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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 325 records · Page 18
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

HPC-Driven Modeling with ML-Based Surrogates for Magnon-Photon Dynamics in Hybrid Quantum System

Here, we introduce a hybrid computational framework that merges HPC-based numerical solvers with physics-informed ML surrogates for efficient modeling of magnon-photon interactions. By running short-duration, high-fidelity Maxwell-LLG simulations and feeding their results into an ML model, we substantially cut simulation time while achieving accurate predictions across larger spatiotemporal domains.

Accuracy↗
DOE OSTI2024

Optimization and Multimachine Learning Algorithms to Predict Nanometal Surface Area Transfer Parameters for Gold and Silver Nanoparticles

Interactions between gold metallic nanoparticles and molecular dyes have been well described by the nanometal surface energy transfer (NSET) mechanism. However, the expansion and testing of this model for nanoparticles of different metal composition is needed to develop a greater variety of nanosensors for medical and commercial applications. In this study, the NSET formula was slightly modified in the size-dependent dampening constant and skin depth terms to allow for modeling of different metals as well as testing the quenching effects created by variously sized gold, silver, copper, and platinum nanoparticles. Overall, the metal nanoparticles followed more closely the NSET prediction than for Förster resonance energy transfer, though scattering effects began to occur at 20 nm in the nanoparticle diameter. To further improve the NSET theoretical equation, an attempt was made to set a best-fit line of the NSET theoretical equation curve onto the Au and Ag data points. An exhaustive grid search optimizer was applied in the ranges for two variables, 0.1≤C≤2.0 and 0≤α≤4, representing the metal dampening constant and the orientation of donor to the metal surface, respectively. Three different grid searches, starting from coarse (entire range) to finer (narrower range), resulted in more than one million total calculations with values C=2.0 and α=0.0736. The results improved the calculation, but further analysis needed to be conducted in order to find any additional missing physics. With that motivation, two artificial intelligence/machine learning (AI/ML) algorithms, multilayer perception and least absolute shrinkage and selection operator regression, gave a correlation coefficient, R2, greater than 0.97, indicating that the small dataset was not overfitting and was method-independent. This analysis indicates that an investigation is warranted to focus on deeper physics informed machine learning for the NSET equations.

Demers, Steven M. E. (ORCID:0000000192213246)↗
DOE OSTI2025

Two-Scale Neural Networks for Partial Differential Equations with Small Parameters

We propose a two-scale neural network method for solving partial differential equations (PDEs) with small parameters using physics-informed neural networks (PINNs). We directly incorporate the small parameters into the architecture of neural networks. The proposed method enables solving PDEs with small parameters in a simple fashion, without adding Fourier features or other computationally taxing searches of truncation parameters. Various numerical examples demonstrate reasonable accuracy in capturing features of large derivatives in the solutions caused by small parameters.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2026

Opportunities in AI/ML for the Rubin LSST Dark Energy Science Collaboration

The Vera C. Rubin Observatory's Legacy Survey of Space and Time (LSST) will produce unprecedented volumes of heterogeneous astronomical data (images, catalogs, and alerts) that challenge traditional analysis pipelines. The LSST Dark Energy Science Collaboration (DESC) aims to derive robust constraints on dark energy and dark matter from these data, requiring methods that are statistically powerful, scalable, and operationally reliable. Artificial intelligence and machine learning (AI/ML) are already embedded across DESC science workflows, from photometric redshifts and transient classification to weak lensing inference and cosmological simulations. Yet their utility for precision cosmology hinges on trustworthy uncertainty quantification, robustness to covariate shift and model misspecification, and reproducible integration within scientific pipelines. This white paper surveys the current landscape of AI/ML across DESC's primary cosmological probes and cross-cutting analyses, revealing that the same core methodologies and fundamental challenges recur across disparate science cases. Since progress on these cross-cutting challenges would benefit multiple probes simultaneously, we identify key methodological research priorities, including Bayesian inference at scale, physics-informed methods, validation frameworks, and active learning for discovery. With an eye on emerging techniques, we also explore the potential of the latest foundation model methodologies and LLM-driven agentic AI systems to reshape DESC workflows, provided their deployment is coupled with rigorous evaluation and governance. Finally, we discuss critical software, computing, data infrastructure, and human capital requirements for the successful deployment of these new methodologies, and consider associated risks and opportunities for broader coordination with external actors.

Aubourg, Eric [APC, Paris] (ORCID:000000025592023X↗
DOE OSTI2024

Optimizing Batch Crystallization with Model-based Design of Experiments

Adaptive and self-optimizing intelligent systems such as digital twins are increasingly important in science and engineering. Digital twins utilize mathematical models to provide added precision to decision-making. However, physics-informed models are challenging to build, calibrate, and validate with existing data science methods. Model-based design of experiments (MBDoE) is a popular framework for optimizing data collection to maximize parameter precision in mathematical models and digital twins. In this work, we apply MBDoE, facilitated by the open-source package Pyomo.DoE, to train and validate mathematical models for batch crystallization. We quantitatively examined the estimability of the model parameters for experiments with different cooling rates. This analysis provides a quantitative explanation for the heuristic of using multiple experiments at different cooling rates.

Lynch, Hailey↗
NASA NTRS1979

Use of Landsat and environmental satellite data in evapotranspiration estimation from a wildland area

A remote sensing-aided procedure was applied to the watershed-wide estimation of water loss to the atmosphere (evapotranspiration, ET). The approach involved a spatially referenced databank based on both remotely sensed and ground-acquired information. Physical models for both estimation of ET and quantification of input parameters are specified, and results of the investigation are outlined.

Khorram, S.↗
NASA NTRS1984

The high-ionization and excited-state interstellar lines in the Carina Nebula - A giant H II region in absorption

The dominant component of the highly ionized and excited-state interstellar species seen in the ultraviolet toward stars within the Carina Nebula has been found to have a heliocentric radial velocity of about -30 km/s. This velocity is known to correspond to the near edge of the expanding H II region, as shown by the double optical nebular emission lines and the single He I lambda 3889 nebular absorption line. It is also seen as a (nondominant) component in both the optical and ultraviolet low-ionization interstellar lines, discussed previously. Hence, the Carina Nebula provides a clear case in which the principal high-ionization interstellar features are associated with the hot stars against which they are observed; and a considerable range of absorption lines can provide physical information about the H II region. Also, the weaker zero-velocity, line-of-sight component in the high-ionization species can be measured in this direction relatively free from confusion by the material associated with the stars. There is, in addition, a pervasive high-ionization feature with a velocity of -90 km/s in this region, which has the relatively large value of N(C IV)/N(Si IV) = 4.5.

Walborn, N. R.↗
NASA NTRS1986

Contributions to the understanding of large-scale coherent structures in developing free turbulent shear flows

Advances in the mechanics of boundary layer flow are reported. The physical problems of large scale coherent structures in real, developing free turbulent shear flows, from the nonlinear aspects of hydrodynamic stability are addressed. The presence of fine grained turbulence in the problem, and its absence, lacks a small parameter. The problem is presented on the basis of conservation principles, which are the dynamics of the problem directed towards extracting the most physical information, however, it is emphasized that it must also involve approximations.

Liu, J. T. C.↗
NASA NTRS1990

A catalogue of low-resolution IUE spectra of dwarf novae and nova-like stars

A catalogue is presented of all the low-resolution IUE spectra of dwarf novae and nova-like stars that were recorded until the end of 1987. All spectra have been reduced, and are displayed, in a homogeneous way. In addition to details about these data, to the extent available, their position in the outburst light curves is given, physical information about each system, and a comprehensive list of references for published observations in all wavelength ranges.

La Dous, Constanze↗
NASA NTRS1993

A new survey of nebulae around Galactic Wolf-Rayet stars in the northern sky

Interference filter CCD images have been obtained in H-alpha and forbidden O III 5007 A for 62 Wolf-Rayet (W-R) stars, representing a complete survey of nebulae around Galactic W-R stars in the northern sky. We find probable new ring nebulae around W-R stars number 113, 116 and 132, and possible new ring nebulae around W-R stars number 133 and 153. All survey images showing nebulosities around W-R stars are presented in this paper. New physical information is derived from the improved images of known ring nebulae. The absence of ring nebulae around most W-R stars is discussed.

Miller, Grant J.↗
NASA NTRS1994

Implications of high-spatial-resolution thermal infrared (Termoskan) data for Mars landing site selection

Thermal infrared observations of Mars from spacecraft provide physical information about the upper thermal skin depth of the surface, which is on the order of a few centimeters in depth and thus very significant for lander site selection. The Termoskan instrument onboard the Soviet Phobos '88 spacecraft acquired the highest spatial-resolution thermal infrared data obtained for Mars, ranging in resolution from 300 m to 3 km per pixel. It simultaneously obtained broadband reflected solar flux data. Although the 6 deg N - 30 deg S Termoskan coverage only slightly overlaps the nominal Mars Pathfinder target range, the implications of Termoskan data for that overlap region and the extrapolations that can be made to other regions give important clues for optimal landing site selection.

Betts, Bruce H.↗
NASA NTRS1998

Emission Lines and the High Energy Continuum

Quasars show many striking relationships between line and continuum radiation whose origins remain a mystery. FeII, [OIII], Hbeta, and HeII emission line properties correlate with high energy continuum properties such as the relative strength of X-ray emission, and X-ray continuum slope. At the same time, the shape of the high energy continuum may vary with luminosity. An important tool for studying global properties of Quasi Stellar Objects (QSOs) is the co-addition of data for samples of QSOS. We use this to show that X-ray bright (XB) QSOs show stronger emission lines in general, but particularly from the narrow line region. The difference in the [OIII]/Hbeta ratio is particularly striking, and even more so when blended FeII emission is properly subtracted. Weaker narrow forbidden lines ([OII] and NeV) are enhanced by factors of 2 to 3 in both UV and optical XB composite spectra. The physical origin of these diverse and interrelated correlations has yet to be determined. Unfortunately, many physically informative trends intrinsic to QSOs may be masked by dispersion in the data due to either low signal-to-noise or variability. An important tool for studying global properties of QSOs is the co-addition of data for samples of QSOS. We use this to show that X-ray bright (XB) QSOs show stronger emission lines in general, but particularly from the narrow line region. The difference in the [OIII]/Hbeta ratio is particularly striking, and even more so when blended Fell emission is properly subtracted. Weaker narrow forbidden lines ([OII] and NeV) are enhanced by factors of 2 to 3 in both UV and optical XB composite spectra. We describe a large-scale effort now underway to probe these effects in large samples, using both data and analysis as homogeneous as possible. Using an HST FOS Atlas of QSO spectra, with primary comparison to ROSAT PSPC spectral constraints, we will model the Big Blue Bump, its relationship to luminosity and QSO type, and we will analyze and contrast line emission and UV/X-ray continuum properties. Absorption of the continuum near the broad emission line region may play a profound role, which we will be able to constrain by direct analysis of observed UV/X-ray spectral absorption.

Green, Paul↗
NASA NTRS1999

Reciprocal Space Mapping of Macromolecular Crystals in the Home Laboratory

Reciprocal space mapping techniques are used widely by the materials science community to provide physical information about their crystal samples. We have used similar methods at synchrotron sources to look at the quality of macromolecular crystals produced both on the ground and under microgravity conditions. The limited nature of synchrotron time has led us to explore the use of a high resolution materials research diffractometer to perform similar measurements in the home laboratory. Although the available intensity is much reduced due to the beam conditioning necessary for high reciprocal space resolution, lower resolution data can be collected in the same detail as the synchrotron source. Experiments can be optimized at home to make most benefit from the synchrotron time available. Preliminary results including information on the mosaicity and the internal strains from reciprocal space maps will be presented.

Snell, Edward H.↗
NASA NTRS1995

Profiles of Gamma-Ray Bursts and Their Component Pulses

One physically informative regularity of their otherwise heterogeneous ensemble, is that many Gamma-Ray Bursts consist of well defined pulses. To objectively quantify the temporal structure of BATSE bursts, we have developed an automatic modeling procedure that separates overlapping pulses and determines the energy-dependence of the pulse-shape parameters. No binning of photon arrival times is needed, so when applied to time-tagged events (TTE) the procedure captures variability information down to the shortest time scales present in the raw data. Maximizing the Bayesian likelihood function Pr(data/model) yields estimates of the model parameters, including the number of pulses present, and allows intercomparison of models of different forms. As with any nonlinear optimization, good initial guesses are crucial to avoid convergence to undesirable local minima. We find excellent initial pulse decompositions by wavelet-denoising a cumulative distribution of the raw photon arrival data; differentiation then gives a time profile mostly free of the systematic effects of degraded resolution (as in ordinary Fourier smoothing) and binning. We present statistical information on pulse rise-time, decay-time, peakedness, and amplitudes, plus their energy dependences - both within a single burst and for a large ensemble of bursts.

Scargle, Jeff D.↗
NASA NTRS1987

Hi-Tech for Archeology

Remote sensing is the process of acquiring physical information from a distance, obtaining data on Earth features from a satellite or an airplane. Advanced remote sensing instruments detect radiations not visible to the ordinary camera or the human eye in several bands of the spectrum. These data are computer processed to produce multispectral images that can provide enormous amounts of information about Earth objects or phenomena. Since every object on Earth emits or reflects radiation in its own unique signature, remote sensing data can be interpreted to tell the difference between one type of vegetation and another, between densely populated urban areas and lightly populated farmland, between clear and polluted water or in the archeological application between rain forest and hidden man made structures.

Source record↗
NASA NTRS2004

Putting Priors in Mixture Density Mercer Kernels

This paper presents a new methodology for automatic knowledge driven data mining based on the theory of Mercer Kernels, which are highly nonlinear symmetric positive definite mappings from the original image space to a very high, possibly infinite dimensional feature space. We describe a new method called Mixture Density Mercer Kernels to learn kernel function directly from data, rather than using predefined kernels. These data adaptive kernels can en- code prior knowledge in the kernel using a Bayesian formulation, thus allowing for physical information to be encoded in the model. We compare the results with existing algorithms on data from the Sloan Digital Sky Survey (SDSS). The code for these experiments has been generated with the AUTOBAYES tool, which automatically generates efficient and documented C/C++ code from abstract statistical model specifications. The core of the system is a schema library which contains template for learning and knowledge discovery algorithms like different versions of EM, or numeric optimization methods like conjugate gradient methods. The template instantiation is supported by symbolic- algebraic computations, which allows AUTOBAYES to find closed-form solutions and, where possible, to integrate them into the code. The results show that the Mixture Density Mercer-Kernel described here outperforms tree-based classification in distinguishing high-redshift galaxies from low- redshift galaxies by approximately 16% on test data, bagged trees by approximately 7%, and bagged trees built on a much larger sample of data by approximately 2%.

Srivastava, Ashok N.↗
NASA NTRS2004

To Boldly Go: America's Next Era in Space. Machine Consciousness and the Exploration of Space

Dr. France Cordova, NASA's Chief Scientist, chaired this meeting, another part of the NASA Administrator's Seminar Series. She introduced Administrator Daniel S. Goldin, who welcomed the attendees, and noted that the two speakers have a running feud regarding the possibility of creating robots that can 'think'. Dr. Cordova then introduced the first speaker, Dr. Roger Penrose of the Mathematical Institute at Oxford in the U.K. His primary interests are in mathematics, physics, information systems technology, and artificial intelligence. He thinks that robots cannot be made to 'think' and that consciousness is not computable. Dr. Hans Moravec, who spoke next, has opinions and activities that are related to, but substantially different from those of Dr. Penrose. Dr. Moravec believes that he can build a robot that can act based on the deductions that it will make. To mimic human thinking capabilities, he figures that a robot ultimately will need to be able to handle ten trillion computations per second. He predicts that his goal of building a 'thinking' robot will be met in the 2030-2040 time period. He pointed out that he already has built a car that successfully drove itself from Washington, DC to San Diego, CA. He commented that a human being, was ready to take over driving the car, if necessary, but there was no need. The robots envisioned by Dr. Moravec would not only be able to 'think', but also would have human-like emotions, and ultimately would be able to reproduce. The discussion that followed raised questions about the morality of sending human-like robots into outer space. Also a concern was expressed that human-like robots might perceive humans as a threat and become dangerous to people.

Source record↗
NASA NTRS2013

Memory Circuit Fault Simulator

Spacecraft are known to experience significant memory part-related failures and problems, both pre- and postlaunch. These memory parts include both static and dynamic memories (SRAM and DRAM). These failures manifest themselves in a variety of ways, such as pattern-sensitive failures, timingsensitive failures, etc. Because of the mission critical nature memory devices play in spacecraft architecture and operation, understanding their failure modes is vital to successful mission operation. To support this need, a generic simulation tool that can model different data patterns in conjunction with variable write and read conditions was developed. This tool is a mathematical and graphical way to embed pattern, electrical, and physical information to perform what-if analysis as part of a root cause failure analysis effort.

Sheldon, Douglas J.↗