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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 37 records · Page 2

Development of Ambient Mass Spectrometry Rapid Analysis Methods for Trace Inorganics

Ambient mass spectrometry is being investigated as a new method for rapidly characterizing trace inorganic species, including nuclear materials. SRNL is currently developing electrospray ionization (ESI) and paper spray ionization (PSI) methods for mass spectrometry for the detection of trace inorganic compounds JEOL AccuTOF™-DART ® LP 4G mass spectrometer. Sample analysis generates a complex three-dimensional data set with 10 2 -10 3 individual mass spectra spread temporally. To improve the quality and ease of data extraction from this amount of information, a simple data analysis pipeline written in R/R Studio has been improved and expanded upon. Specifically, the software now has header inputs to set base input/output filenames, isotopes of interest, and a list of concentrations analyzed on the instrument. Using list-based structures to enable batch processing of many concentrations at once, it then loads each file, extracts the relevant intensities for masses of interest from each spectrum, and iterates through each concentration to generate graphs of internal standard & analyte correlations, measured isotope ratios, and total ion chromatograms. It then filters the data to remove points at background levels or at the detector saturation limit. Using this filtered data, the pipeline re-creates the graphs to reveal high-quality information from a low-quality raw dataset. All graphs of the R software then output to PowerPoint format. Additionally, faster 3D visualization functionality was added to the pipeline for viewing the entire data file produced by the instrument as an intensity map. With these data analysis tools ready, samples of strontium nitrate/yttrium nitrate as an analyte/internal standard combination were measured on the AccuTOF. From the filtered data, calibration curves were prepared and limits of detection (LOD) of 1 ppb for ESI-MS and 20 ppb for PSI-MS were obtained. The quality available from the calibration curves and the low limits of detection demonstrate the value of the instrument/analysis pipeline system in characterizing trace inorganics.

47 OTHER INSTRUMENTATION↗

Anomaly analysis and visualization for dynamic networks through spatiotemporal graph segmentations

With recent technology advance in Internet of Things (IoT) that involves human, sensors, and mobile devices, networks are not only growing much larger but more complex and dynamic in nature. The spatiotemporal dynamics of networks are represented by both topological changes and temporal shifts of attribute information associated with network components. Understanding the pattern and trend of dynamic networks is increasingly important. While data mining approaches are generally useful in analyzing the statistical properties of networks, there has been recent trend to consider bringing human into the loop, and to examine how feedback from visualizations of large-scale dynamic networks can further improve data mining and machine learning. Traditional visualization methods based on animation and sequences of snapshot graphs are also limited by human cognitive capability. Here, we present a dynamic network analysis and visualization (DNAV) tool which explores the spatiotemporal dimensions of graph components. In particular, nodes and edges are augmented with spatiotemporal segmentation based on both topological and attribute dynamics (e.g., time and locations of connectivity). To further facilitate analysis of large dynamic networks, DNAV includes statistical dynamic overviews alongside graph views, as well as data filtering modules for scalable analysis. Using case studies on public datasets, we demonstrate the effectiveness of DNAV in understanding and analyzing anomalies in dynamic networks such as computer communication networks.

97 MATHEMATICS AND COMPUTING↗

A Visual Analytics Paradigm Enabling Trillion-Edge Graph Exploration

We present a visual analytics paradigm and a system prototype for exploring web-scale graphs. A web-scale graph is described as a graph with ~one trillion edges and ~50 billion vertices. While there is an aggressive R&D effort in processing and exploring web-scale graphs among internet vendors such as Facebook and Google, visualizing a graph of that scale still remains an underexplored R&D area. The paper describes a nontraditional peek-and-filter strategy that facilitates the exploration of a graph database of unprecedented size for visualization and analytics. We demonstrate that our system prototype can 1) preprocess a graph with ~25 billion edges in less than two hours and 2) support database query and visualization on the processed graph database afterward. Based on our computational performance results, we argue that we most likely will achieve the one trillion edge mark (a computational performance improvement of 40 times) for graph visual analytics in the near future.

graph visualization↗

Effect of Turbulence Modeling on the Melt Flow and Inclusions Transport in a Steel Filtration Experiment

The current article deals with the effect of turbulence modeling on inclusions transport and melt flow in an induction crucible furnace (ICF), which was employed in order to investigate the efficiency and the performance of a ceramic filter. Furthermore, the influence of the discrete random-walk dispersion model on the behavior of inclusions in the ICF was investigated. Different turbulence models were employed in order to predict the turbulent melt flow. The numerical results show that the flow field is affected by the turbulence modeling method. Moreover, the distribution of the turbulent kinetic energy depends considerably on the choice of the turbulence model. In addition, the turbulence model and dispersion model also affect the inclusion transport in the melt. The filtration rate is also affected by the choice of the turbulence model.

36 MATERIALS SCIENCE↗

A Dynamic Reduction Network for Point Clouds

Classifying whole images is a classic problem in machine learning, and graph neural networks are a powerful methodology to learn highly irregular geometries. It is often the case that certain parts of a point cloud are more important than others when determining overall classification. On graph structures this started by pooling information at the end of convolutional filters, and has evolved to a variety of staged pooling techniques on static graphs. In this paper, a dynamic graph formulation of pooling is introduced that removes the need for predetermined graph structure. It achieves this by dynamically learning the most important relationships between data via an intermediate clustering. The network architecture yields interesting results considering representation size and efficiency. It also adapts easily to a large number of tasks from image classification to energy regression in high energy particle physics.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Graph Databases for Large-Scale Healthcare Systems: A Framework for Efficient Data Management and Data Services

Designing a database system for both efficient data management and data services has been one of the enduring challenges in the healthcare domain. In many healthcare systems, data services and data management are often viewed as two orthogonal tasks; data services refer to retrieval and analytic queries such as search, joins, statistical data extraction, and simple data mining algorithms, while data management refers to building error-tolerant and non-redundant database systems. The gap between service and management has resulted in rigid database systems and schemas that do not support effective analytics. We compose a rich graph structure from an abstracted healthcare RDBMS to illustrate how we can fill this gap in practice. We show how a healthcare graph can be automatically constructed from a normalized relational database using the proposed 3NF Equivalent Graph (3EG) transformation.We discuss a set of real world graph queries such as finding self-referrals, shared providers, and collaborative filtering, and evaluate their performance over a relational database and its 3EG-transformed graph. Experimental results show that the graph representation serves as multiple de-normalized tables, thus reducing complexity in a database and enhancing data accessibility of users. Based on this finding, we propose an ensemble framework of databases for healthcare applications.

Park, Yubin↗

Structure Discovery in Large Semantic Graphs Using Extant Ontological Scaling and Descriptive Statistics

As semantic datasets grow to be very large and divergent, there is a need to identify and exploit their inherent semantic structure for discovery and optimization. Towards that end, we present here a novel methodology to identify the semantic structures inherent in an arbitrary semantic graph dataset. We first present the concept of an extant ontology as a statistical description of the semantic relations present amongst the typed entities modeled in the graph. This serves as a model of the underlying semantic structure to aid in discovery and visualization. We then describe a method of ontological scaling in which the ontology is employed as a hierarchical scaling filter to infer different resolution levels at which the graph structures are to be viewed or analyzed. We illustrate these methods on three large and publicly available semantic datasets containing more than one billion edges each. Keywords-Semantic Web; Visualization; Ontology; Multi-resolution Data Mining;

Multiresolution Data Mining↗

Real-Time event reconstruction for Nuclear Physics Experiments using Artificial Intelligence

Charged track reconstruction is a critical task in nuclear physics experiments, enabling the identification and analysis of particles produced in high-energy collisions. Machine learning (ML) has emerged as a powerful tool for this purpose, addressing the challenges posed by complex detector geometries, high event multiplicities, and noisy data. Traditional methods rely on pattern recognition algorithms like the Kalman filter, but ML techniques, such as neural networks, graph neural networks (GNNs), and recurrent neural networks (RNNs), offer improved accuracy and scalability. By learning from simulated and real detector data, ML models can identify and classify tracks, predict trajectories, and handle ambiguities caused by overlapping or missing hits. Moreover, ML-based approaches can process data in near-real-time, enhancing the efficiency of experiments at large-scale facilities like the Large Hadron Collider (LHC) and Jefferson Lab (JLAB). As detector technologies and computational resources evolve, ML-driven charged track reconstruction continues to push the boundaries of precision and discovery in nuclear physics. In these proceedings, we highlight advancements in charged track identification leveraging Artificial Intelligence within the CLAS12 detector, achieving a notable enhancement in experimental statistics compared to traditional methods. Additionally, we showcase real-time event reconstruction capabilities, including the inference of charged particle properties, such as momentum, direction, and species identification, at speeds matching data acquisition rates. These innovations enable the extraction of physics observables directly from the experiment in real-time.

Gavalian, Gagik (ORCID:0000000267385457)↗

Astrobee's Multi-year Activities at the International Space Station's Japanese Experimental Module

The Astrobee free-flying robots recently completed their third successful year of operations, housed in the Japanese Experimental Module (JEM) on the International Space Station. We summarize the three years of operation, giving special attention to JAXA's 1st and 2nd Kibo Robot Programming Challenge (RPC) and the mapping processes and tools that make Astrobees' autonomous operation possible. The JEM is an ever changing, dynamic environment where light settings, cargo, payloads, and crew members constantly move and interact with one another. The 1st JAXA Kibo RPC event, a collaboration between JAXA and NASA, was held in 2020. Students from several countries in the Asia-Pacific region competed in programming challenges with a simulated Astrobee. The finalists were then invited to run their code on an actual Astrobee in the JEM. For the final round, students programmed Astrobee to visit three different locations to obtain data that would instruct the robot to complete a final task with the participation of ISS crew. The first competition was a tremendous success, leading to an equally successful 2nd JAXA Kibo RPC in 2021 with even larger participation. The 3rd JAXA Kibo RPC will occur in 2022 expanding further to incorporate US participants. These activities led to several firsts in Astrobee’s history: operation of an Astrobee free-flying robot without crew supervision in preparation for on-orbit operations, autonomous image acquisition towards updates of the navigation map, non-NASA code running on the robot (both from JAXA and participating students), two heterogeneous free-flying robots from two different space agencies working together (Int-Ball and Astrobee) during the final event in 2020, the first payload using Astrobee, and having Astrobee controlled from a non-NASA location (Tsukuba Space Center). The preparation towards these activities involved constant evaluation of the different components of Astrobee's systems, specially mapping and localization. The paper describes the evolution of these systems such as the improvements made in localization to reduce localization drift by using graph-based optimization instead of the extended Kalman Filter localizer. Additionally, it reports on the mapping process and analysis tools created to validate map consistency across different activities in the constantly changing JEM environment. These enhancements have enabled the Astrobee facility to successfully execute over 100 ISS activities supporting over a dozen researchers and partners around the world.

Astrobee↗

An analysis of the Kalman filter in the Gamma Ray Observatory (GRO) onboard attitude determination subsystem

The Gamma Ray Observatory (GRO) spacecraft needs a highly accurate attitude knowledge to achieve its mission objectives. Utilizing the fixed-head star trackers (FHSTs) for observations and gyroscopes for attitude propagation, the discrete Kalman Filter processes the attitude data to obtain an onboard accuracy of 86 arc seconds (3 sigma). A combination of linear analysis and simulations using the GRO Software Simulator (GROSS) are employed to investigate the Kalman filter for stability and the effects of corrupted observations (misalignment, noise), incomplete dynamic modeling, and nonlinear errors on Kalman filter. In the simulations, on-board attitude is compared with true attitude, the sensitivity of attitude error to model errors is graphed, and a statistical analysis is performed on the residuals of the Kalman Filter. In this paper, the modeling and sensor errors that degrade the Kalman filter solution beyond mission requirements are studied, and methods are offered to identify the source of these errors.

Snow, Frank↗

On the response of superpressure balloons to displacements from equilibrium density level

The response of a superpressure balloon to an initial displacement from its constant-density floating level is examined. An approximate solution is obtained to the governing vertical equation of motion for constant-density superpressure balloons. This solution is used to filter out neutrally buoyant oscillations in balloon records despite the nonlinear behavior of the balloon. The graph depicting the pressure data after deconvolution between the raw pressure data and the normalized balloon wavelet shows clearly the strong filtering-out of the neutral buoyancy oscillations.

Levanon, N.↗

Quantum-accelerated Global Constraint Filtering

Motivated by recent advances in quantum algorithms and gate-model quantum computation, we introduce quantum-accelerated filtering algorithms for global constraints in constraint programming. We adapt recent work in quantum algorithms for graph problems and identify quantum subroutines that accelerate the main domain consistency algorithms for the all different constraint and the global cardinality constraint (gcc). The subroutines are based on quantum algorithms for finding maximum matchings and strongly connected components in graphs, and provide speedups over the best classical algorithms. We detail both complete and bounded-probability frameworks for quantum-accelerated global constraint filtering algorithms within backtracking search.

Quantum algorithms↗

Cryogenic metal mesh bandpass filters for submillimeter astronomy

The design and performance of a tunable double-half-wave bandpass filter centered at 286 microns (Delta lambda/lambda = 0.16) and operating at cryogenic temperatures (for astronomy applications) are presented. The operating principle is explained, and the fabrication of the device, which comprises two identical mutually coupled Fabry-Perot filters with electroformed Ni-mesh reflectors and is tuned by means of variable spacers, is described. A drawing of the design and graphs of computed and measured performance are provided. Significantly improved bandpass characteristics are obtained relative to the single Fabry-Perot filter.

Dragovan, M.↗

Novel deep learning methods for track reconstruction

For the past year, the HEP.TrkX project has been investigating machine learning solutions to LHC particle track reconstruction problems. A variety of models were studied that drew inspiration from computer vision applications and operated on an image-like representation of tracking detector data. While these approaches have shown some promise, image-based methods face challenges in scaling up to realistic HL-LHC data due to high dimensionality and sparsity. In contrast, models that can operate on the spacepoint representation of track measurements ("hits") can exploit the structure of the data to solve tasks efficiently. In this paper we will show two sets of new deep learning models for reconstructing tracks using space-point data arranged as sequences or connected graphs. In the first set of models, Recurrent Neural Networks (RNNs) are used to extrapolate, build, and evaluate track candidates akin to Kalman Filter algorithms. Such models can express their own uncertainty when trained with an appropriate likelihood loss function. The second set of models use Graph Neural Networks (GNNs) for the tasks of hit classification and segment classification. These models read a graph of connected hits and compute features on the nodes and edges. They adaptively learn which hit connections are important and which are spurious. The models are scaleable with simple architecture and relatively few parameters. Results for all models will be presented on ACTS generic detector simulated data.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Distributed-Memory Fast Maximal Independent Set

The Maximal Independent Set (MIS) graph problem arises in many applications such as computer vision, information theory, molecular biology, and process scheduling. The growing scale of MIS problems suggests the use of distributed-memory hardware as a cost-effective approach to providing necessary compute and memory resources. Luby proposed four randomized algorithms to solve the MIS problem. All those algorithms are designed focusing on shared-memory machines and are analyzed using the PRAM model. These algorithms do not have direct efficient distributed-memory implementations. In this paper, we extend two of Luby’s seminal MIS algorithms, “Luby(A)” and “Luby(B),” to distributed-memory execution, and we evaluate their performance. We compare our results with the “Filtered MIS” implementation in the Combinatorial BLAS library for two types of synthetic graph inputs.

distributed memory parallel↗

Bayesian network ensemble as a multivariate strategy to predict radiation pneumonitis risk

Purpose: Prediction of radiation pneumonitis (RP) has been shown to be challenging due to the involvement of a variety of factors including dose–volume metrics and radiosensitivity biomarkers. Some of these factors are highly correlated and might affect prediction results when combined. Bayesian network (BN) provides a probabilistic framework to represent variable dependencies in a directed acyclic graph. The aim of this study is to integrate the BN framework and a systems’ biology approach to detect possible interactions among RP risk factors and exploit these relationships to enhance both the understanding and prediction of RP. Methods: The authors studied 54 nonsmall-cell lung cancer patients who received curative 3D-conformal radiotherapy. Nineteen RP events were observed (common toxicity criteria for adverse events grade 2 or higher). Serum concentration of the following four candidate biomarkers were measured at baseline and midtreatment: alpha-2-macroglobulin, angiotensin converting enzyme (ACE), transforming growth factor, interleukin-6. Dose-volumetric and clinical parameters were also included as covariates. Feature selection was performed using a Markov blanket approach based on the Koller–Sahami filter. The Markov chain Monte Carlo technique estimated the posterior distribution of BN graphs built from the observed data of the selected variables and causality constraints. RP probability was estimated using a limited number of high posterior graphs (ensemble) and was averaged for the final RP estimate using Bayes’ rule. A resampling method based on bootstrapping was applied to model training and validation in order to control under- and overfit pitfalls. Results: RP prediction power of the BN ensemble approach reached its optimum at a size of 200. The optimized performance of the BN model recorded an area under the receiver operating characteristic curve (AUC) of 0.83, which was significantly higher than multivariate logistic regression (0.77), mean heart dose (0.69), and a pre-to-midtreatment change in ACE (0.66). When RP prediction was made only with pretreatment information, the AUC ranged from 0.76 to 0.81 depending on the ensemble size. Bootstrap validation of graph features in the ensemble quantified confidence of association between variables in the graphs where ten interactions were statistically significant. Conclusions: The presented BN methodology provides the flexibility to model hierarchical interactions between RP covariates, which is applied to probabilistic inference on RP. The authors’ preliminary results demonstrate that such framework combined with an ensemble method can possibly improve prediction of RP under real-life clinical circumstances such as missing data or treatment plan adaptation.

60 APPLIED LIFE SCIENCES↗

Monitoring and flaw detection during wire-based directed energy deposition using in-situ acoustic sensing and wavelet graph signal analysis

The goal of this work is to detect flaw formation in the wire-based directed energy deposition (W-DED) process using in-situ sensor data. The W-DED studied in this work is analogous to metal inert gas electric arc welding. The adoption of W-DED in industry is limited because the process is susceptible to stochastic and environmental disturbances that cause instabilities in the electric arc, eventually leading to flaw formation, such as porosity and suboptimal geometric integrity. Moreover, due to the large size of W-DED parts, it is difficult to detect flaws post-process using non-destructive techniques, such as X-ray computed tomography. Accordingly, the objective of this work is to detect flaw formation in W-DED parts using data acquired from an acoustic (sound) sensor installed near the electric arc. To realize this objective, we develop and apply a novel wavelet integrated graph theory approach. The approach extracts a single feature called graph Laplacian Fiedler number from the noise-contaminated acoustic sensor data, which is subsequently tracked in a statistical control chart. Using this approach, the onset of various types of flaws are detected with a false alarm rate less-than 2%. This work demonstrates the potential of using advanced data analytics for in-situ monitoring of W-DED.

42 ENGINEERING↗

New in-flight calibration adjustment of the Nimbus 6 and 7 earth radiation budget wide field of view radiometers

In-flight calibration adjustments are developed to process data obtained from the wide-field-of-view channels of Nimbus-6 and Nimbus-7 after the failure of the Nimbus-7 longwave scanner on June 22, 1980. The sensor characteristics are investigated; the satellite environment is examined in detail; and algorithms are constructed to correct for long-term sensor-response changes, on/off-cycle thermal transients, and filter-dome absorption of longwave radiation. Data and results are presented in graphs and tables, including comparisons of the old and new algorithms.

Kyle, H. L.↗