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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 955 records · Page 53
All sourcesNASA NTRSDOE OSTI
DOE OSTI2015

A MACHINE-LEARNING METHOD TO INFER FUNDAMENTAL STELLAR PARAMETERS FROM PHOTOMETRIC LIGHT CURVES

A fundamental challenge for wide-field imaging surveys is obtaining follow-up spectroscopic observations: there are >10{sup 9} photometrically cataloged sources, yet modern spectroscopic surveys are limited to ∼few× 10{sup 6} targets. As we approach the Large Synoptic Survey Telescope era, new algorithmic solutions are required to cope with the data deluge. Here we report the development of a machine-learning framework capable of inferring fundamental stellar parameters (T {sub eff}, log g, and [Fe/H]) using photometric-brightness variations and color alone. A training set is constructed from a systematic spectroscopic survey of variables with Hectospec/Multi-Mirror Telescope. In sum, the training set includes ∼9000 spectra, for which stellar parameters are measured using the SEGUE Stellar Parameters Pipeline (SSPP). We employed the random forest algorithm to perform a non-parametric regression that predicts T {sub eff}, log g, and [Fe/H] from photometric time-domain observations. Our final optimized model produces a cross-validated rms error (RMSE) of 165 K, 0.39 dex, and 0.33 dex for T {sub eff}, log g, and [Fe/H], respectively. Examining the subset of sources for which the SSPP measurements are most reliable, the RMSE reduces to 125 K, 0.37 dex, and 0.27 dex, respectively, comparable to what is achievable via low-resolution spectroscopy. For variable stars this represents a ≈12%-20% improvement in RMSE relative to models trained with single-epoch photometric colors. As an application of our method, we estimate stellar parameters for ∼54,000 known variables. We argue that this method may convert photometric time-domain surveys into pseudo-spectrographic engines, enabling the construction of extremely detailed maps of the Milky Way, its structure, and history.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2019

A Moving Target Defense Control Framework for Cyber-Physical Systems

This paper considers the problem of efficiently and securely controlling cyber-physical systems that are operating in uncertain, and adversarial environments. To mitigate sensor, actuator attacks, and performance loss due to such attacks, we formulate a secure control algorithm that consists of a proactive and a reactive defense mechanism. The proactive mechanism, which is based on the principles of moving target defense, utilizes a stochastic switching structure to dynamically and continuously alter the parameters of the system, while hindering the attacker's ability to conduct successful reconnaissance to the system. The unpredictability of the current actuator and sensor is optimized using an information entropy measure, which is induced by probabilistic switching. The reactive mechanism on the other side, detects potentially attacked components, namely sensors and actuators, by leveraging online data to compute an integral Bellman error. A rigorous mathematical framework is presented to guarantee the stability of the equilibrium point of the closed-loop system, and provide a quantified bound on the performance loss when utilizing both reactive and proactive mechanisms. Simulation results show the efficacy of the proposed approaches on a benchmark aircraft model.

42 ENGINEERING↗
DOE OSTI2018

Remote Distributed Vibration Sensing Through Opaque Media Using Permanent Magnets

Vibration sensing is critical for a variety of applications from structural fatigue monitoring to understanding the modes of airplane wings. In particular, remote sensing techniques are needed for measuring the vibrations of multiple points simultaneously, assessing vibrations inside opaque metal vessels, and sensing through smoke clouds and other optically challenging environments. Here, in this paper, we propose a method which measures high-frequency displacements remotely using changes in the magnetic field generated by permanent magnets. We leverage the unique nature of vibration tracking and use a calibrated local model technique developed specifically to improve the frequency-domain estimation accuracy. The results show that two-dimensional local models surpass the dipole model in tracking high-frequency motions. A theoretical basis for understanding the effects of electronic noise and error due to correlated variables is generated in order to predict the performance of experiments prior to implementation. Simultaneous measurements of up to three independent vibrating components are shown. The relative accuracy of the magnet-based displacement tracking with respect to the video tracking ranges from 40 to 190 μm when the maximum displacements approach ±5 mm and when sensor-to-magnet distances vary from 25 to 36 mm. Finally, vibration sensing inside an opaque metal vessel and mode shape changes due to damage on an aluminum beam are also studied using the wireless permanent-magnet vibration sensing scheme.

42 ENGINEERING↗
DOE OSTI2026

Generative modeling enables molecular structure retrieval from Coulomb explosion imaging

Capturing the structural changes that molecules undergo during chemical reactions in real space and time is a long-standing dream and an essential prerequisite for understanding and ultimately controlling femtochemistry. A key approach to tackle this challenging task is Coulomb explosion imaging, which benefited decisively from recently emerging high-repetition-rate X-ray free-electron laser sources. With this technique, information on the molecular structure is inferred from the momentum distributions of the ions produced by the rapid Coulomb explosion of molecules. Retrieving molecular structures from these distributions poses a highly non-linear inverse problem that remains unsolved for molecules consisting of more than a few atoms. Here, we address this challenge using a diffusion-based Transformer neural network. We show that the network reconstructs unknown molecular geometries from ion-momentum distributions with a mean absolute error below one Bohr radius, which is half the length of a typical chemical bond.

Artificial Intelligence (cs.AI)↗
DOE OSTI2021

Entropic formation of a thermodynamically stable colloidal quasicrystal with negligible phason strain

Quasicrystals have been discovered in a variety of materials ranging from metals to polymers. Yet, why and how they form is incompletely understood. In situ transmission electron microscopy of alloy quasicrystal formation in metals suggests an error-and-repair mechanism, whereby quasiperiodic crystals grow imperfectly with phason strain present, and only perfect themselves later into a high-quality quasicrystal with negligible phason strain. The growth mechanism has not been investigated for other types of quasicrystals, such as dendrimeric, polymeric, or colloidal quasicrystals. Soft-matter quasicrystals typically result from entropic, rather than energetic, interactions, and are not usually grown (either in laboratories or in silico) into large-volume quasicrystals. Consequently, it is unknown whether soft-matter quasicrystals form with the high degree of structural quality found in metal alloy quasicrystals. Here, we investigate the entropically driven growth of colloidal dodecagonal quasicrystals (DQCs) via computer simulation of systems of hard tetrahedra, which are simple models for anisotropic colloidal particles that form a quasicrystal. Using a pattern recognition algorithm applied to particle trajectories during DQC growth, we analyze phason strain to follow the evolution of quasiperiodic order. As in alloys, we observe high structural quality; DQCs with low phason strain crystallize directly from the melt and only require minimal further reduction of phason strain. Finally, we also observe transformation from a denser approximant to the DQC via continuous phason strain relaxation. Our results demonstrate that soft-matter quasicrystals dominated by entropy can be thermodynamically stable and grown with high structural quality––just like their alloy quasicrystal counterparts.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Toward shell model interactions with credible uncertainties

Background: The nuclear shell model is a powerful framework for predicting nuclear structure observables, but relies on interaction matrix elements fit to experimental data as its inputs. Extending the shell model's applicability, particularly toward dripline nuclei, requires efficient fitting methods and credible uncertainty quantification. Traditional approaches face computational challenges and may underestimate uncertainties. Purpose: We develop and test a framework combining eigenvector continuation and Markov chain Monte Carlo to efficiently fit shell model interaction matrix elements and quantify their uncertainties. Methods: Eigenvector continuation is used to emulate shell model calculations, reducing computational costs. The emulator enables Markov chain Monte Carlo sampling to optimize interaction matrix elements and rigorously assess parametric uncertainties. Here, the framework is benchmarked using the USDB interaction in the 𝑠⁢𝑑 shell. Results: The emulator reproduces the USDB interaction with negligible error, validating its use in shell model fitting applications. However, we find that to obtain credible predictive intervals, the model defect of the shell model itself, rather than experimental or emulator error, must be taken into account in order to obtain credible uncertainties. Conclusions: The proposed framework provides an efficient and rigorous approach for fitting shell model interactions and quantifying uncertainties. Further, the normality assumption used in the past appears sufficient to describe the distribution of interaction matrix elements. However, it is crucial to account for model correlations to avoid underestimating uncertainties.

Nuclear forces↗
DOE OSTI2020

Designing accurate emulators for scientific processes using calibration-driven deep models

Abstract Predictive models that accurately emulate complex scientific processes can achieve speed-ups over numerical simulators or experiments and at the same time provide surrogates for improving the subsequent analysis. Consequently, there is a recent surge in utilizing modern machine learning methods to build data-driven emulators. In this work, we study an often overlooked, yet important, problem of choosing loss functions while designing such emulators. Popular choices such as the mean squared error or the mean absolute error are based on a symmetric noise assumption and can be unsuitable for heterogeneous data or asymmetric noise distributions. We propose Learn-by-Calibrating, a novel deep learning approach based on interval calibration for designing emulators that can effectively recover the inherent noise structure without any explicit priors. Using a large suite of use-cases, we demonstrate the efficacy of our approach in providing high-quality emulators, when compared to widely-adopted loss function choices, even in small-data regimes.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2015

On using large scale correlation of the Ly-α forest and redshifted 21-cm signal to probe HI distribution during the post reionization era

We investigate the possibility of detecting the 3D cross correlation power spectrum of the Ly-α forest and HI 21 cm signal from the post reionization epoch. (The cross-correlation signal is directly dependent on the dark matter power spectrum and is sensitive to the 21-cm brightness temperature and Ly-α forest biases. These bias parameters dictate the strength of anisotropy in redshift space.) We find that the cross-correlation power spectrum can be detected using 400 hrs observation with SKA-mid (phase 1) and a futuristic BOSS like experiment with a quasar (QSO) density of 30 deg{sup −2} at a peak SNR of 15 for a single field experiment at redshift z = 2.5. on large scales using the linear bias model. We also study the possibility of constraining various bias parameters using the cross power spectrum. We find that with the same experiment 1 σ (conditional errors) on the 21-cm linear redshift space distortion parameter β{sub T} and β{sub F} corresponding to the Ly-α forest are ∼ 2.7 % and ∼ 1.4 % respectively for 01 independent pointings of the SKA-mid (phase 1). This prediction indicates a significant improvement over existing measurements. We claim that the detection of the 3D cross correlation power spectrum will not only ascertain the cosmological origin of the signal in presence of astrophysical foregrounds but will also provide stringent constraints on large scale HI biases. This provides an independent probe towards understanding cosmological structure formation.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2019

Nuclear Data and Benchmarking Program: Nuclear Data Performance Assessment for Advanced Reactors

Over the last several Evaluated Nuclear Data File (ENDF)/B releases, many updates have been introduced to the nuclear data libraries that can significantly change computational results. These changes can be particularly important for advanced reactor concepts, which are not as thoroughly investigated as those used in light water reactor (LWR) systems. Therefore, a performance assessment of the ENDF/B libraries using the SCALE 6.2.3 code package was conducted under the auspices of the U.S., Department of Energy Office of Nuclear Energy (DOE-NE). The following systems relevant to the advanced reactor community were chosen as subject for investigation in this report: sodium cooled fast reactor systems, graphite moderated high temperature gas-cooled reactors, and several molten salt reactor models. At first, the similarity of the integral performance of the ENDF/B-VII.1 and ENDF/B-VIII.0 nuclear data libraries caused by compensating errors in important differential data was demonstrated. In calculations for a shipping container of high-assay low enriched uranium, the data of individual isotopes were systematically swapped between the two ENDF/B libraries. An eigenvalue difference of up to 450 pcm was found due to the use of 235 U and 238 U from one library and 1 H and 16 O from the other library. This clearly demonstrates a cross-correlation between reaction data sets of different isotopes within a library that should be reported in the evaluations. For sodium-cooled fast reactor (SFR) fuel assemblies, significant eigenvalue (k inf ) differences (200– 450 pcm) were found between calculations using the 2011 ENDF/B-VII.1 data and 2018 ENDF/B-VIII.0 data. These differences were mainly caused by updates of 238 U and 239 Pu neutron cross sections. Results from the multigroup (MG) calculations further revealed that the group structure of the applied MG library strongly influences the MG bias due to the importance of an appropriate energy resolution of the resonances in higher energy ranges. The application of previously used MG libraries requires new verification for advanced reactor simulation in comparisons with reference continuous-energy calculations. Nuclear data uncertainty analyses of these SFR systems resulted in eigenvalue uncertainties between 1,400 and 1,800 pcm, which are three to four times higher than corresponding uncertainties in light water reactor (LWR) systems. The main contributor to this uncertainty was found to be inelastic scattering on 238 U, which shows an uncertainty of up to 50% in the fast energy range. Other important contributors are the scattering reactions of 56 Fe and 23 Na which have so far not appeared in LWR analysis. Since the largest contribution to the eigenvalue uncertainty of SFR systems is coming from scattering reactions, it is expected that uncertainties in the angular scattering distributions also have a significant impact. Those uncertainties are, however, not available for the majority of nuclides, and the capabilities to determine sensitivities to this data are currently underdeveloped. For two graphite moderated high temperature gas-cooled reactor (HTGR) benchmarks, only the ENDF/BVII. 1 calculations resulted in consistent eigenvalues (k eff ) with the corresponding experimental measurements. Eigenvalue differences of about 1,000 pcm were found between the 2006 ENDF/B-VII.0 data and the 2011 ENDF/B-VII.1 data, primarily due to an updated carbon capture cross section in the thermal energy range in the later ENDF/B release. The ENDF/B-VIII.0 eigenvalue was larger than the ENDF/B-VII.1 eigenvalue by about 300 pcm mainly due to updates in multiple 235 U neutron cross sections, with offsetting updates in the 238 U cross sections. With ENDF/B-VIII.0, graphite can be modeled as perfect crystal or with two different porosities. The choice of the graphite evaluation can have a significant influence of the eigenvalue. For a HTGR benchmark, maximum eigenvalue differences as high as 650 pcm due to different porosities were observed. More detailed studies of the impact of the porosity are necessary while considering that the graphite porosity can vary between the used materials and changes as a function of neutron fluence. xii The uncertainty of the HTGR eigenvalues due to nuclear data uncertainties was found between 500 and 600 pcm, with the top contributor being the neutron multiplicity of 235 U. A gap in the form of missing uncertainties in graphite thermal scattering data, that might have significant impact on HTGR reactors, was identified. This gap is being investigated by the DOE-NE Nuclear Data and Benchmarking Program, as documented in a separate report The fast spectrum molten salt reactor calculations revealed similar comparisons as for the SFR assemblies. The eigenvalue uncertainties were significantly influenced by inelastic scattering on 238 U, while the impact of angular scattering distributions is unknown. For the graphite and zirconium hydride moderated system, eigenvalue uncertainties of up to 700 pcm were observed, requiring in depth analyses of the cross sections and corresponding uncertainties of the included materials. In general, it was observed that the flux spectra of the various molten salt reactor systems show significant differences, even between a fresh state and a depleted state. The choice of the energy group structure of MG calculations is therefore highly relevant; the applicability of previously used MG libraries needs to be verified. Due the unavailability of pin power measurements of advanced reactor systems, pin power calculations with both ENDF/B-VII.1 and VIII.0 data were performed for a light water reactor and compared to corresponding measurements. Both calculations show good agreement with the measurements. A comparison between the ENDF/B-VII.1 and VIII.0 results revealed small differences, mostly in the range of about 0.2%.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2025

Heterogeneous catalysis: Optimal performance at a phase boundary?

Most of the industrially used heterogeneous catalysts have been discovered by trial and error, and despite decades of experience, the discovery of new catalysts continues to be extremely challenging. The drive to uncover guiding principles in catalyst design is more present than ever. We share a series of observations indicating that optimal catalysts typically function at characteristic phase boundaries (e.g., abrupt changes in adsorbate coverage, catalyst structure, etc.) accessed in the reaction conditions. The catalyst exploits the associated instability—the desire to exist in multiple states simultaneously—as a driving force for chemical transformations. In other words, phase boundaries are good places to start the catalyst search, and indeed, we should focus on at least two phases at once rather than just one. Here, we substantiate this claim with several studies that combine statistical operando modeling and experiments. Transpiring from these observations is a hitherto unrecognized vector in catalyst discovery.

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

Test-Based Calibration of Safety Factors for Capacity Models

In this paper, a simple procedure to calibrate the safety factor of capacity models is presented. The calibration can be carried out based on any available database of experimental tests, even of limited size. The procedure aims to assess the model capability of predicting the test results and to calibrate the safety factor so that the capacity equation meets the target reliability level required by the code or sought by the calibrator. After predicting each test of the database with the capacity equation under consideration, the test-prediction pairs are checked for the property of linearity, and the relative error for the properties of homoscedasticity and normality. Once these properties are fulfilled—which may require a nonlinear transformation of the test values and/or the predictions—the closed-form equation proposed in this paper is employed to compute a target design value. The model safety factor is finally obtained by comparing such target design value with the design value obtained from the code. The paper also proposes two approximate analytical equations to compute the tolerance factor, used to attain any given fractile, as a function of the (even small) number of tests, with any assigned confidence level. A fundamental outcome of the procedure is that it yields an objective indicator of the model accuracy, measured by the standard deviation of its error, which may be regarded as a parameter useful for selecting the most reliable model among different competing ones. In the long run, the application of the proposed procedure will allow achieving a uniform reliability level throughout all capacity models used in codes and guidelines. A further advantage is that the partial safety factors so derived can be straightforwardly updated when more experiments become available. Finally, as an example, the proposed procedure is herein applied to the ACI 318 shear design capacity equation for concrete members unreinforced in shear.

42 ENGINEERING↗
DOE OSTI2023

Three-dimensional phenotyping of peach tree-crown architecture utilizing terrestrial laser scanning

Tree training systems for temperate fruit have been developed throughout history by pomologists to improve light interception, fruit yield, and fruit quality. These training systems direct crown and branch growth to specific configurations. Quantifying crown architecture could aid the selection of trees that require less pruning or that naturally excel in specific growing/training system conditions. Regarding peaches [Prunus persica (L.) Batsch], access tools such as branching indices have been developed to characterize tree-crown architecture. However, the required branching data (BD) to develop these indices are difficult to collect. Traditionally, BD have been collected manually, but this process is tedious, time-consuming, and prone to human error. These barriers can be circumnavigated by utilizing terrestrial laser scanning (TLS) to obtain a digital twin of the real tree. TLS generates three-dimensional (3D) point clouds of the tree crown, wherein every point contains 3D coordinates (x, y, z). To facilitate the use of these tools for peach, we selected 16 young peach trees scanned in 2021 and 2022. These 16 trees were then modeled and quantified using the open-source software TreeQSM. As a result, “in silico” branching and biometric data for the young peach trees were calculated to demonstrate the capabilities of TLS phenotyping of peach tree-crown architecture. The comparison and analysis of field measurements (in situ) and in silico BD, biometric data, and quantitative structural model branch uncertainty data were utilized to determine the reconstructive model’s reliability as a source substitute for field measurements. Mean average deviation when comparing young tree (YT) height was approx. 5.93%, with crown volume was approx. 13.26% across both 2021 and 2022. All point clouds of the YTs in 2022 showed residuals lower than 12 mm to cylinders fitted to all branches, and mean surface coverage greater than 40% for both the trunk and primary branching orders.

09 BIOMASS FUELS↗
DOE OSTI2024

NANO.PTML model for read-across prediction of nanosystems in neurosciences. computational model and experimental case of study

Abstract Neurodegenerative diseases involve progressive neuronal death. Traditional treatments often struggle due to solubility, bioavailability, and crossing the Blood-Brain Barrier (BBB). Nanoparticles (NPs) in biomedical field are garnering growing attention as neurodegenerative disease drugs (NDDs) carrier to the central nervous system. Here, we introduced computational and experimental analysis. In the computational study, a specific IFPTML technique was used, which combined Information Fusion (IF) + Perturbation Theory (PT) + Machine Learning (ML) to select the most promising Nanoparticle Neuronal Disease Drug Delivery (N2D3) systems. For the application of IFPTML model in the nanoscience, NANO.PTML is used. IF-process was carried out between 4403 NDDs assays and 260 cytotoxicity NP assays conducting a dataset of 500,000 cases. The optimal IFPTML was the Decision Tree (DT) algorithm which shown satisfactory performance with specificity values of 96.4% and 96.2%, and sensitivity values of 79.3% and 75.7% in the training (375k/75%) and validation (125k/25%) set. Moreover, the DT model obtained Area Under Receiver Operating Characteristic (AUROC) scores of 0.97 and 0.96 in the training and validation series, highlighting its effectiveness in classification tasks. In the experimental part, two samples of NPs (Fe 3 O 4 _A and Fe 3 O 4 _B) were synthesized by thermal decomposition of an iron(III) oleate (FeOl) precursor and structurally characterized by different methods. Additionally, in order to make the as-synthesized hydrophobic NPs (Fe 3 O 4 _A and Fe 3 O 4 _B) soluble in water the amphiphilic CTAB (Cetyl Trimethyl Ammonium Bromide) molecule was employed. Therefore, to conduct a study with a wider range of NP system variants, an experimental illustrative simulation experiment was performed using the IFPTML-DT model. For this, a set of 500,000 prediction dataset was created. The outcome of this experiment highlighted certain NANO.PTML systems as promising candidates for further investigation. The NANO.PTML approach holds potential to accelerate experimental investigations and offer initial insights into various NP and NDDs compounds, serving as an efficient alternative to time-consuming trial-and-error procedures.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2021

Toward Full Configuration Interaction for Transition-Metal Complexes

In this work, an efficacious approximation to full configuration interaction (FCI) is adapted to calculate singlet-triplet gaps for transition-metal complexes. This strategy, incremental FCI (iFCI), uses a many-body expansion to systematically add correlation to a simple reference wave function and therefore achieves greatly reduced computational costs compared to FCI. iFCI through the 3-body expansion is demonstrated on four model transition-metal complexes involving the metals Zn, V, and Cu. Screening techniques to increase the computational efficiency of iFCI are proposed and tested, showing reduction in the number of 3-body terms by more than 90% with controlled errors. The largest complex treated by iFCI has 142 valence electrons, all of which are correlated among the full set of 444 active orbitals. Computed spin gaps approach experimental results for the four complexes, though room for improvement remains.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2018

Integrated Sachs-Wolfe map reconstruction in the presence of systematic errors

The decay of gravitational potentials in the presence of dark energy leads to an additional, late-time contribution to anisotropies in the cosmic microwave background (CMB) at large angular scales. The imprint of this so-called integrated Sachs-Wolfe (ISW) effect to the CMB angular power spectrum has been detected and studied in detail, but reconstructing its spatial contributions to the CMB map, which would offer the tantalizing possibility of separating the early- from the late-time contributions to CMB temperature fluctuations, is more challenging. Here, we study the technique for reconstructing the ISW map based on information from galaxy surveys and focus in particular on how its accuracy is impacted by the presence of photometric calibration errors in input galaxy maps, which were previously found to be a dominant contaminant for ISW signal estimation. We find that both including tomographic information from a single survey and using data from multiple, complementary galaxy surveys improve the reconstruction by mitigating the impact of spurious power contributions from calibration errors. A high-fidelity reconstruction further requires one to account for the contribution of calibration errors to the observed galaxy power spectrum in the model used to construct the ISW estimator. Here, we find that if the photometric calibration errors in galaxy surveys can be independently controlled at the level required to obtain unbiased dark energy constraints, then it is possible to reconstruct ISW maps with excellent accuracy using a combination of maps from two galaxy surveys with properties similar to Euclid and SPHEREx.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2025

Towards an Introspective Dynamic Model of Globally Distributed Computing Infrastructures

Large-scale scientific collaborations like ATLAS, Belle II, CMS, DUNE, and others involve hundreds of research institutes and thousands of researchers spread across the globe. These experiments generate petabytes of data, with volumes soon expected to reach exabytes. Consequently, there is a growing need for computation, including structured data processing from raw data to consumer-ready derived data, extensive Monte Carlo simulation campaigns, and a wide range of end-user analysis. To manage these computational and storage demands, centralized workflow and data management systems are implemented. However, decisions regarding data placement and payload allocation are often made disjointly and via heuristic means. A significant obstacle in adopting more effective heuristic or AI-driven solutions is the absence of a quick and reliable introspective dynamic model to evaluate and refine alternative approaches. In this study, we aim to develop such an interactive system using real-world data. By examining job execution records from the PanDA workflow management system, we have pinpointed key performance indicators such as queuing time, error rate, and the extent of remote data access. The dataset includes five months of activity. Additionally, we are creating a generative AI model to simulate time series of payloads, which incorporate visible features like category, event count, and submitting group, as well as hidden features like the total computational load—derived from existing PanDA records and computing site capabilities. These hidden features, which are not visible to job allocators, whether heuristic or AI-driven, influence factors such as queuing times and data movement.

kilic, Ozgur Ozan [Brookhaven National Laboratory ↗
DOE OSTI2016

WE-AB-BRA-08: Correction of Patient Motion in C-Arm Cone-Beam CT Using 3D-2D Registration

Purpose: Intraoperative C-arm cone-beam CT (CBCT) is subject to artifacts arising from patient motion during the fairly long (∼5–20 s) scan times. We present a fiducial free method to mitigate motion artifacts using 3D-2D image registration that simultaneously corrects residual errors in geometric calibration. Methods: A 3D-2D registration process was used to register each projection to DRRs computed from the 3D image by maximizing gradient orientation (GO) using the CMA-ES optimizer. The resulting rigid 6 DOF transforms were applied to the system projection matrices, and a 3D image was reconstructed via model-based image reconstruction (MBIR, which accommodates the resulting noncircular orbit). Experiments were conducted using a Zeego robotic C-arm (20 s, 200°, 496 projections) to image a head phantom undergoing various types of motion: 1) 5° lateral motion; 2) 15° lateral motion; and 3) 5° lateral motion with 10 mm periodic inferior-superior motion. Images were reconstructed using a penalized likelihood (PL) objective function, and structural similarity (SSIM) was measured for axial slices of the reconstructed images. A motion-free image was acquired using the same protocol for comparison. Results: There was significant improvement (p < 0.001) in the SSIM of the motion-corrected (MC) images compared to uncorrected images. The SSIM in MC-PL images was >0.99, indicating near identity to the motion-free reference. The point spread function (PSF) measured from a wire in the phantom was restored to that of the reference in each case. Conclusion: The 3D-2D registration method provides a robust framework for mitigation of motion artifacts and is expected to hold for applications in the head, pelvis, and extremities with reasonably constrained operative setup. Further improvement can be achieved by incorporating multiple rigid components and non-rigid deformation within the framework. The method is highly parallelizable and could in principle be run with every acquisition. Research supported by National Institutes of Health Grant No. R01-EB-017226 and academic-industry partnership with Siemens Healthcare (AX Division, Forcheim, Germany).

60 APPLIED LIFE SCIENCES↗
DOE OSTI2012

Target Strength of Southern Resident Killer Whales (Orcinus orca): Measurement and Modeling

A major criterion for tidal power licensing in Washington’s Puget Sound is the management of the risk of injury to killer whales due to collision with moving turbine blades. An active monitoring system is being proposed for killer whale detection, tracking, and alerting that links to and triggers temporary turbine shutdown when there is risk of collision. Target strength (TS) modeling of the killer whale is critical to the design and application of any active monitoring system. A 1996 study performed a high-resolution measurement of acoustic reflectivity as a function of frequency of a female bottlenose dolphin (2.2 m length) at broadside aspect and TS as a function of incident angle at 67 kHz frequency. Assuming that killer whales share similar morphology structure with the bottlenose dolphin, we extrapolated the TS of an adult killer whale 7.5 m in length at 67 kHz frequency with -8 dB at broadside aspect and -28 dB at tail side. The backscattering data from three Southern Resident killer whales were analyzed to obtain the TS measurement. These data were collected at Lime Kiln State Park using a split-beam system deployed from a boat. The TS of the killer whale at higher frequency (200 kHz) was estimated based on a three-layer model for plane wave reflection from the lung of the whale. The TS data of killer whales were in good agreement with our model. In this paper, we also discuss and explain possible causes for measurement estimation error.

16 TIDAL AND WAVE POWER↗