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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 19 records
All sourcesNASA NTRSDOE OSTI
NASA NTRS2011

A Real-Time MODIS Vegetation Composite for Land Surface Models and Short-Term Forecasting

The NASA Short-term Prediction Research and Transition (SPoRT) Center is producing real-time, 1- km resolution Normalized Difference Vegetation Index (NDVI) gridded composites over a Continental U.S. domain. These composites are updated daily based on swath data from the Moderate Resolution Imaging Spectroradiometer (MODIS) sensor aboard the polar orbiting NASA Aqua and Terra satellites, with a product time lag of about one day. A simple time-weighting algorithm is applied to the NDVI swath data that queries the previous 20 days of data to ensure a continuous grid of data populated at all pixels. The daily composites exhibited good continuity both spatially and temporally during June and July 2010. The composites also nicely depicted high greenness anomalies that resulted from significant rainfall over southwestern Texas, Mexico, and New Mexico during July due to early-season tropical cyclone activity. The SPoRT Center is in the process of computing greenness vegetation fraction (GVF) composites from the MODIS NDVI data at the same spatial and temporal resolution for use in the NASA Land Information System (LIS). The new daily GVF dataset would replace the monthly climatological GVF database (based on Advanced Very High Resolution Radiometer [AVHRR] observations from 1992-93) currently available to the Noah land surface model (LSM) in both LIS and the public version of the Weather Research and Forecasting (WRF) model. The much higher spatial resolution (1 km versus 0.15 degree) and daily updates based on real-time satellite observations have the capability to greatly improve the simulation of the surface energy budget in the Noah LSM within LIS and WRF. Once code is developed in LIS to incorporate the daily updated GVFs, the SPoRT Center will conduct simulation sensitivity experiments to quantify the impacts and improvements realized by the MODIS real-time GVF data. This presentation will describe the methodology used to develop the 1-km MODIS NDVI composites and show sample output from summer 2010, compare the MODIS GVF data to the AVHRR monthly climatology, and illustrate the sensitivity of the Noah LSM within LIS and/or the coupled LIS/WRF system to the new MODIS GVF dataset.

Case, Jonathan L.↗
DOE OSTI2024

Adaptive Variational Quantum Computing Approaches for Green’s Functions and Nonlinear Susceptibilities

Here, we present and benchmark quantum computing approaches for calculating real-time single-particle Green’s functions and nonlinear susceptibilities of Hamiltonian systems. The approaches leverage adaptive variational quantum algorithms for state preparation and propagation. Using automatically generated compact circuits, the dynamical evolution is performed over sufficiently long times to achieve adequate frequency resolution of the response functions. We showcase accurate Green’s function calculations using a statevector simulator on classical hardware for Fermi-Hubbard chains of 4 and 6 sites, with maximal ansatz circuit depths of 65 and 424 layers, respectively, and for the molecule LiH with a maximal ansatz circuit depth of 81 layers. Additionally, we consider an antiferromagnetic quantum spin-1 model that incorporates the Dzyaloshinskii-Moriya interaction to illustrate calculations of the third-order nonlinear susceptibilities, which can be measured in two-dimensional coherent spectroscopy experiments. These results demonstrate that real-time approaches using adaptive parametrized circuits to evaluate linear and nonlinear response functions can be feasible with near-term quantum processors.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS2008

A VARI-Based Relative Greenness from MODIS Data for Computing the Fire Potential Index

The Fire Potential Index (FPI) relies on relative greenness (RG) estimates from remote sensing data. The Normalized Difference Vegetation index (NDVI), derived from NOAA Advanced Very High Resolution Radiometer (AVHRR) imagery is currently used to calculate RG operationally. Here we evaluated an alternate measure of RG using the Visible Atmospheric Resistant Index (VARI) derived from Moderate Resolution Imaging Spectrometer (MODIS) data. VARI was chosen because it has previously been shown to have the strongest relationship with Live Fuel Moisture (LFM) out of a wide selection of MODIS-derived indices in southern California shrublands. To compare MODIS-based NDVI-FPI and VARI-FPI, RG was calculated from a 6-year time series of MODIS composites and validated against in-situ observations of LFM as a surrogate for vegetation greenness. RG from both indices was then compared in terms of its performance for computing the FPI using historical wildfire data. Computed RG values were regressed against ground-sampled LFM at 14 sites within Los Angeles County. The results indicate the VARI-based RG consistently shows a stronger relationship with observed LFM than NDVI-based RG. With an average R2 of 0.727 compared to a value of only 0.622 for NDVI-RG, VARI-RG showed stronger relationships at 13 out of 14 sites. Based on these results, daily FPI maps were computed for the years 2001 through 2005 using both NDVI-RG and VARI-RG. These were then validated against 12,490 fire detections from the MODIS active fire product using logistic regression. Deviance of the logistic regression model was 408.8 for NDVI-FPI and 176.2 for VARI-FPI. The c-index was found to be 0.69 and 0.78, respectively. The results show that VARI-FP outperforms NDVI-FPI in distinguishing between fire and no-fire events for historical wildfire data in southern California for the given time period.

Schneider, P.↗
NASA NTRSDate not supplied

Predictions of the Azimuthal Variation of the Noise from Chevron Jets using an Acoustic Analogy

An existing acoustic analogy formulation is used to make predictions of the turbulent mixing noise from a series of chevron jets tested at NASA Glenn Research Center. Reynolds-averaged Navier-Stokes solutions are used as input to provide the mean flow and turbulence quantities needed to compute the Green’s function and parameterize the source model. The Green’s function for the non-axisymmetric mean flows generated by these nozzles is computed using a second-order finite volume method. A slightly modified version of an existing source model originally developed for round jets is used to assess its capability in these non-axisymmetric flows. Prediction results are compared with experimental data for a range of azimuthal orders of the nozzle geometry and flow speeds. The results show that the RANS-based acoustic analogy prediction method is able to capture the observed azimuthal variation of the sound field fairly well at relatively low jet exit velocities. At higher speeds, the prediction method still captures the observed trends in azimuthal directivity but not the absolute levels, particularly at higher frequencies. Areas for potential improvement of the method are suggested.

Jet Noise↗
NASA NTRSDate not supplied

Predictions of the Azimuthal Variation of the Noise from Chevron Jets using an Acoustic Analogy

An existing acoustic analogy formulation is used to make predictions of the turbulent mixing noise from a series of chevron jets tested at NASA Glenn Research Center. Reynolds-averaged Navier-Stokes solutions are used as input to provide the mean flow and turbulence quantities needed to compute the Green’s function and parameterize the source model. The Green’s function for the non-axisymmetric mean flows generated by these nozzles is computed using a second-order finite volume method. A slightly modified version of an existing source model originally developed for round jets is used to assess its capability in these non-axisymmetric flows. Prediction results are compared with experimental data for a range of azimuthal orders of the nozzle geometry and flow speeds. The results show that the RANS-based acoustic analogy prediction method is able to capture the observed azimuthal variation of the sound field fairly well at relatively low jet exit velocities. At higher speeds, the prediction method still captures the observed trends in azimuthal directivity but not the absolute levels, particularly at higher frequencies. Areas for potential improvement of the method are suggested.

Jet Noise↗
DOE OSTI2024

Decision Points and Practical Considerations for AI Projects

In this presentation, I will present business-relevant decisions, risks, and considerations for practical implementations of AI projects. I will use energy efficiency and renewable energy AI projects at NREL as examples and case-studies highlighting the journey from concept to implementation. First, I present challenges, questions, and trade-offs related to system inputs: the data. Next, I will examine issues with system behavior and trust, presenting examples, risks, and mitigation strategies. Finally, I will discuss challenges to effective widespread deployment of AI systems including energy, compute, and time requirements.

AI↗
NASA NTRS1977

Recent developments in the Green's function method

A recent computational development on the Green's function method (the method used in the computer program SOUSSA: Steady, Oscillatory and Unsteady Subsonic and Supersonic Aerodynamics) is presented. A scheme consisting of combined numerical (Gaussian quadrature) and analytical procedures for the evaluation of the source and doublet integrals used in the program is presented. This combination results in 80 to 90% reduction in computer time.

Tseng, K.↗
DOE OSTI2026

Measuring the Energy Consumption and Efficiency of Deep Neural Networks: An Empirical Analysis and Design Recommendations

Addressing the "Red-AI" trend of rising energy consumption by large-scale neural networks, this study investigates the measured energy consumption of training various fully connected neural network architectures. We introduce the BUTTER-E dataset, an augmentation to the BUTTER Empirical Deep Learning dataset, containing energy consumption and performance data from 41,129 individual experimental runs spanning 30,582 distinct configurations: 13 datasets, 20 sizes (trainable parameters), 8 "shapes", and 14 depths on both CPUs and GPUs using node-level watt-meters. This dataset reveals the complex relationship between dataset size, network structure, and energy use. Our analysis uncovers a surprising, hardware-mediated non-linear relationship between energy efficiency and network design, challenging the assumption that reducing the number of parameters or FLOPs is the best way to achieve greater energy efficiency. We propose a straightforward and effective energy model that accounts for network size, computing, and memory hierarchy. Highlighting the need for cache-considerate algorithm development, we suggest a codesign approach to energy efficient network, algorithm, and hardware design. This work contributes to the fields of sustainable computing and Green AI, offering practical guidance for creating more energy-efficient neural networks and promoting sustainable AI.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS1982

Perturbation corrections to Koopmans' theorem. V - A study with large basis sets

The vertical ionization potentials of N2, F2 and H2O were calculated by perturbation corrections to Koopmans' theorem using six different basis sets. The largest set used includes several sets of polarization functions. Comparison is made with measured values and with results of computations using Green's functions.

Chong, D. P.↗
NASA NTRS1996

A Computer Program for the Computation of Running Gear Temperatures Using Green's Function

A new technique has been developed to study two dimensional heat transfer problems in gears. This technique consists of transforming the heat equation into a line integral equation with the use of Green's theorem. The equation is then expressed in terms of eigenfunctions that satisfy the Helmholtz equation, and their corresponding eigenvalues for an arbitrarily shaped region of interest. The eigenfunction are obtalned by solving an intergral equation. Once the eigenfunctions are found, the temperature is expanded in terms of the eigenfunctions with unknown time dependent coefficients that can be solved by using Runge Kutta methods. The time integration is extremely efficient. Therefore, any changes in the time dependent coefficients or source terms in the boundary conditions do not impose a great computational burden on the user. The method is demonstrated by applying it to a sample gear tooth. Temperature histories at representative surface locatons are given.

GREENS FUNCTIONS↗
DOE OSTI2025

A Green’s function fast multipole method for computation of micromechanical fields in heterogeneous materials

Computation of micromechanical fields in heterogeneous materials is usually performed using either the finite element method or the Green’s function method based on FFTs. The finite element method allows for accurate discretization and for non-periodic boundary conditions but is computationally expensive. On the other hand, the FFT-based method is computationally efficient but requires discretization on a regular grid of hexahedral voxels. In this paper, a Green’s function method allowing for accurate discretization using tetrahedral elements and for non-periodic boundary conditions is proposed. The convolution is computed using the fast multipole method, which provides good accuracy even for low-order expansion due to the fast decay of interactions between elements. The proposed Green’s function fast multipole method is verified by comparison with analytical and FFT-based solutions. Furthermore, the computational time is analyzed and compared to the FFT-based method for non-periodic convolution. Finally, effective properties of an elastic polycrystalline microstructure containing thin intergranular cracks are computed and analyzed.

36 MATERIALS SCIENCE↗
NASA NTRS1987

Simulated annealing in networks for computing possible arrangements for red and green cones

Attention is given to network models in which each of the cones of the retina is given a provisional color at random, and then the cones are allowed to determine the colors of their neighbors through an iterative process. A symmetric-structure spin-glass model has allowed arrays to be generated from completely random arrangements of red and green to arrays with approximately as much disorder as the parafoveal cones. Simulated annealing has also been added to the process in an attempt to generate color arrangements with greater regularity and hence more revealing moirepatterns than than the arrangements yielded by quenched spin-glass processes. Attention is given to the perceptual implications of these results.

Ahumada, Albert J., Jr.↗
DOE OSTI2026

Molecular dynamics simulation of hydrodynamic transport coefficients in plasmas

Molecular dynamics simulations are used to calculate transport coefficients in a two-component plasma interacting through a repulsive Coulomb potential. The thermal conductivity, electrical conductivity, electrothermal coefficient, thermoelectric coefficient, and shear viscosity are computed using the Green–Kubo formalism over a broad range of Coulomb coupling strength, 0.01 ≤ Γ ≤ 140. Emphasis is placed on testing standard results of the Chapman–Enskog solution in the weakly coupled regime (Γ ≪ 1) using these first-principles simulations. As expected, the results show good agreement for Γ ≲ 0.1. However, this agreement is only possible if careful attention is paid to the definitions of linear constitutive relations in each of the theoretical models, a point that is often overlooked. For example, the standard Green–Kubo expression for thermal conductivity is a linear combination of thermal conductivity, electrothermal, and thermoelectric coefficients computed in the Chapman–Enskog formalism. Meaningful results for electrical conductivity are obtained over the full range of coupling strengths explored, but it is shown that potential and virial components of the other transport coefficients diverge in the strongly coupled regime (Γ ≫ 1). In this regime, only the kinetic components of the transport coefficients are meaningful for a classical plasma.

Electrical conductivity↗
DOE OSTI2024

Computational Advances in Ionic Liquid Applications for Green Chemistry: A Critical Review of Lignin Processing and Machine Learning Approaches

The valorization and dissolution of lignin using ionic liquids (ILs) is critical for developing sustainable biorefineries and a circular bioeconomy. This review aims to critically assess the current state of computational and machine learning methods for understanding and optimizing IL-based lignin dissolution and valorization processes reported since 2022. The paper examines various computational approaches, from quantum chemistry to machine learning, highlighting their strengths, limitations, and recent advances in predicting and optimizing lignin-IL interactions. Key themes include the challenges in accurately modeling lignin’s complex structure, the development of efficient screening methodologies for ionic liquids to enhance lignin dissolution and valorization processes, and the integration of machine learning with quantum calculations. These computational advances will drive progress in IL-based lignin valorization by providing deeper molecular-level insights and facilitating the rapid screening of novel IL-lignin systems.

09 BIOMASS FUELS↗
NASA NTRS1978

Information extraction from digital images of the earth and the planets

An overview is presented of recent developments at the JPL Image Processing Laboratory which emphasize the utilization of a digital computer to automate the process of information extraction from digital imagery. Consideration is given to: (1) the analysis of Viking Orbiter stereo imagery to determine elevation profiles of the Mars surface, (2) the use of Viking Lander stereo imagery to determine nonhazardous surface sample acquisition strategies, (3) the correlation of Landsat imagery with geographically referenced cultural data to determine land use trends, and (4) the generation of mosaics using digital computer techniques.

Green, W. B.↗
NASA NTRS1989

A 3D visualization system for molecular structures

The properties of molecules derive in part from their structures. Because of the importance of understanding molecular structures various methodologies, ranging from first principles to empirical technique, were developed for computing the structure of molecules. For large molecules such as polymer model compounds, the structural information is difficult to comprehend by examining tabulated data. Therefore, a molecular graphics display system, called MOLDS, was developed to help interpret the data. MOLDS is a menu-driven program developed to run on the LADC SNS computer systems. This program can read a data file generated by the modeling programs or data can be entered using the keyboard. MOLDS has the following capabilities: draws the 3-D representation of a molecule using stick, ball and ball, or space filled model from Cartesian coordinates, draws different perspective views of the molecule; rotates the molecule on the X, Y, Z axis or about some arbitrary line in space, zooms in on a small area of the molecule in order to obtain a better view of a specific region; and makes hard copy representation of molecules on a graphic printer. In addition, MOLDS can be easily updated and readily adapted to run on most computer systems.

Green, Terry J.↗