Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “Domain reduction method”

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.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 127 records · Page 7
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Transfer learning of memory kernels for transferable coarse-graining of polymer dynamics

The present work concerns the transferability of coarse-grained (CG) modeling in reproducing the dynamic properties of the reference atomistic systems across a range of parameters. In particular, we focus on implicit-solvent CG modeling of polymer solutions. The CG model is based on the generalized Langevin equation, where the memory kernel plays the critical role in determining the dynamics in all time scales. Thus, we propose methods for transfer learning of memory kernels. The key ingredient of our methods is Gaussian process regression. By integration with the model order reduction via proper orthogonal decomposition and the active learning technique, the transfer learning can be practically efficient and requires minimum training data. Through two example polymer solution systems, we demonstrate the accuracy and efficiency of the proposed transfer learning methods in the construction of transferable memory kernels. The transferability allows for out-of-sample predictions, even in the extrapolated domain of parameters. Built on the transferable memory kernels, the CG models can reproduce the dynamic properties of polymers in all time scales at different thermodynamic conditions (such as temperature and solvent viscosity) and for different systems with varying concentrations and lengths of polymers.

Ma, Zhan↗
NASA NTRS2016

Earth Science Data Analytics: Preparing for Extracting Knowledge from Information

Data analytics is the process of examining large amounts of data of a variety of types to uncover hidden patterns, unknown correlations and other useful information. Data analytics is a broad term that includes data analysis, as well as an understanding of the cognitive processes an analyst uses to understand problems and explore data in meaningful ways. Analytics also include data extraction, transformation, and reduction, utilizing specific tools, techniques, and methods. Turning to data science, definitions of data science sound very similar to those of data analytics (which leads to a lot of the confusion between the two). But the skills needed for both, co-analyzing large amounts of heterogeneous data, understanding and utilizing relevant tools and techniques, and subject matter expertise, although similar, serve different purposes. Data Analytics takes on a practitioners approach to applying expertise and skills to solve issues and gain subject knowledge. Data Science, is more theoretical (research in itself) in nature, providing strategic actionable insights and new innovative methodologies. Earth Science Data Analytics (ESDA) is the process of examining, preparing, reducing, and analyzing large amounts of spatial (multi-dimensional), temporal, or spectral data using a variety of data types to uncover patterns, correlations and other information, to better understand our Earth. The large variety of datasets (temporal spatial differences, data types, formats, etc.) invite the need for data analytics skills that understand the science domain, and data preparation, reduction, and analysis techniques, from a practitioners point of view. The application of these skills to ESDA is the focus of this presentation. The Earth Science Information Partners (ESIP) Federation Earth Science Data Analytics (ESDA) Cluster was created in recognition of the practical need to facilitate the co-analysis of large amounts of data and information for Earth science. Thus, from a to advance science point of view: On the continuum of ever evolving data management systems, we need to understand and develop ways that allow for the variety of data relationships to be examined, and information to be manipulated, such that knowledge can be enhanced, to facilitate science. Recognizing the importance and potential impacts of the unlimited ways to co-analyze heterogeneous datasets, now and especially in the future, one of the objectives of the ESDA cluster is to facilitate the preparation of individuals to understand and apply needed skills to Earth science data analytics. Pinpointing and communicating the needed skills and expertise is new, and not easy. Information technology is just beginning to provide the tools for advancing the analysis of heterogeneous datasets in a big way, thus, providing opportunity to discover unobvious scientific relationships, previously invisible to the science eye. And it is not easy It takes individuals, or teams of individuals, with just the right combination of skills to understand the data and develop the methods to glean knowledge out of data and information. In addition, whereas definitions of data science and big data are (more or less) available (summarized in Reference 5), Earth science data analytics is virtually ignored in the literature, (barring a few excellent sources).

data analytics↗
DOE OSTI2024

CI-MOR Final Report: Analysis and Validation of Critical Infrastructure Models using Model Order Reduction

This report summarizes the research and capabilities developed as part of the project “Analysis and Validation of Critical Infrastructure Models using Model Order Reduction” (CI-MOR) LDRD project. CI-MOR research enables the solution of large, complex optimization models that naturally arise in national security challenges involving critical infrastructures. Specifically, CI-MOR researchers developed methods to (1) rigorously approximate complex, nonlinear optimization formulations, (2) identify alternative near-optimal solutions, (3) accelerate optimization workflows used for complex applications, and (4) rigorously integrate domain knowledge in stochastic-process models. This report provides an overview of the research done in CI-MOR, and we describe application exemplars used to illustrate CI-MOR capabilities. Furthermore, we describe the software developed by CI-MOR that researchers can leverage to analyze new applications.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS1981

Spherical earth gravity and magnetic anomaly analysis by equivalent point source inversion

To facilitate geologic interpretation of satellite elevation potential field data, analysis techniques are developed and verified in the spherical domain that are commensurate with conventional flat earth methods of potential field interpretation. A powerful approach to the spherical earth problem relates potential field anomalies to a distribution of equivalent point sources by least squares matrix inversion. Linear transformations of the equivalent source field lead to corresponding geoidal anomalies, pseudo-anomalies, vector anomaly components, spatial derivatives, continuations, and differential magnetic pole reductions. A number of examples using 1 deg-averaged surface free-air gravity anomalies of POGO satellite magnetometer data for the United States, Mexico, and Central America illustrate the capabilities of the method.

Von Frese, R. R. B.↗
DOE OSTI2025

Using Eye Tracking to Elucidate the Mechanisms Underlying Stimulation-Enhanced Visual Target Detection

Transcranial direct current stimulation (tDCS) is a noninvasive form of brain stimulation that involves passing a weak electrical current between electrodes on the scalp to modulate underlying neural tissue. TDCS has been shown to modulate cognition in a variety of domains, including memory, attention, and visual processing. Prior work from our laboratory has shown positive effects of tDCS on learning to detect target objects hidden in complex naturalistic visual scenes and learn rules for categorizing images, though the mechanism for these benefits remains unknown. One possibility is that tDCS optimizes visual search by modulating visual attention or via the reduction in search errors. One method of quantifying visual attention is to use eye tracking to record search patterns to determine if and how visual search is adjusted under verum stimulation conditions. Eye tracking data allows classification of errors into error types, including sampling errors (failing to look in the relevant region), recognition errors (looking at the critical portion of a scene, but failing to recognize it as such as evidenced by visual fixation), and decision-making errors (fixating on the relevant portion of a scene, but making the wrong determination). Our results indicate that the benefit tDCS confers on visual search for targets stems from the reduction in decision-making errors when targets are present (Cohen’s d = 0.86). Also reported is a replication of previous findings showing a tDCS-dependent improvement in learning this task, learning score (Cohen’s d = 0.88); d’ (Cohen’s d = 1.00). This provides support for moving tDCS into the application space by pairing it with analysts who are concerned with the type of search error that is corrected via stimulation.

attention↗
DOE OSTI2021

A Study on Computational Cost Reduction of Simulations of Phase-Change Material (PCM) Embedded Heat Exchangers

Thermal storage can be implemented using Phase-Change Materials (PCM), which absorb significant latent heat with a relatively small temperature change. PCM phase-change processes are transient and are driven by thermal diffusion and natural convection – the latter, especially for melting process. Modeling and simulation of PCM heat exchangers (HX’s) is typically computationally intensive due to the relatively complex time-dependent physics. Most of the PCM modeling work in the literature uses high-order modeling tools such as Computational Fluid Dynamics (CFD) and Lattice-Boltzmann Method (LBM). For design purposes, the existing PCM modeling approaches are not practical, limiting researchers in their ability to investigate new ideas and different PCM’s with faster turnarounds. This paper presents a study investigating the reduction of computational cost of PCM embedded HX’s CFD models by evaluating the feasibility of spatial reduction without losing accuracy. The analysis consists of comparing full and partial domain under full melting conditions. The subject of this study is a single straight tube with circular transverse fins in the vertical orientation, using PCM’s with 35oC nominal melting temperature. Different tube and fin dimensions are investigated. Results indicate that the reduced domain reproduces - in half the run time - the same behavior as the full domain since the buoyancy effects are localized and patterned. The outputs from the partial domain simulation were used to build a non-general correlation for the PCM heat transfer characteristics and demonstrated how it can be implemented in a Finite Control Volume Reduced Order Model (ROM). The ROM can accurately reproduce the CFD simulations at 4 to 5 orders of magnitude faster.

25 ENERGY STORAGE↗
NASA NTRS1992

Computing high-speed flows past an oscillating cylinder near a vertical wall

A computational method to simulate unsteady flows involving moving rigid boundaries and interference has been developed. The method is used to solve inviscid equations governing the fluid flow and the dynamic equations governing the motion of rigid bodies. A second-order accurate, upwind-biased, and alterating-direction-implicit method is used to solve the governing equations of the flow. A kinematic domain decomposition (KDD) procedure is extended to treat 3D problems with a high degree of accuracy and generality. The method under consideration is applied to both transonic and supertransonic flows. Both cases involve flow past a cylinder which is forced to pitch sinusoidally near a vertical wall. Benefits of the proposed approach include accurate calculation of the flow around 3D moving multiple bodies with interference; reduction of a numerical error; in particular, the dispersion error which strongly affects wave propagation; and minimization of the phase error which is accumulated according to the time advance procedure.

Yen, Guan-Wei↗
NASA NTRS1989

Domain decomposition methods for systems of conservation laws: Spectral collocation approximations

Hyperbolic systems of conversation laws are considered which are discretized in space by spectral collocation methods and advanced in time by finite difference schemes. At any time-level a domain deposition method based on an iteration by subdomain procedure was introduced yielding at each step a sequence of independent subproblems (one for each subdomain) that can be solved simultaneously. The method is set for a general nonlinear problem in several space variables. The convergence analysis, however, is carried out only for a linear one-dimensional system with continuous solutions. A precise form of the error reduction factor at each iteration is derived. Although the method is applied here to the case of spectral collocation approximation only, the idea is fairly general and can be used in a different context as well. For instance, its application to space discretization by finite differences is straight forward.

Quarteroni, Alfio↗
DOE OSTI2023

Interactive Power to Frequency Dynamics Between Grid-Forming Inverters and Synchronous Generators in Power Electronics-Dominated Power Systems

With increased attention on grid-forming inverters as a power system stabilizing device during high shares of inverter-based resource operations, there is a present need for a transparent and methodical investigation of the inverted and direct power to frequency control capabilities and impacts of these devices on emerging power systems. Here, analysis of the frequency dynamics of the droop-controlled grid-forming inverter and the synchronous generator illuminates the inverted active power-frequency relationship and the frequency response order reduction, forming the basis for novel, nonlinear frequency control approaches. Device-level electromagnetic transient domain simulations corroborate the order-reduction findings, establish that a properly designed dc-side system has a negligible impact on power transfer and will not impede frequency regulation, and confirm the primary frequency response improvement with nonlinear control. Simulations of the 9- and 39-bus test systems validate the order reduction and associated decoupling of the nadir and rate of change of frequency in larger networks. Oscillatory mode analysis confirms the grid-forming benefit of increased damping; decreased damping is observed at shares above 80%, but not at 100%. Finally, simulations on a validated Maui power system model with a 96% of inverter-based resources model yield a trend toward a first-order response.

24 POWER TRANSMISSION AND DISTRIBUTION↗
NASA NTRS1994

A Space and Atmospheric Visualization Science System

SAVS (a Space and Atmospheric Visualization Science system) is an integrated system with user-friendly functionality that employs a 'push-button' software environment that mimics the logical scientific processes in data acquisition, reduction, analysis, and visualization. All of this is accomplished without requiring a detailed understanding of the methods, networks, and modules that link the tools and effectively execute the functions. This report describes SAVS and its components, followed by several applications based on generic research interests in interplanetary and magnetospheric physics (IMP/ISTP), active experiments in space (CRRES), and mission planning focused on the earth's thermospheric, ionospheric, and mesospheric domains (TIMED). The final chapters provide a user-oriented description of interface functionalities, hands-on operations, and customized modules, with details of the primary modules presented in the appendices. The overall intent of the report is to reflect the accomplishments of the three-year development effort and to introduce potential users to the power and utility of the integrated data acquisition, analysis, and visualization system.

Szuszczewicz, E. P.↗
DOE OSTI2020

Machine Learning for Memory Reduction in the Implicit Monte Carlo Simulations of Thermal Radiative Transfer [Slides]

Project Goal: Use parametric Machine Learning methods in order to reduce memory requirements at checkpointing & restarting in the IMC simulations of Thermal Radiative Transfer using: Expectation Maximization and Weighted Gaussian Mixture Model-based approach for `particle-data compression', introduced in Plasma Physics to model Maxwellian particle distributions by Luis Chacon and Guangye Chen; Expectation Maximization with Weighted Hyper-Erlang Model in order to compress isotropic IMC particle data in the frequency domain; and Expectation Maximization and von Mises-Fisher Mixture Model for compression of anisotropic IMC particle data in the angular domain (work-in-progress).

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS1986

Coherent lidar signal fluctuation reduction by means of frequency diversity technique

The atmospheric return measured by a coherent lidar is typically characterized by rapid and deep fluctuations in signal strength. These fluctuations result from the interference of the fields backscattered to the lidar from randomly located aerosol particles which move relative to the lidar pulse. In many applications, it is necessary to determine the average value of the lidar signal intensity at some range. A new method utilizes frequency diversity initially suggested by Goldstein and subsequently studied in the microwave radar domain by others. It is expected that the application of the frequency diversity method in the coherent lidar domain will eventually provide greater efficiency and speed in the return signal averaging needed to obtain accurate intensity estimates. The frequency diversity method recognizes that the transmitted lidar pulse is very long compared to a wavelength and consequently a given phase, theta sub i, is repeated many times within the pulse. In order to test this concept, a fairly simple laboratory experiment was designed which simulates scattering of a lidar pulse from atmospheric aerosol. The testing of the frequency diversity method is discussed.

Schotland, R. M.↗
NASA NTRS1991

Rotor noise

The physical characteristics and sources of rotorcraft noise as they exist today are presented. Emphasis is on helicopter-like vehicles, that is, on rotorcraft in nonaxial flight. The mechanisms of rotor noise are reviewed in a simple physical manner for the most dominant sources of rotorcraft noise. With simple models, the characteristic time- and frequency-domain features of these noise sources are presented for idealized cases. Full-scale data on several rotorcraft are then reviewed to allow for the easy identification of the type and extent of the radiating noise. Methods and limitations of using scaled models to test for several noise sources are subsequently presented. Theoretical prediction methods are then discussed and compared with experimental data taken under very controlled conditions. Finally, some promising noise reduction technology is reviewed.

Schmitz, F. H.↗
NASA NTRS2015

Automatic Speech Acquisition and Recognition for Spacesuit Audio Systems

NASA has a widely recognized but unmet need for novel human-machine interface technologies that can facilitate communication during astronaut extravehicular activities (EVAs), when loud noises and strong reverberations inside spacesuits make communication challenging. WeVoice, Inc., has developed a multichannel signal-processing method for speech acquisition in noisy and reverberant environments that enables automatic speech recognition (ASR) technology inside spacesuits. The technology reduces noise by exploiting differences between the statistical nature of signals (i.e., speech) and noise that exists in the spatial and temporal domains. As a result, ASR accuracy can be improved to the level at which crewmembers will find the speech interface useful. System components and features include beam forming/multichannel noise reduction, single-channel noise reduction, speech feature extraction, feature transformation and normalization, feature compression, and ASR decoding. Arithmetic complexity models were developed and will help designers of real-time ASR systems select proper tasks when confronted with constraints in computational resources. In Phase I of the project, WeVoice validated the technology. The company further refined the technology in Phase II and developed a prototype for testing and use by suited astronauts.

Ye, Sherry↗
DOE OSTI2023

Post-Hydration Crosslinking of Ion Exchange Membranes to Control Water Content

The utilization of crosslinking as a technique to limit excess water uptake in ion exchange membranes is a well-established approach. However, traditional methods involve performing the crosslinking reaction before the membrane self-segregates into hydrophilic and hydrophobic domains upon exposure to water. In this study, we employ numerical and molecular simulations to explore the potential of post-hydration crosslinking of the polymer at subsaturated conditions. This process allows for the development of a nanosegregated morphology, which establishes well-connected but narrow water channels, while limiting additional sorption of water. The significant reduction in membrane swelling observed in our study indicates that post-hydration crosslinking could be a promising approach to regulate water uptake in ion exchange membranes. Here based on our analyses, we propose chemical crosslinking strategies that may yield high membrane gel fractions.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Improving the precision of forces in real-space pseudopotential density functional theory

The high-order finite difference real-space pseudopotential density functional theory (DFT) approach is a valuable method for large-scale, massively parallel DFT calculations. A significant challenge in the approach is the oscillating “egg-box” error introduced by aliasing associated with a coarse grid spacing. To address this issue while minimizing computational cost, we developed a finite difference interpolation (FDI) scheme [Roller et al., J. Chem. Theory Comput. 19, 3889 (2023)] as a means of exploiting the high resolution of the pseudopotential to reduce egg-box effects systematically. Here, we show an implementation of this method in the PARSEC code and examine the practical utility of the combination of FDI with additional methods for improving force precision and/or reducing its computational cost, including orbital-based forces, compensating charges (namely, adding and subtracting a judiciously chosen charge density such that the total density is unaltered), and a modified spatial domain in which the real-space grid is defined. Using selected small molecules, as well as metallic Li, as test cases, we show that a combination of all four aspects leads to a significant reduction in computational cost while retaining a high level of precision that supports accurate structures and vibrational spectra, as well as stable and accurate molecular dynamics runs.

Chemistry↗
NASA NTRS2002

Structural Studies of Human Pyruvate Dehydrogenase

Human pyruvate dehydrogenase (E1) catalyzes the irreversible decarboxylation of pyruvate in the presence of Mg(2+) and thiamin pyrophosphate (TPP) followed by the rate-limiting reductive acetylation of the lipoyl moiety linked to dihydrolipoamide acetyltransferase. The three-dimensional structure of human E1 is elucidated using the methods of macromolecular X-ray crystallography. The structure is an alpha, alpha', beta and beta' tetramer with the protein units being in the tetrahedral arrangement. Each 361-residue alpha-subunit and 329-residue beta-subunit is composed of a beta-sheet core surrounded by alpha-helical domains. Each subunit is in extensive contact with all the three subunits involving TPP and magnesium cofactors, and potassium ions. The two binding sites for TPP are at the alpha-beta' and alpha'-beta interfaces, each involving a magnesium ion and Phe6l, His63, Tyr89, and Met200 from the alpha-subunit (or alpha'-subunit), and Met81 Phe85, His128 from the beta-subunit (or beta'-subunit). K+ ions are nestled between two beta-sheets and the end of an alpha-helix in each beta-subunit, where they are coordinated by four carbonyl oxygen groups from Ile12, Ala160, Asp163, and Asnl65, and a water molecule. The catalytic C2 carbon of thiazolium ring in this structure forms a 3.2 A contact with a water molecule involved in a series of H-bonds with other water molecules, and indirectly with amino acids including those involved in the catalysis and regulation of the enzyme.

Ciszak, Ewa↗
DOE OSTI2023

Extending Parsimonious Bayesian Inference

Parsimonious Bayesian inference is a theoretical framework for efficient data assimilation that seeks to balance increased consistency between predictions and training data against corresponding increases in model complexity. Within this framework, over-training is understood as optimization that encodes excessive information within model parameters while only achieving small improvements between predictions and training data. This project aims to develop practical methods of limiting excess model information during optimization. One key observation is that practical heuristics for parsimonious learning in high-dimensions must balance expressivity, i.e. the ability of the model to capture diverse predictions with only a few non-zero parameters, against discoverability, i.e. the ability to train the model with gradient-based optimization and drive parameters to low information states. As such, we developed logical activation functions that are able to adaptively approximate arbitrary truth tables that define Boolean logic operations within a probabilistic framework. These functions have demonstrated the ability to learn exclusive disjunction (XOR) and conditioned disjunction (if [condition] then [result_if_true] else [result_if_false]) within a single layer of a neural network. To efficiently exploit these activation functions to drive parsimonious learning required several other advances within the domain of variational inference. The most efficient form of complexity suppression is structured sparsification, driving most model parameters to zero while achieving the structural coherence among nonzeros needed for bandwidth reduction. Such models are not only far more efficient at suppressing information-theoretic complexity, they also reduce the other forms of complexity (computations, communication, storage, and the number of dependencies needed to evaluate predictions). Aiming to support enhanced sparsification, this project examined new approaches to high-dimensional variational inference that allow us to calibrate and control parameter uncertainty during optimization. By identifying which parameters can sustain sparsifying perturbations with little impact on prediction quality, we can develop better pruning strategies by framing them as approximate Bayesian inference. These advances also open paths to mitigate concerns with deploying advanced learning methods in resource-constrained environments, such as running models on power-limited or communication-limited devices.

97 MATHEMATICS AND COMPUTING↗