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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 793 records · Page 44

PV-Finder: ML Based Algorithm for Primary Vertex Identification

he CMS detector at the High-Luminosity Large Hadron Collider (HL-LHC) will operate in challenging conditions with expected pile-up of up to 200 collisions per bunch crossing, necessitating the development of a more resilient primary vertex (PV) reconstruction method to ensure the integrity of data analysis and the efficiency of the CMS triggering system. This contribution describes preliminary studies on a new ML based PV-Finder method for PV identification. The method is based on a model trained using Kernel Density Estimations (KDEs) derived from the positions of reconstructed tracks at the beamline, incorporating uncertainties from track parameters. It also utilizes target histograms, modeled as Gaussian distributions centered on the actual ground truth values of specific primary vertices.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DeepAdversaries: examining the robustness of deep learning models for galaxy morphology classification

With increased adoption of supervised deep learning methods for work with cosmological survey data, the assessment of data perturbation effects (that can naturally occur in the data processing and analysis pipelines) and the development of methods that increase model robustness are increasingly important. In the context of morphological classification of galaxies, we study the effects of perturbations in imaging data. In particular, we examine the consequences of using neural networks when training on baseline data and testing on perturbed data. We consider perturbations associated with two primary sources: (a) increased observational noise as represented by higher levels of Poisson noise and (b) data processing noise incurred by steps such as image compression or telescope errors as represented by one-pixel adversarial attacks. We also test the efficacy of domain adaptation techniques in mitigating the perturbation-driven errors. We use classification accuracy, latent space visualizations, and latent space distance to assess model robustness in the face of these perturbations. For deep learning models without domain adaptation, we find that processing pixel-level errors easily flip the classification into an incorrect class and that higher observational noise makes the model trained on low-noise data unable to classify galaxy morphologies. On the other hand, we show that training with domain adaptation improves model robustness and mitigates the effects of these perturbations, improving the classification accuracy up to 23% on data with higher observational noise. Domain adaptation also increases up to a factor of ${\approx}2.3$ the latent space distance between the baseline and the incorrectly classified one-pixel perturbed image, making the model more robust to inadvertent perturbations. Successful development and implementation of methods that increase model robustness in astronomical survey pipelines will help pave the way for many more uses of deep learning for astronomy.

79 ASTRONOMY AND ASTROPHYSICS↗

Illustrated formalisms for total scattering data: a guide for new practitioners

The total scattering method is the simultaneous study of both the real- and reciprocal-space representations of diffraction data. While conventional Bragg-scattering analysis (employing methods such as Rietveld refinement) provides insight into the average structure of the material, pair distribution function (PDF) analysis allows for a more focused study of the local atomic arrangement of a material. Generically speaking, a PDF is generated by Fourier transforming the total measured reciprocal-space diffraction data (Bragg and diffuse) into a real-space representation. However, the details of the transformation employed and, by consequence, the resultant appearance and weighting of the real-space representation of the system can vary between different research communities. As the worldwide total scattering community continues to grow, these subtle differences in nomenclature and data representation have led to conflicting and confusing descriptions of how the PDF is defined and calculated. This paper provides a consistent derivation of many of these different forms of the PDF and the transformations required to bridge between them. Some general considerations and advice for total scattering practitioners in selecting and defining the appropriate choice of PDF in their own research are presented. This contribution aims to benefit people starting in the field or trying to compare their results with those of other researchers.

36 MATERIALS SCIENCE↗

Micro-architected material design for mechanical response

Rapid advances in additive manufacturing (AM) have enabled the creation of micro-architected materials—also known as mechanical metamaterials—with unprecedented control over fine-scale geometries and arrangements of multiple material constituents. These “materials” can achieve unique and extraordinary effective mechanical properties through their complex architectures rather than composition alone. A key challenge is to design for these bespoke effective mechanical responses within the constraints of available AM techniques (i.e., given a set of desired effective properties), identify a (often nonunique) micro-architecture and selection of material constituents that achieves them. Two main strategies have emerged. Gradient-based methods use sensitivity analysis to iteratively refine candidate designs, while data-driven methods learn micro-architecture-constituent relationships from existing examples to propose new designs. This article reviews these design approaches for micro-architected materials with tailored mechanical responses that can be fabricated by AM as well as their applications.

Spadaccini, Christopher M [Lawrence Livermore Nati↗

Comparison and validation of the QuEChERSER mega-method for determination of per- and polyfluoroalkyl substances in foods by liquid chromatography with high-resolution and triple quadrupole mass spectrometry

Instances of food contamination with per- and polyfluoroalkyl substances (PFAS) continue to occur globally, but sample preparation and analytical methods are quite limited and often monitor for a small percentage of known PFAS. This study aimed to evaluate, validate, and compare performance of two instruments with the recently developed “quick, easy, cheap, effective, rugged, safe, efficient, and robust” (QuEChERSER) sample preparation mega-method – a method developed to monitor chemicals over a broad range of physicochemical properties. Initial evaluation of the QuEChERSER mega-method for determination of PFAS in food demonstrated recoveries, matrix interferences, and co-extractive removal comparable to (or better than) US Food and Drug Administration (FDA) and USDA Food Safety and Inspection Service (FSIS) methods. Subsequent validation of QuEChERSER in beef, catfish, chicken, pork, liquid eggs, and powdered eggs on a high-resolution mass spectrometer achieved acceptable recoveries (70–120%) and precision (RSDs ≤20%) for all 33 target analytes at the 1 and 5 ng g –1 levels and 67–88% of analytes at the 0.1 ng g –1 level, depending on the matrix. Additional validation was performed by tandem mass spectrometry on a triple quadrupole instrument. This approach provided no non-detects and better recoveries at the 0.1 ng g –1 level than the HRMS method but exhibited more variability at 1 and 5 ng g –1 spiking levels. Analysis of NIST SRMs 1946 and 1947 gave accuracies of 70–117%. Furthermore, these results demonstrate the capability of combining PFAS analysis with a mega-method previously validated for 350 analytes, while collecting non-target data for future retrospective analysis of emerging alternatives with a high-resolution mass spectrometry method.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Classifying and analyzing small-angle scattering data using weighted k nearest neighbors machine learning techniques

A consistent challenge for both new and expert practitioners of small-angle scattering (SAS) lies in determining how to analyze the data, given the limited information content of said data and the large number of models that can be employed. Machine learning (ML) methods are powerful tools for classifying data that have found diverse applications in many fields of science. Here, ML methods are applied to the problem of classifying SAS data for the most appropriate model to use for data analysis. The approach employed is built around the method of weighted k nearest neighbors (wKNN), and utilizes a subset of the models implemented in the SasView package (https://www.sasview.org/) for generating a well defined set of training and testing data. The prediction rate of the wKNN method implemented here using a subset of SasView models is reasonably good for many of the models, but has difficulty with others, notably those based on spherical structures. A novel expansion of the wKNN method was also developed, which uses Gaussian processes to produce local surrogate models for the classification, and this significantly improves the classification accuracy. Further, by integrating a stochastic gradient descent method during post-processing, it is possible to leverage the local surrogate model both to classify the SAS data with high accuracy and to predict the structural parameters that best describe the data. The linking of data classification and model fitting has the potential to facilitate the translation of measured data into results for both novice and expert practitioners of SAS.

97 MATHEMATICS AND COMPUTING↗

Influence of Averaging Method on the Evaluation of a Coastal Ocean Color Event on the U.S. Northeast Coast

Application of appropriate spatial averaging techniques is crucial to correct evaluation of ocean color radiometric data, due to the common log-normal or mixed log-normal distribution of these data. Averaging method is particularly crucial for data acquired in coastal regions. The effect of averaging method was markedly demonstrated for a precipitation-driven event on the U.S. Northeast coast in October-November 2005, which resulted in export of high concentrations of riverine colored dissolved organic matter (CDOM) to New York and New Jersey coastal waters over a period of several days. Use of the arithmetic mean averaging method created an inaccurate representation of the magnitude of this event in SeaWiFS global mapped chl a data, causing it to be visualized as a very large chl a anomaly. The apparent chl a anomaly was enhanced by the known incomplete discrimination of CDOM and phytoplankton chlorophyll in SeaWiFS data; other data sources enable an improved characterization. Analysis using the geometric mean averaging method did not indicate this event to be statistically anomalous. Our results predicate the necessity of providing the geometric mean averaging method for ocean color radiometric data in the Goddard Earth Sciences DISC Interactive Online Visualization ANd aNalysis Infrastructure (Giovanni).

Acker, James G.↗

Parallelization of the Physical-Space Statistical Analysis System (PSAS)

Atmospheric data assimilation is a method of combining observations with model forecasts to produce a more accurate description of the atmosphere than the observations or forecast alone can provide. Data assimilation plays an increasingly important role in the study of climate and atmospheric chemistry. The NASA Data Assimilation Office (DAO) has developed the Goddard Earth Observing System Data Assimilation System (GEOS DAS) to create assimilated datasets. The core computational components of the GEOS DAS include the GEOS General Circulation Model (GCM) and the Physical-space Statistical Analysis System (PSAS). The need for timely validation of scientific enhancements to the data assimilation system poses computational demands that are best met by distributed parallel software. PSAS is implemented in Fortran 90 using object-based design principles. The analysis portions of the code solve two equations. The first of these is the "innovation" equation, which is solved on the unstructured observation grid using a preconditioned conjugate gradient (CG) method. The "analysis" equation is a transformation from the observation grid back to a structured grid, and is solved by a direct matrix-vector multiplication. Use of a factored-operator formulation reduces the computational complexity of both the CG solver and the matrix-vector multiplication, rendering the matrix-vector multiplications as a successive product of operators on a vector. Sparsity is introduced to these operators by partitioning the observations using an icosahedral decomposition scheme. PSAS builds a large (approx. 128MB) run-time database of parameters used in the calculation of these operators. Implementing a message passing parallel computing paradigm into an existing yet developing computational system as complex as PSAS is nontrivial. One of the technical challenges is balancing the requirements for computational reproducibility with the need for high performance. The problem of computational reproducibility is well known in the parallel computing community. It is a requirement that the parallel code perform calculations in a fashion that will yield identical results on different configurations of processing elements on the same platform. In some cases this problem can be solved by sacrificing performance. Meeting this requirement and still achieving high performance is very difficult. Topics to be discussed include: current PSAS design and parallelization strategy; reproducibility issues; load balance vs. database memory demands, possible solutions to these problems.

Larson, J. W.↗

Evaluation, Analysis, and Application of Internal Strain-Gage Balance Data

Experimental processes, analytical methods, and numerical algorithms are described that may be used to predict the forces and moments of an internal strain-gage balance during a wind tunnel test. First, the control volume model of a strain-gage balance and the concepts of load state, load space, and output space are introduced. These important abstractions provide a better understanding of fundamental characteristics of different balance load prediction approaches. Then, the description of strain-gage balance data and the definition of the primary gage sensitivity is discussed. Afterwards, basic elements of the calibration of a typical six-component balance are reviewed. Two fundamentally different balance load prediction methods, the processing of check loads, and related topics are also discussed. Three real-world balance data examples are reviewed in great detail to illustrate typical analysis results for a variety of strain-gage balance designs. Finally, important observations are summarized and recommendations are provided. Additional information and detailed mathematical derivations can be found in the appendices of the document. They include the following topics: balance terminology, definitions of important statistical metrics, balance axis system conventions, balance load transformations, the combined load diagram, electrical output format options, bi-directional gage output characteristics, determination of the natural zeros, derivation of two balance load prediction methods, description of two tare load iteration algorithms, modeling of balance temperature effects, basics of three-component moment balances, definition of the percent contribution, detection of linear and near-linear dependencies in balance calibration data, a regression model term selection algorithm, and other related topics.

wind tunnel test↗

Analysis of three-component aeromagnetic data

The numerical method of obtaining three field components from total field measurements, using double Fourier series expansion, is presented. The expressions for moments of the anomalous field components over a finite area are given. The magnitude and direction of the magnetization vector indicate that the vertical component of the magnetic field calculated from total field observations is more accurate at higher geomagnetic latitudes than at lower latitudes. The opposite is true for the horizontal components. The error in determining the magnetization vector directions are significantly large over most of the range of variation of declination and inclination of the vector, demonstrating the practical limitations of computing field components from total field data even under the best of conditions.

Bhattacharyya, B. K.↗

Recent advances in thermal-structural analysis and design

A continuing effort to develop a comprehensive capability for thermal-structural analysis and automated design (sizing) is reviewed. A principal role in the activity is played by the finite element program SPAR which contains both an efficient structural and thermal analysis capability. The benefit of having thermal and structural analyses in the same finite element program is illustrated by the application of SPAR to design calculations for the National Transonic Facility - a cryogenic wind tunnel under construction at Langley. Some experience with large-scale thermal structural analysis problems, particularly the space shuttle orbiter, has led to the identification of some analysis needs. Those needs include automated model generation and data output for lumped parameter thermal analysis, faster solution methods for nonlinear transient heat transfer, automated interpolation of temperature data from a thermal finite element model to a dissimilar structural finite model, and automated techniques to identify the times at which the critical combinations of transient heating and loads occur on a structure.

Adelman, H. M.↗

Scientific study of data analysis

We present a comparison between two numerical methods for the extrapolation of nonlinear force-free magnetic fields, the Iterative Method (IM) and the Progressive Extension Method (PEM). The advantages and disadvantages of these two methods are summarized and the accuracy and numerical instability are discussed. On the basis of this investigation, we claim that the two methods do resemble each other qualitatively.

Wu, S. T.↗

Cleanliness evaluation of rough surfaces with diffuse IR reflectance

Contamination on bonding surfaces has been determined to be a primary cause for degraded bond strength in certain solid rocket motor bondlines. Hydrocarbon and silicone based organic contaminants that are airborne or directly introduced to a surface are a significant source of contamination. Diffuse infrared (IR) reflectance has historically been used as an effective technique for detection of organic contaminants, however, common laboratory methods involving the use of a Fourier transform IR spectrometer (FTIR) are impractical for inspecting the large bonding surface areas found on solid rocket motors. Optical methods involving the use of acousto-optic tunable filters and fixed bandpass optical filters are recommended for increased data acquisition speed. Testing and signal analysis methods are presented which provide for simultaneous measurement of contamination concentration and roughness level on rough metal surfaces contaminated with hydrocarbons.

Pearson, L. H.↗

Method for Visually Integrating Multiple Data Acquisition Technologies for Real Time and Retrospective Analysis

A system for display on a single video display terminal of multiple physiological measurements is provided. A subject is monitored by a plurality of instruments which feed data to a computer programmed to receive data, calculate data products such as index of engagement and heart rate, and display the data in a graphical format simultaneously on a single video display terminal. In addition live video representing the view of the subject and the experimental setup may also be integrated into the single data display. The display may be recorded on a standard video tape recorder for retrospective analysis.

Bogart, Edward H.↗

Analysis Methods and Results for Weak Gamma-Ray Bursts in the BATSE Data

We report initial results on the statistical properties of the dimmest gamma-ray bursts (GRBs) observed with the Burst and Transient Source Experiment (BATSE), using new ground-based methods to obtain a sample of GRBs from 502 days of BATSE data. Using the most sensitive ground-based detection of GRBs, the sample extends to GRBs much fainter than those detected by the on-board trigger, but because of the temporal resolution of the data, the sample is limited to GRBs of duration of at least 2(approx.)s. For each detected event, Bayesian probabilities are calculated for the event to belong to each of seven classes of differing physical origins. The sample of GRB candidates is defined by the requirement that the Bayesian probability for belonging to the GRB class is higher than 0.5. The intensity distribution of the GRB sample is corrected using a Monte Carlo simulation of the post-flight detection efficiency. The dimmest BATSE bursts of the sample continue the hardness-intensity trend seen in brighter GREs and are consistent with isotropy.

Mitrofanov, I. G.↗

How reliable is distribution of relaxation times (DRT) analysis? A dual regression-classification perspective on DRT estimation, interpretation, and accuracy

The distribution of relaxation times (DRT) has gained increasing attention and adoption in recent years as a versatile method for analyzing electrochemical impedance spectroscopy (EIS) data obtained from complex devices like fuel cells, electrolyzers, and batteries. The DRT deconvolutes the impedance without a priori specification of a generative model, which is especially useful for interpretation and model selection when the governing principles of the system under study are not fully understood. However, DRT estimation is an ill-posed inversion problem that must be addressed with a subjective choice of regularization and tuning, which leaves substantial risk of misleading interpretations of EIS data. In this work, we suggest a new classification view of the DRT inversion to clarify DRT estimation and interpretation. We introduce a dual regression-classification framework that unifies the classification and regression views of the DRT inversion with wide-reaching implications for DRT analysis. The dual framework is employed to demonstrate a new kind of DRT inversion algorithm and develop novel evaluation metrics that capture previously ignored aspects of DRT accuracy. These approaches are applied to both synthetic data and experimental spectra collected from a protonic ceramic fuel cell and a lithium-ion battery to illustrate their broad utility. The dual inversion algorithm shows promising performance for accurate DRT estimation and autonomous model identification, while the dual evaluation approach produces metrics that meaningfully assess the strengths and risks of DRT algorithms. Here this work provides valuable insight for both practical application of the DRT to experimental data and further development of EIS analysis methods.

36 MATERIALS SCIENCE↗

Cultivating an Emergent Earth Observation Analytics Ecosystem in the Cloud

A diverse set of data analytics systems for Earth Observations are sprouting up in the Earth Science community, with a wealth of processing algorithms and analysis methods. There is a similar wealth of data resources available via myriad data providers and clearinghouses, including large institutional systems like the Earth Observing System Data and Information System, Comprehensive Large Scale Array-data Stewardship System, and Federated Earth Observation Missions gateway. With Earth system science driving a need to work with more datasets together, and the community developing more analysis tools (some of them dataset-specific), how can we develop analysis workflows that incorporate far-flung datasets and leverage analysis resources from multiple organizations? Cloud computing points the way toward a solution in two different respects. Firstly, the access to and abstraction of virtually unlimited storage and computing power provides an environment that enables more straightforward means of pulling datasets and analysis resources together. Just as importantly, however, cloud computing serves as an example of an "ecosystem" of interoperating services, since the essence of cloud computing is the presentation of all resources as a service, from hardware to infrastructure to platform to software. This enables the combination of off-the-shelf, diverse services to construct entire systems that emerge out of an equally diverse community of architects and developers. This approach can be similarly applied to the data and analysis resources in the Earth Observation community. By exposing these resources via well understood services, and consuming resources in the same way, different organizations can construct bespoke analysis workflows and systems for their own purposes. The key leap the community needs to make is to develop analysis systems in components that interact with other components via services. The result would be a rich ecosystem of analytics components that can be combined to analyze datasets at scale and in conjunction with other datasets from other sources.

chaos↗