipparcos relative to this trustworthy set, as well as to check supposed correlations between several parameters (measurement residuals, positions, magnitudes, and parallaxes). In addition, using the high-confidence subset of visual–spectroscopic binaries, we implemented a validation test of the Hipparcos trigonometric parallaxes of binary systems that allowed the evaluation of their reliability. Standard and non-standard statistical analysis techniques were applied in order to achieve well-founded conclusions. In particular, errors-in-variables models such as the total least-squares method were used to validate Hipparcos parallaxes by comparison with those obtained directly from the orbital elements. Previously, we executed Thompson's τ technique in order to detect suspected outliers in the data. Furthermore, several statistical hypothesis tests were carried out to verify if our results were statistically significant. A statistically significant trend indicating larger Hipparcos angular separations with respect to the reference values in 5.2 ± 1.4 mas was found at the 10{sup −8} significance level. Uncertainties in the polar coordinates θ and ρ of 1.°8 and 6.3 mas, respectively, were estimated for the Hipparcos observations of binary systems. We also verified that the parallaxes of binary systems measured in this mission are absolutely compatible with the set of orbital parallaxes obtained from the most accurate orbits at least at the 95% confidence level. This methodology allows us to better estimate the accuracy of Hipparcos observations of binary systems. Indeed, further application to the data collected by Gaia should yield a standard procedure to compare both data sets.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2019

Towards Hyper-Dimensional Variography Using the Product-Sum Covariance Model

Modeling hyper-dimensional spatial variability is a complex task from both practical and theoretical standpoints. In this paper we develop a method for modeling hyper-dimensional covariance (variogram) structures using the product-sum covariance model initially developed to model spatio-temporal variability. We show that the product-sum model can be used recursively up to an arbitrarily large number of dimensions while preserving relative modeling simplicity and yielding valid covariance models. The method can be used to model variability in anisotropic conditions with multiple axes of anisotropy or when temporal evolution is involved, and thus is applicable to “full anisotropic 3D+time” situations often encountered in environmental sciences. It requires fewer assumptions than the traditional product-sum modeling approach. The new method also presents an alternative to classical approaches to modeling zonal anisotropy and requires fewer parameters to be estimated from data. We present an example by applying the method in conjunction with ordinary kriging to map photosynthetically-active radiation (PAR) for 2006, in Oklahoma, CA, USA and to explore effects of spatio-temporal variability in PAR on gross primary productivity (GPP).

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2024

An Empirical Model For Intrinsic Alignments: Insights From Cosmological Simulations

We extend current models of the halo occupation distribution (HOD) to include a flexible, empirical framework for the forward modeling of the intrinsic alignment (IA) of galaxies. A primary goal of this work is to produce mock galaxy catalogs for the purpose of validating existing models and methods for the mitigation of IA in weak lensing measurements. This technique can also be used to produce new, simulation-based predictions for IA and galaxy clustering. Our model is probabilistically formulated, and rests upon the assumption that the orientations of galaxies exhibit a correlation with their host dark matter (sub)halo orientation or with their position within the halo. We examine the necessary components and phenomenology of such a model by considering the alignments between (sub)halos in a cosmological dark matter only simulation. We then validate this model for a realistic galaxy population in a set of simulations in the Illustris-TNG suite. We create an HOD mock with Illustris-like correlations using our method, constraining the associated IA model parameters, with the $\mathcal{X}$$^{2}_{dof}$ between our model’s correlations and those of Illustris matching as closely as 1.4 and 1.1 for orientation–position and orientation–orientation correlation functions, respectively. By modeling the misalignment between galaxies and their host halo, we show that the 3-dimensional two-point position and orientation correlation functions of simulated (sub)halos and galaxies can be accurately reproduced from quasi-linear scales down to 0.1 $\mathcal{h}$ –1 Mpc. We also find evidence for environmental influence on IA within a halo. Our publicly-available software provides a key component enabling efficient determination of Bayesian posteriors on IA model parameters using observational measurements of galaxy-orientation correlation functions in the highly nonlinear regime.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2018

Validation of Statistical Uncertainties in Subcritical Benchmark Measurements: Part I - Theory and Simulations

Subcritical neutron noise measurements are often used to determine multiplication of a system with Special Nuclear Material. This work presents an uncertainty approach which incorporates the singles and doubles counting rates determined by the Hage-Cifarelli formalism. This is a moments-based approach which utilizes time correlations between prompt neutrons in order to assess the system multiplication. After the method is described, a validation is presented which utilizes simulated data generated using a 0-D point-kinetics Monte Carlo code.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗