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At least 793 records · Page 44

All sources NASA NTRS DOE OSTI

DOE OSTI2022

Augmented Adam-Gibbs model for glass melt viscosity and configuration entropy as functions of temperature and composition

As the temperature of glass melt increases, its structure approaches the state of a simple liquid while the configuration entropy approaches a maximum value. We describe this gradual change using a power law function of inverse temperature. The Adam-Gibbs model for glass viscosity as a function of temperature and glass composition augmented in this way is greatly simplified when applied to common glass families occupying moderate composition regions, such as float glass or nuclear waste glasses, on which properties can be approximated as linear functions of composition. The parsimonious model thus obtained is preferable for use in optimizing glass formulation and mathematical modeling of glass melting and forming. For multicomponent glasses with N viscosity-affecting components, the augmented Adam-Gibbs model requires 2N + 3 adjustable parameters. The model efficacy is demonstrated by fitting the model to a viscosity-temperature-composition dataset for low-activity nuclear waste glasses.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2022

Electron energy loss spectroscopy database synthesis and automation of core-loss edge recognition by deep-learning neural networks

Abstract The ionization edges encoded in the electron energy loss spectroscopy (EELS) spectra enable advanced material analysis including composition analyses and elemental quantifications. The development of the parallel EELS instrument and fast, sensitive detectors have greatly improved the acquisition speed of EELS spectra. However, the traditional way of core-loss edge recognition is experience based and human labor dependent, which limits the processing speed. So far, the low signal–noise ratio and the low jump ratio of the core-loss edges on the raw EELS spectra have been challenging for the automation of edge recognition. In this work, a convolutional-bidirectional long short-term memory neural network (CNN-BiLSTM) is proposed to automate the detection and elemental identification of core-loss edges from raw spectra. An EELS spectral database is synthesized by using our forward model to assist in the training and validation of the neural network. To make the synthesized spectra resemble the real spectra, we collected a large library of experimentally acquired EELS core edges. In synthesize the training library, the edges are modeled by fitting the multi-Gaussian model to the real edges from experiments, and the noise and instrumental imperfectness are simulated and added. The well-trained CNN-BiLSTM network is tested against both the simulated spectra and real spectra collected from experiments. The high accuracy of the network, 94.9%, proves that, without complicated preprocessing of the raw spectra, the proposed CNN-BiLSTM network achieves the automation of core-loss edge recognition for EELS spectra with high accuracy.

36 MATERIALS SCIENCE↗

DOE OSTI2025

Modeling ethanol/water adsorption in all-silica zeolites using the real adsorbed solution theory

A comprehensive set of single-component and binary isotherms were collected for ethanol/water adsorption into the siliceous forms of 185 known zeolites using grand-canonical Monte Carlo simulations. Using these data, a systematic analysis of ideal/real adsorbed-solution theory (IAST/RAST) was conducted and activity coefficients were derived for ethanol/water mixtures adsorbed in different zeolites based on RAST. It was found that activity coefficients of ethanol are close to unity while activity coefficients of water are larger in most zeolites, indicating a positive excess free energy of the mixture. This observation can be attributed to water/ethanol interactions being less favorable than water/water interactions in the single-component adsorption of water at comparable loadings. The deviation from ideal behavior can be highly structure-dependent but no clear correlation with pore diameters was identified. Furthermore, our analysis also demonstrates the following: (1) accurate unary isotherms in the low-loading regime are critical for obtaining physically sensible activity coefficients; (2) the global regression scheme to solve for activity model parameters performs better than fitting activity models to activity coefficients calculated locally at each binary state point; and (3) including the dependence on adsorption potential offers only a minor benefit for describing binary adsorption at the lowest fugacities. Finally, the Margules activity model was found incapable of capturing the non-ideal adsorption behavior over the entire range of fugacities and compositions in all zeolites, but for conditions typical of solution-phase adsorption, RAST predictions using zeolite-specific or even bulk Margules parameters provide an improved description compared to IAST.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2020

The completed SDSS-IV extended Baryon Oscillation Spectroscopic Survey: large-scale structure catalogues and measurement of the isotropic BAO between redshift 0.6 and 1.1 for the Emission Line Galaxy Sample

ABSTRACT We present the Emission Line Galaxy (ELG) sample of the extended Baryon Oscillation Spectroscopic Survey from the Sloan Digital Sky Survey IV Data Release 16. We describe the observations and redshift measurement for the 269 243 observed ELG spectra, and then present the large-scale structure catalogues, used for the cosmological analysis, and made of 173 736 reliable spectroscopic redshifts between 0.6 and 1.1. We perform a spherically averaged baryon acoustic oscillations (BAO) measurement in configuration space, with density field reconstruction: the data two-point correlation function shows a feature consistent with that of the BAO, the BAO model being only weakly preferred over a model without BAO (Δχ2 < 1). Fitting a model constrained to have a BAO feature provides a 3.2 per cent measurement of the spherically averaged BAO distance DV(zeff)/rdrag = 18.23 ± 0.58 at the effective redshift zeff = 0.845.

Raichoor, Anand↗

DOE OSTI2024

Three-Stage Adjusted Regression Forecasting for Software Defect Prediction

In this paper, a three-stage adjusted regression forecasting model is proposed to forecast the local regression model [6]. This is a growth curve approximation model that predicts the parameters for a future linear model based on a sliding window of previous linear models. The three stages of the model are as follows: • Initial fit: train regression models on a sliding window of the date and record model coefficients. • Prediction: fit new regression models to the coefficient lists and predict the value of the next coefficient. • Error correction: correct coefficient prediction error using the residual of the last point of the coefficient list and moving average. The resulting model from the multi-stage process is a forecast of the local regression model that represents the future window of data and is referred to as the predicted line. Results suggest the three-stage model demonstrates better prediction capability compared to existing solutions.

Pritchard, Shadow↗

DOE OSTI2021

A Gaussian Process Regression Reveals No Evidence for Planets Orbiting Kapteyn’s Star

Radial–velocity (RV) planet searches are often polluted by signals caused by gas motion at the star’s surface. Stellar activity can mimic or mask changes in the RVs caused by orbiting planets, resulting in false positives or missed detections. Here we use Gaussian process regression to disentangle the contradictory reports of planets versus rotation artifacts from Kapteyn’s star. To model rotation, we use joint quasiperiodic kernels for the RV and Hα signals, requiring that their periods and correlation timescales be the same. We find that the rotation period of Kapteyn’s star is 125 days, while the characteristic active-region lifetime is 694 days. Adding a planet to the RV model produces a best-fit orbital period of 100 yr, or 10 times the observing time baseline, indicating that the observed RVs are best explained by star rotation only. We also find no significant periodic signals in residual RV data sets constructed by subtracting off realizations of the best-fit rotation model and conclude that both previously reported “planets” are artifacts of the star’s rotation and activity. Our results highlight the pitfalls of using sinusoids to model quasiperiodic rotation signals.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

NASA NTRS1982

Quantiles, parametric-select density estimation, and bi-information parameter estimators

A quantile-based approach to statistical analysis and probability modeling of data is presented which formulates statistical inference problems as functional inference problems in which the parameters to be estimated are density functions. Density estimators can be non-parametric (computed independently of model identified) or parametric-select (approximated by finite parametric models that can provide standard models whose fit can be tested). Exponential models and autoregressive models are approximating densities which can be justified as maximum entropy for respectively the entropy of a probability density and the entropy of a quantile density. Applications of these ideas are outlined to the problems of modeling: (1) univariate data; (2) bivariate data and tests for independence; and (3) two samples and likelihood ratios. It is proposed that bi-information estimation of a density function can be developed by analogy to the problem of identification of regression models.

Parzen, E.↗

NASA NTRS1989

Application of statistical distribution theory to launch-on-time for space construction logistic support

The ability to launch-on-time and to send payloads into space has progressed dramatically since the days of the earliest missile and space programs. Causes for delay during launch, i.e., unplanned 'holds', are attributable to several sources: weather, range activities, vehicle conditions, human performance, etc. Recent developments in space program, particularly the need for highly reliable logistic support of space construction and the subsequent planned operation of space stations, large unmanned space structures, lunar and Mars bases, and the necessity of providing 'guaranteed' commercial launches have placed increased emphasis on understanding and mastering every aspect of launch vehicle operations. The Center of Space Construction has acquired historical launch vehicle data and is applying these data to the analysis of space launch vehicle logistic support of space construction. This analysis will include development of a better understanding of launch-on-time capability and simulation of required support systems for vehicle assembly and launch which are necessary to support national space program construction schedules. In this paper, the author presents actual launch data on unscheduled 'hold' distributions of various launch vehicles. The data have been supplied by industrial associate companies of the Center for Space Construction. The paper seeks to determine suitable probability models which describe these historical data and that can be used for several purposes such as: inputs to broader simulations of launch vehicle logistic space construction support processes and the determination of which launch operations sources cause the majority of the unscheduled 'holds', and hence to suggest changes which might improve launch-on-time. In particular, the paper investigates the ability of a compound distribution probability model to fit actual data, versus alternative models, and recommends the most productive avenues for future statistical work.

Morgenthaler, George W.↗

NASA NTRS1995

Elliptical accretion disks in active galactic nuclei

We present a calculation of the profiles of emission lines originating in a relativistic, eccentric disk, and show examples of the resulting model profiles. Our calculations are motivated by the fact that in about one-quarter of the double-peaked emission lines observed in radio-loud active galactic nuclei (and in the mildly active nucleus of NGC 1097), the red peak is stronger than the blue peak, which is contrary to the prediction of relativistic, circular disk models. Using the eccentric disk model we fit some of the observed profiles that cannot be fitted with a circular disk model. We propose two possible scenarios for the formation of an eccentric disk in an active galactic nucleus: (a) tidal perturbation of the disk around a supermassive black hole by a smaller binary companion, and (b) formation of an elliptical disk from the debris resulting from the tidal disruption of a star by the central black hole. In the former case we show that the eccentricity can be long-lived because of the presence of the binary companion. In the latter case, although the inner parts of the disk may circularize quickly, we estimate that the outer parts will maintain their eccentricity for times much longer than the local viscous time. We suggest that it may be possible to detect profile variability on much shorter timescales than those ranging from a decade to several centuries by comparing the evolution of the line profile with detailed model predictions. We argue that line-profile variability may also be the most promising discriminant among competing models for the origin of asymmetric, double-peaked emission lines.

Eracleous, Michael↗

NASA NTRS2013

Modeling the HD 32297 Debris Disk With Far-Infrared Herschel Data

HD 32297 is a young A-star (approx. 30 Myr) 112 pc away with a bright edge-on debris disk that has been resolved in scattered light. We observed the HD 32297 debris disk in the far-infrared and sub-millimeter with the Herschel Space Observatory PACS and SPIRE instruments, populating the spectral energy distribution (SED) from 63 to 500 micron..We aimed to determine the composition of dust grains in the HD 32297 disk through SED modeling, using geometrical constraints from the resolved imaging to break the degeneracies inherent in SED modeling. We found the best fitting SED model has two components: an outer ring centered around 110 AU, seen in the scattered light images, and an inner disk near the habitable zone of the star. The outer disk appears to be composed of grains>2 micron consisting of silicates, carbonaceous material, and water ice with an abundance ratio of 1:2:3 respectively and 90% porosity. These grains appear consistent with cometary grains, implying the underlying planetesimal population is dominated by comet-like bodies. We also discuss the 3.7 sigma detection of [C ii] emission at 158 micron with the Herschel PACS instrument, making HD 32297 one of only a handful of debris disks with circumstellar gas detected

infrared: stars↗

NASA NTRS2020

Evaluation of Fatigue Damage Accumulation Functions for Delamination Initiation and Propagation

The present report follows on the cohesive fatigue damage model methodology proposed in NASA-TP-2018-219838. In that report, an empirical function describing the incremental damage due to cyclic loading was used to calculate fatigue damage within a cohesive formulation. The form of the function was developed such that, when integrated at a constant stress amplitude from no damage to failure, it produces a life versus load response that is consistent with an S-N diagram. Therefore, the parameters of the damage model could be obtained by fitting the model predictions to an S-N diagram. The finite element analyses performed demonstrate that the cohesive fatigue accumulation function provides a link between the S-N diagram that describes crack initiation, and the Paris law that characterizes the rate of crack propagation. However, when the model was proposed, it was not known whether the form of the damage accumulation function associated with a desired S-N diagram is unique and, if not, if the link between S-N and the Paris law is unique and independent of the fatigue function selected. In the effort described herein, several alternative forms of the damage function that reproduce the desired features of S-N diagrams were found and evaluated. The effects of each of these functions on the predicted parameters of the Paris law and the propagation threshold are discussed. The results indicate that the predicted exponent m of the Paris law is indeed independent of the damage accumulation function. However, different functions predict different values for the pre-factor C of the Paris law. Therefore, the proper damage accumulation function must be selected by comparison with experiments. One of the new damage accumulation functions proposed herein was found to be particularly useful for analysis because of the ease with which the model parameters can be determined with a minimal amount of experimental information. The effectiveness of the proposed methodology and damage function was demonstrated by conducting analyses of a double cantilever beam test, a mixed-mode bending test, and a three-point bending test of a skin/doubler specimen. The results indicate that the same set of model parameters can provide accurate predictions of the rate of fatigue crack propagation for a variety of material interfaces, mode mixities, load levels, and stress ratios.

Cohesive elements↗

NASA NTRSDate not supplied

Finite Element Modeling of Extravehicular Mobility Units for Use With Human Body Models – Motivation, Major Challenges, Use Cases and Preliminary Work

Finite element modeling of pressurized spacesuits and implementation with human body models offers many advantages over physical experimentation, but also presents significant challenges. A model of pressurized spacesuit softgoods was developed, integrated with an existing hardgoods model, and fitted to a human body model. Two representative loading scenarios were simulated: dynamic external suit loading and internal occupant-driven loading, to serve as proof-of-concept for the modeling techniques employed. The modeled interactions behaved as intended and illustrate that finite element models of pressurized spacesuits can be used in conjunction with human body models to assess the biomechanical behavior. Further model development and experimental validation are needed.

Finite Element↗

NASA NTRS2024

Finite Element Modeling of Extravehicular Mobility Units for Use With Human Body Models – Motivation, Major Challenges, Use Cases and Preliminary Work

Finite Element↗

DOE OSTI2023

Fitting a deep generative hadronization model

Hadronization is a critical step in the simulation of high-energy particle and nuclear physics experiments. As there is no first principles understanding of this process, physically-inspired hadronization models have a large number of parameters that are fit to data. Deep generative models are a natural replacement for classical techniques, since they are more flexible and may be able to improve the overall precision. Proof of principle studies have shown how to use neural networks to emulate specific hadronization when trained using the inputs and outputs of classical methods. However, these approaches will not work with data, where we do not have a matching between observed hadrons and partons. In this paper, we develop a protocol for fitting a deep generative hadronization model in a realistic setting, where we only have access to a set of hadrons in data. Our approach uses a variation of a Generative Adversarial Network with a permutation invariant discriminator. We find that this setup is able to match the hadronization model in Herwig with multiple sets of parameters. This work represents a significant step forward in a longer term program to develop, train, and integrate machine learning-based hadronization models into parton shower Monte Carlo programs.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

NASA NTRS1997

Hierarchical Modeling and Robust Synthesis for the Preliminary Design of Large Scale Complex Systems

Large-scale complex systems are characterized by multiple interacting subsystems and the analysis of multiple disciplines. The design and development of such systems inevitably requires the resolution of multiple conflicting objectives. The size of complex systems, however, prohibits the development of comprehensive system models, and thus these systems must be partitioned into their constituent parts. Because simultaneous solution of individual subsystem models is often not manageable iteration is inevitable and often excessive. In this dissertation these issues are addressed through the development of a method for hierarchical robust preliminary design exploration to facilitate concurrent system and subsystem design exploration, for the concurrent generation of robust system and subsystem specifications for the preliminary design of multi-level, multi-objective, large-scale complex systems. This method is developed through the integration and expansion of current design techniques: Hierarchical partitioning and modeling techniques for partitioning large-scale complex systems into more tractable parts, and allowing integration of subproblems for system synthesis; Statistical experimentation and approximation techniques for increasing both the efficiency and the comprehensiveness of preliminary design exploration; and Noise modeling techniques for implementing robust preliminary design when approximate models are employed. Hierarchical partitioning and modeling techniques including intermediate responses, linking variables, and compatibility constraints are incorporated within a hierarchical compromise decision support problem formulation for synthesizing subproblem solutions for a partitioned system. Experimentation and approximation techniques are employed for concurrent investigations and modeling of partitioned subproblems. A modified composite experiment is introduced for fitting better predictive models across the ranges of the factors, and an approach for constructing partitioned response surfaces is developed to reduce the computational expense of experimentation for fitting models in a large number of factors. Noise modeling techniques are compared and recommendations are offered for the implementation of robust design when approximate models are sought. These techniques, approaches, and recommendations are incorporated within the method developed for hierarchical robust preliminary design exploration. This method as well as the associated approaches are illustrated through their application to the preliminary design of a commercial turbofan turbine propulsion system. The case study is developed in collaboration with Allison Engine Company, Rolls Royce Aerospace, and is based on the Allison AE3007 existing engine designed for midsize commercial, regional business jets. For this case study, the turbofan system-level problem is partitioned into engine cycle design and configuration design and a compressor modules integrated for more detailed subsystem-level design exploration, improving system evaluation. The fan and low pressure turbine subsystems are also modeled, but in less detail. Given the defined partitioning, these subproblems are investigated independently and concurrently, and response surface models are constructed to approximate the responses of each. These response models are then incorporated within a commercial turbofan hierarchical compromise decision support problem formulation. Five design scenarios are investigated, and robust solutions are identified. The method and solutions identified are verified by comparison with the AE3007 engine. The solutions obtained are similar to the AE3007 cycle and configuration, but are better with respect to many of the requirements.

Koch, Patrick N.↗

NASA NTRS2005

Spectral Photometric Properties of the Moon

We modeled the solar phase curves of the moon at a series of wavelengths using the full disk telescopic observations [1]. We endeavored to keep the database self-contained, that is, to use the values derived for the solar magnitude and phase curves of the disk-integrated [1]. These observations were made in a suite of 10 narrowband filters between 0.315 microns and 1.06 microns, and in the broad band Johnson UBV filters, as part of a larger program to obtain photoelectric photometry of the larger planets. Two aspects of the lunar observations are unique. First, the observations cover phase angles from 6deg through 120deg. More importantly, the observers used a special 20-mm diameter f/15 fused quartz lens constructed solely for this purpose. The lens reduced the whole lunar image in the focal plane to a size comparable to the planets observed as part of the same program. This image was fed directly into the photometer. Thus, these observations constitute the only existing set of phase curves of the entire lunar disk over a range of wavelengths. Table 1 lists the values of the Hapke model parameters which fit the data. Figure 1 is an example of the model fits to the data.

Dominque, D.↗

DOE OSTI2020

Deeper snow increases the net soil organic carbon accrual rate in moist acidic tussock tundra: 210Pb evidence from Arctic Alaska

The net change in the carbon inventory of arctic tundra remains uncertain as global warming leads to shifts in arctic water and carbon cycles. To better understand the response of arctic tundra carbon to changes in winter precipitation amount, we investigated soil depth profiles of carbon concentration and radionuclide activities ( 7 Be, 137 Cs, 210 Pb, and 241 Am) in the active layer of a twenty-two-year winter snow depth manipulation experiment in moist acidic tussock tundra at Toolik Lake, Alaska. Depth correlations of cumulative carbon dry mass (g cm -2 ) vs. unsupported 210 Pb activity (mBq g -1 ) were examined using a modified constant rate of supply (CRS) model. Results were best fit by two-slope CRS models indicating an apparent step temporal increase in the accumulation rate of soil organic carbon. Most of the best-fit model chronologies indicated that the increase in carbon accumulation rate apparently began and persisted after snow fence construction in 1994. The inhomogeneous nature of permafrost soils and their relatively low net carbon accumulation rates make it challenging to establish robust chronologic records. Nonetheless, the data obtained in this study support a decadal-scale increase in net soil organic carbon accumulation rate in the active layer of arctic moist acidic tussock tundra under conditions of increased winter precipitation.

54 ENVIRONMENTAL SCIENCES↗

NASA NTRS1984

Satellite ephemerides for the Voyager Uranus encounter

Uranian satellite ephemerides are needed by the Voyager project to support both navigation and acquisition of scientific data. This paper presents the approach being taken to develop the ephemerides and details the initial phase of the development. That phase involves the analytical modeling of the satellites' motion and the adjustment of the model to fit astronomical observations. The paper describes the model and gives the result of a fit to 71 years of observations.

Jacobson, R. A.↗