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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 1,189 records · Page 66
All sourcesNASA NTRSDOE OSTI
DOE OSTI2013

The feasibility of a piecewise-linear dynamic bowtie filter

Purpose: The prepatient attenuator (or 'bowtie filter') in CT is used to modulate the flux as a function of fan angle of the x-ray beam incident on the patient. Traditional, static bowtie filters are tailored only for very generic scans and for the average patient. The authors propose a design for a dynamic bowtie that can produce a time-dependent piecewise-linear attenuation profile. This dynamic bowtie may reduce dynamic range, dose or scatter, but in this work they focus on its ability to reduce dynamic range, which may be particularly important for systems employing photon-counting detectors. Methods: The dynamic bowtie is composed of a set of triangular wedges. Each wedge is independently moved in order to produce a time-dependent piecewise-linear attenuation profile. Simulations of the bowtie are conducted to estimate the dynamic range reduction in six clinical datasets. The control of the dynamic bowtie is determined by solving a convex optimization problem, and the dose is estimated using Monte Carlo techniques. Beam hardening artifacts are also simulated. Results: The dynamic range is reduced by factors ranging from 2.4 to 27 depending on the part of the body studied. With a dynamic range minimization objective, the dose to the patient can be reduced from 6% to 33% while maintaining peak image noise. Further reduction in dose may be possible with a specific dose reduction objective. Beam hardening artifacts are suppressed with a two-pass algorithm. Conclusions: A dynamic bowtie producing a time-dependent, piecewise-linear attenuation profile is possible and can be used to modulate the flux of the scanner to the imaging task. Initial simulations show a large reduction in dynamic range. Several other applications are possible.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2014

SU-E-T-389: Effect of Interfractional Shoulder Motion On Low Neck Nodal Targets for Patients Treated Using Volume Modulated Arc Therapy (VMAT)

Purpose: To quantify the dosimetric impact of interfractional shoulder motion on targets in the low neck for head and neck patients treated with volume modulated arc therapy (VMAT). Methods: Three patients with head and neck cancer were selected. All three required treatment to nodal regions in the low neck in addition to the primary tumor. The patients were immobilized during simulation and treatment with a custom thermoplastic mask covering the head and shoulders. One VMAT plan was created for each patient utilizing two full 360° arcs. A second plan was created consisting of two superior VMAT arcs matched to an inferior static AP supraclavicular field. A CT-on-rails alignment verification was performed weekly during each patient's treatment course. The weekly CT images were registered to the simulation CT and the target contours were deformed and applied to the weekly CT. The two VMAT plans were copied to the weekly CT datasets and recalculated to obtain the dose to the low neck contours. Results: The average observed shoulder position shift in any single dimension relative to simulation was 2.5 mm. The maximum shoulder shift observed in a single dimension was 25.7 mm. Low neck target mean doses, normalized to simulation and averaged across all weekly recalculations were 0.996, 0.991, and 1.033 (Full VMAT plan) and 0.986, 0.995, and 0.990 (Half-Beam VMAT plan) for the three patients, respectively. The maximum observed deviation in target mean dose for any individual weekly recalculation was 6.5%, occurring with the Full VMAT plan for Patient 3. Conclusion: Interfractional variation in dose to low neck nodal regions was quantified for three head and neck patients treated with VMAT. Mean dose was 3.3% higher than planned for one patient using a Full VMAT plan. A Half-Beam technique is likely a safer choice when treating the supraclavicular region with VMAT.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2025

Model-free estimation of completeness, uncertainties, and outliers in atomistic machine learning using information theory

Abstract An accurate description of information is relevant for a range of problems in atomistic machine learning (ML), such as crafting training sets, performing uncertainty quantification (UQ), or extracting physical insights from large datasets. However, atomistic ML often relies on unsupervised learning or model predictions to analyze information contents from simulation or training data. Here, we introduce a theoretical framework that provides a rigorous, model-free tool to quantify information contents in atomistic simulations. We demonstrate that the information entropy of a distribution of atom-centered environments explains known heuristics in ML potential developments, from training set sizes to dataset optimality. Using this tool, we propose a model-free UQ method that reliably predicts epistemic uncertainty and detects out-of-distribution samples, including rare events in systems such as nucleation. This method provides a general tool for data-driven atomistic modeling and combines efforts in ML, simulations, and physical explainability.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Advancements on Multi-Fidelity Random Fourier Neural Networks: Application to Hurricane Modeling for Wind Energy

Multi-fidelity approaches are emerging as effective strategies in computational science to handle otherwise intractable tasks like Uncertainty Quantification (UQ), training of Machine Learning (ML) models, and optimization, for expensive high-fidelity applications in which the amount of available simulations or data is limited. The main idea is simple: large datasets generated for low-fidelity approximations of the problem at hand are fused with a much sparser dataset for the target (high-fidelity) system. In this paper, we build on our recent success in designing random Fourier Neural Networks (rFNNs) [1] to target problems arising in wind energy applications and in particular problems of interest for hurricane modeling. In this context, data for the high-fidelity models are limited and lower fidelity alternatives are needed. In this work, we introduce a novel multi-fidelity training approach for our rFNNs and demonstrate its use on a simple verification problem and on a hurricane modeling problem in which high-fidelity data are generated via Large-Eddy Simulations (LES), while low-fidelity data are given by a mesoscale model. Initial results demonstrate how the multi-fidelity training approach can improve the quality of the resulting surrogate.

Fourier Neural Networks↗
DOE OSTI2015

Quantifying Interannual Variability for Photovoltaic Systems in PVWatts

The National Renewable Energy Laboratory's (NREL's) PVWatts is a relatively simple tool used by industry and individuals alike to easily estimate the amount of energy a photovoltaic (PV) system will produce throughout the course of a typical year. PVWatts Version 5 has previously been shown to be able to reasonably represent an operating system's output when provided with concurrent weather data, however this type of data is not available when estimating system output during future time frames. For this purpose PVWatts uses weather data from typical meteorological year (TMY) datasets which are available on the NREL website. The TMY files represent a statistically 'typical' year which by definition excludes anomalous weather patterns and as a result may not provide sufficient quantification of project risk to the financial community. It was therefore desired to quantify the interannual variability associated with TMY files in order to improve the understanding of risk associated with these projects. To begin to understand the interannual variability of a PV project, we simulated two archetypal PV system designs, which are common in the PV industry, in PVWatts using the NSRDB's 1961-1990 historical dataset. This dataset contains measured hourly weather data and spans the thirty years from 1961-1990 for 239 locations in the United States. To note, this historical dataset was used to compose the TMY2 dataset. Using the results of these simulations we computed several statistical metrics which may be of interest to the financial community and normalized the results with respect to the TMY energy prediction at each location, so that these results could be easily translated to similar systems. This report briefly describes the simulation process used and the statistical methodology employed for this project, but otherwise focuses mainly on a sample of our results. A short discussion of these results is also provided. It is our hope that this quantification of the interannual variability of PV systems will provide a starting point for variability considerations in future PV system designs and investigations. however this type of data is not available when estimating system output during future time frames.

14 SOLAR ENERGY↗
DOE OSTI2016

Humidity Bias and Effect on Simulated Aerosol Optical Properties during the Ganges Valley Experiment

The radiosonde humidity profiles available during the Ganges Valley Experiment were compared to those simulated from the regional Weather Research and Forecasting (WRF) model coupled with a chemistry module (WRF -Chern) and the global reanalysis datasets. Large biases were revealed. On a monthly mean basis at Nainital, located in northern India, the WRFChern model simulates a large moist bias in the free troposphere (up to +20%) as well as a large dry bias in the boundary layer (up to -30%). While the overall pattern of the biases is similar, the magnitude of the biases varies from time to time and from one location to another. At Thiruvananthapuram, the magnitude of the dry bias is smaller, and in contrast to Nainital, the higher-resolution regional WRF -Chern model generates larger moist biases in the upper troposphere than the global reanalysis data. Furthermore, the humidity biases in the upper troposphere, while significant, have little impact on the model estimation of column aerosol optical depth (AOD). The frequent occurrences of the dry boundary-layer bias simulated by the large-scale models tend to lead to the underestimation of AOD. It is thus important to quantify the humidity vertical profiles for aerosol simulations over South Asia.

aerosol extinction↗
NASA NTRS2024

Detection and Socio-Economic Attribution of Groundwater Depletion in India

Groundwater is a critical resource for both consumption and food security in India, where groundwater management faces significant challenges due to climate change and anthropogenic activities. Although several studies explored groundwater variability in India, few have focused on the socioeconomic attribution of these changes, utilizing data from industries, population and water demand. In this study, trends in groundwater storage were examined by leveraging the largest in situ dataset ever collated in India from ~27,000 groundwater wells, satellite-based terrestrial-water-storage estimates, and hydrological model simulations. Five major hotspots of groundwater depletion across India were identified using in situ measurements and previously untapped socioeconomic datasets to attribute these trends. Approximately 16% of Indian groundwater monitoring stations exhibited systematically decreasing trends in groundwater levels. These hotspots are primarily concentrated in the northern and northwestern parts of India as well as in the states of Chhattisgarh, West Bengal, and Kerala. The north/northwestern hotspots have experienced a staggering loss of ~6.46 × 10^10 m3 of water over the past two decades. The factors contributing to this depletion include population growth, rapid urbanization, proliferation of factories and the expansion of agriculture.

Gautam Kunwar↗
DOE OSTI2018

Accounting for adaptation and intensity in projecting heat wave-related mortality

Highlights: • We propose novel models for intensity of and adaptation to heat waves in projections of heat wave- mortality. • The modeling used a large national dataset and the projections used a rich set of climate models and scenarios. • Future heat wave-related mortality would be substantially overestimated, if adaptation were ignored. • The time trend of future heat wave-related mortality will vary substantially across climate regions. How adaptation and intensity of heat waves affect heat wave-related mortality is unclear, making health projections difficult.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2022

Automated Crystal Orientation Mapping in py4DSTEM using Sparse Correlation Matching

Crystalline materials used in technological applications are often complex assemblies composed of multiple phases and differently oriented grains. Robust identification of the phases and orientation relationships from these samples is crucial, but the information extracted from the diffraction condition probed by an electron beam is often incomplete. We have developed an automated crystal orientation mapping (ACOM) procedure which uses a converged electron probe to collect diffraction patterns from multiple locations across a complex sample. We provide an algorithm to determine the orientation of each diffraction pattern based on a fast sparse correlation method. We demonstrate the speed and accuracy of our method by indexing diffraction patterns generated using both kinematical and dynamical simulations. We have also measured orientation maps from an experimental dataset consisting of a complex polycrystalline twisted helical AuAgPd nanowire. From these maps we identify twin planes between adjacent grains, which may be responsible for the twisted helical structure. All of our methods are made freely available as open source code, including tutorials which can be easily adapted to perform ACOM measurements on diffraction pattern datasets.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Leveraging BERT and Network-Based Attention Analysis for Identifying Treatment Milestones in EHRs

This study introduces a sophisticated data-driven framework for analyzing Electronic Health Records (EHRs) using transformer-based models to identify and disentangle overlapping treatment contexts. The framework leverages a preprocessing pipeline that transforms structured procedural codes into semantically enriched descriptive text, enabling the use of attention mechanisms to cluster medical events into treatment milestones—cohesive and distinct components of care processes. The methodology is rigorously validated using synthetic datasets derived from the MIMIC-III database, designed to simulate the heterogeneity and overlapping procedural contexts characteristic of real-world EHR scenarios. Quantitative evaluation highlights the framework’s robustness in disentangling concurrent care pathways, with attention metrics and unsupervised clustering approaches demonstrating the ability to preserve intra-context relationships while distinguishing inter-context dependencies. By addressing challenges inherent in data heterogeneity, this approach provides a foundation for uncovering complex treatment patterns, advancing clinical decision-making, and optimizing resource allocation in diverse healthcare environments.

Kim, Minsu [ORNL] (ORCID:0000000224185535)↗
DOE OSTI2020

A Machine Learning-based Approach to Predict the Aggregate Flexibility of HVAC Systems

Use of renewable energy resources can play a significant role in mitigation of climate change since they reduce the dependency on fossil fuels. However, high penetration of renewable energy resources into the power grid may cause some reliability problems. Ancillary services are key to realize the potential of renewable resources without disturbing the grid reliability. In recent years, many control approaches focused on exploiting the aggregate flexible heating, ventilation, and air-conditioning (HVAC) loads of buildings. However, there are still research gaps in assessing in advance the resulting indoor temperature responses for given total power and weather profiles before implementing the controls in the buildings. Such an assessment is critical to guarantee satisfying both the grid related objective (reliability) and the building related objective (occupants' comfort). Towards addressing this research gap, this paper presents a machine-learning approach for predicting the ratings of indoor temperature responses. In this approach, a prediction model was developed using a dataset generated by a set of model-free control simulations. The developed model achieved high prediction accuracy and showed the potential of the proposed approach.

Amasyali, Kadir↗
DOE OSTI2024

SRBench++: Principled Benchmarking of Symbolic Regression With Domain-Expert Interpretation

Symbolic regression searches for analytic expressions that accurately describe studied phenomena. The main promise of this approach is that it may return an interpretable model that can be insightful to users, while maintaining high accuracy. The current standard for benchmarking these algorithms is SRBench, which evaluates methods on hundreds of datasets that are a mix of real-world and simulated processes spanning multiple domains. At present, the ability of SRBench to evaluate interpretability is limited to measuring the size of expressions on real-world data, and the exactness of model forms on synthetic data. In practice, model size is only one of many factors used by subject experts to determine how interpretable a model truly is. Furthermore, SRBench does not characterize algorithm performance on specific, challenging sub-tasks of regression such as feature selection and evasion of local minima. In this work, we propose and evaluate an approach to benchmarking SR algorithms that addresses these limitations of SRBench by 1) incorporating expert evaluations of interpretability on a domain-specific task, and 2) evaluating algorithms over distinct properties of data science tasks. We evaluate 12 modern symbolic regression algorithms on these benchmarks and present an in-depth analysis of the results, discuss current challenges of symbolic regression algorithms and highlight possible improvements for the benchmark itself.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2017

Nested Tracking Graphs

Tracking graphs are a well established tool in topological analysis to visualize the evolution of components and their properties over time, i.e., when components appear, disappear, merge, and split. However, tracking graphs are limited to a single level threshold and the graphs may vary substantially even under small changes to the threshold. To examine the evolution of features for varying levels, users have to compare multiple tracking graphs without a direct visual link between them. We propose a novel, interactive, nested graph visualization based on the fact that the tracked superlevel set components for different levels are related to each other through their nesting hierarchy. This approach allows us to set multiple tracking graphs in context to each other and enables users to effectively follow the evolution of components for different levels simultaneously. We show the effectiveness of our approach on datasets from finite pointset methods, computational fluid dynamics, and cosmology simulations.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2015

SU-E-T-23: A Developing Australian Network for Datamining and Modelling Routine Radiotherapy Clinical Data and Radiomics Information for Rapid Learning and Clinical Decision Support

Purpose: Large amounts of routine radiotherapy (RT) data are available, which can potentially add clinical evidence to support better decisions. A developing collaborative Australian network, with a leading European partner, aims to validate, implement and extend European predictive models (PMs) for Australian practice and assess their impact on future patient decisions. Wider objectives include: developing multi-institutional rapid learning, using distributed learning approaches; and assessing and incorporating radiomics information into PMs. Methods: Two initial standalone pilots were conducted; one on NSCLC, the other on larynx, patient datasets in two different centres. Open-source rapid learning systems were installed, for data extraction and mining to collect relevant clinical parameters from the centres’ databases. The European DSSs were learned (“training cohort”) and validated against local data sets (“clinical cohort”). Further NSCLC studies are underway in three more centres to pilot a wider distributed learning network. Initial radiomics work is underway. Results: For the NSCLC pilot, 159/419 patient datasets were identified meeting the PM criteria, and hence eligible for inclusion in the curative clinical cohort (for the larynx pilot, 109/125). Some missing data were imputed using Bayesian methods. For both, the European PMs successfully predicted prognosis groups, but with some differences in practice reflected. For example, the PM-predicted good prognosis NSCLC group was differentiated from a combined medium/poor prognosis group (2YOS 69% vs. 27%, p<0.001). Stage was less discriminatory in identifying prognostic groups. In the good prognosis group two-year overall survival was 65% in curatively and 18% in palliatively treated patients. Conclusion: The technical infrastructure and basic European PMs support prognosis prediction for these Australian patient groups, showing promise for supporting future personalized treatment decisions, improved treatment quality and potential practice changes. The early indications from the distributed learning and radiomics pilots strengthen this. Improved routine patient data quality should strengthen such rapid learning systems.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2016

SU-F-I-49: Vendor-Independent, Model-Based Iterative Reconstruction On a Rotating Grid with Coordinate-Descent Optimization for CT Imaging Investigations

Purpose: Iterative reconstruction methods show promise for improving image quality and lowering the dose in helical CT. We aim to develop a novel model-based reconstruction method that offers potential for dose reduction with reasonable computation speed and storage requirements for vendor-independent reconstruction from clinical data on a normal desktop computer. Methods: In 2012, Xu proposed reconstructing on rotating slices to exploit helical symmetry and reduce the storage requirements for the CT system matrix. Inspired by this concept, we have developed a novel reconstruction method incorporating the stored-system-matrix approach together with iterative coordinate-descent (ICD) optimization. A penalized-least-squares objective function with a quadratic penalty term is solved analytically voxel-by-voxel, sequentially iterating along the axial direction first, followed by the transaxial direction. 8 in-plane (transaxial) neighbors are used for the ICD algorithm. The forward problem is modeled via a unique approach that combines the principle of Joseph’s method with trilinear B-spline interpolation to enable accurate reconstruction with low storage requirements. Iterations are accelerated with multi-CPU OpenMP libraries. For preliminary evaluations, we reconstructed (1) a simulated 3D ellipse phantom and (2) an ACR accreditation phantom dataset exported from a clinical scanner (Definition AS, Siemens Healthcare). Image quality was evaluated in the resolution module. Results: Image quality was excellent for the ellipse phantom. For the ACR phantom, image quality was comparable to clinical reconstructions and reconstructions using open-source FreeCT-wFBP software. Also, we did not observe any deleterious impact associated with the utilization of rotating slices. The system matrix storage requirement was only 4.5GB, and reconstruction time was 50 seconds per iteration. Conclusion: Our reconstruction method shows potential for furthering research in low-dose helical CT, in particular as part of our ongoing development of an acquisition/reconstruction pipeline for generating images under a wide range of conditions. Our algorithm will be made available open-source as “FreeCT-ICD”. NIH U01 CA181156; Disclosures (McNitt-Gray): Institutional research agreement, Siemens Healthcare; Past recipient, research grant support, Siemens Healthcare; Consultant, Toshiba America Medical Systems; Consultant, Samsung Electronics.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2016

WE-AB-202-09: Feasibility and Quantitative Analysis of 4DCT-Based High Precision Lung Elastography

Purpose: The purpose of this project is to derive high precision elastography measurements from 4DCT lung scans to facilitate the implementation of elastography in a radiotherapy context. Methods: 4DCT scans of the lungs were acquired, and breathing stages were subsequently registered to each other using an optical flow DIR algorithm. The displacement of each voxel gleaned from the registration was taken to be the ground-truth deformation. These vectors, along with the 4DCT source datasets, were used to generate a GPU-based biomechanical simulation that acted as a forward model to solve the inverse elasticity problem. The lung surface displacements were applied as boundary constraints for the model-guided lung tissue elastography, while the inner voxels were allowed to deform according to the linear elastic forces within the model. A biomechanically-based anisotropic convergence magnification technique was applied to the inner voxels in order to amplify the subtleties of the interior deformation. Solving the inverse elasticity problem was accomplished by modifying the tissue elasticity and iteratively deforming the biomechanical model. Convergence occurred when each voxel was within 0.5 mm of the ground-truth deformation and 1 kPa of the ground-truth elasticity distribution. To analyze the feasibility of the model-guided approach, we present the results for regions of low ventilation, specifically, the apex. Results: The maximum apical boundary expansion was observed to be between 2 and 6 mm. Simulating this expansion within an apical lung model, it was observed that 100% of voxels converged within 0.5 mm of ground-truth deformation, while 91.8% converged within 1 kPa of the ground-truth elasticity distribution. A mean elasticity error of 0.6 kPa illustrates the high precision of our technique. Conclusion: By utilizing 4DCT lung data coupled with a biomechanical model, high precision lung elastography can be accurately performed, even in low ventilation regions of the lungs. This material is based upon work supported by the National Science Foundation Graduate Research Fellowship under Grant No. DGE-1144087.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2025

Simulation-Based Inference for Neutrino Interaction Model Tuning

This project demonstrates, for the first time, the application of simulation-based inference (SBI) techniques to tune neutrino–nucleus interaction models. Using a mock dataset based on the MicroBooNE tuning of the GENIE event generator, our approach employs a Neural Posterior Estimator (NPE) with Masked Autoregressive Flows (MAF) to infer the posterior distributions of key GENIE parameters directly from simulated histograms. The workflow provides a scalable and amortized framework for performing likelihood-free inference in high-dimensional parameter spaces, offering a pathway to more efficient and uncertainty-aware model tuning for next-generation neutrino experiments such as DUNE and SBND.

Tame-Narvaez, KarlaMaria [Fermi National Accelerat↗
DOE OSTI2026

Gridded Vegetation and Land Unit Datasets over North America (1km x 1km) for E3SM Land Model, Version 2

Gridded 1 km land-surface-property dataset for Energy Exascale Earth System Model Land Model (ELM) simulations over North America. Thirty-metre NALCMS land cover is aggregated to the Daymet grid; vegetation classes are cross-walked to ELM plant functional types using mean-temperature-of-the-coldest-month (MTCO) rules. NetCDF includes PFT and land-unit fractions, counts, and MTCO.

54 ENVIRONMENTAL SCIENCES↗