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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 811 records · Page 45
All sourcesNASA NTRSDOE OSTI
NASA NTRS2011

Ab initio Computations of the Electronic, Mechanical, and Thermal Properties of Ultra High Temperature Ceramics (UHTC) ZrB2 and HfB2

Refractory materials such as metallic borides, often considered as ultra high temperature ceramics (UHTC), are characterized by high melting point, high hardness, and good chemical inertness. These materials have many applications which require high temperature materials that can operate with no or limited oxidation. Ab initio, first principles methods are the most accurate modeling approaches available and represent a parameter free description of the material based on the quantum mechanical equations. Using these methods, many of the intrinsic properties of these material can be obtained. We performed ab initio calculations based on density functional theory for the UHTC materials ZrB2 and HfB2. Computational results are presented for structural information (lattice constants, bond lengths, etc), electronic structure (bonding motifs, densities of states, band structure, etc), thermal quantities (phonon spectra, phonon densities of states, specific heat), as well as information about point defects such as vacancy and antisite formation energies.

Lawson, John W.↗
DOE OSTI2024

Hourly dynamic line ratings for existing transmission across the contiguous United States (preliminary results) [Slides]

The thermal rating of a transmission line depends on the rate at which heat generated by current flow through the line can be dissipated into the environment by convective and radiative cooling, keeping the conductor below a maximum operating temperature. Static or seasonal line ratings assume nearly-worst-case weather conditions (high ambient air temperature, high solar irradiance, and low wind speed), resulting in a low risk of "overrating" a line (i.e., allowing more current to flow than the line is designed for) but a high fraction of time when the line is "underrated" (i.e., able to flow more current while staying below the maximum temperature). Dynamic transmission line ratings (DLR) use real-time measurements of weather conditions, line sag, or line temperature to determine the thermal rating of transmission lines at hourly or higher time resolution, allowing for increased ratings during some (cold, windy, and/or dark) periods and correcting for overrating during other (hot, calm, and/or sunny) periods. Many studies have explored the benefits of DLR, but typically for small collections of transmission lines under a limited sample of weather conditions, leaving open the question of how widely applicable the benefits of DLR might be over diverse geographies and weather conditions. Here, we combine geospatial data on tens of thousands of transmission line routes across the contiguous United States with high-resolution hourly historical weather data for 2007-2013 to estimate the impact of DLR and other weather-adjusted rating systems. We compare static and dynamic line ratings to intermediate ratings adjusted by ambient temperature, day/night irradiance, clear-sky irradiance, and/or measured irradiance, illustrating the benefits of incorporating progressively more detailed weather data into the calculated line ratings. Moving from nighttime-adjusted ratings to clear-sky-adjusted ratings provides more benefit than moving from clear-sky-adjusted ratings to measured-irradiance-adjusted ratings. Depending on the assumed static windspeed for irradiance-adjusted-ratings, DLR either corrects for overrated hours or provides substantially increased ratings in the majority of hours on the majority of lines.

14 SOLAR ENERGY↗
NASA NTRS2005

How to Distinguish Neutron Star and Black Hole X-ray Binaries? Spectral Index and Quasi-Periodic Oscillation Frequency Correlation

Recent studies have revealed strong correlations between 1-10 Hz frequencies of quasiperiodic oscillations (QPOs) and the spectral power law index of several Black Hole (BH) candidate sources when seen in the low/hard state, the steep power-law (soft) state, and in transition between these states. In the soft state these index-QPO frequency correlations show a saturation of the photon index GAMMA approximately equal to 2.7 at high values of the low frequency nu(sub L). This saturation effect was previously identified as a black hole signature. In this paper we argue that this saturation does not occur, at least for one neutron star (NS) source 4U 1728-34, for which the index GAMMA monotonically increases with nu(sub L) to the values of 6 and higher. We base this conclusion on our analysis of approximately 1.5 Msec of RXTE archival data for 4U 1728-34. We reveal the spectral evolution of the Comptonized blackbody spectra when the source transitions from the hard to soft states. The hard state spectrum is a typical thermal Comptonization spectrum of the soft photons which originate in the disk and the NS outer photospheric layers. The hard state photon index is GAMMA approximately 2. The soft state spectrum consists of two blackbody components which are only slightly Comptonized. Thus we can claim (as expected from theory) that in NS sources thermal equilibrium is established for the soft state. To the contrary in BH sources, the equilibrium is never established due to the presence of the BH horizon. The emergent BH spectrum, even in the high/soft state, has a power law component. We also identify the low QPO frequency nu(sub L) as a fundamental frequency of the quasi-spherical component of the transition layer (presumably related to the corona and the NS and disk magnetic closed field lines). The lower frequency nu(sub SL) is identified as the frequency of oscillations of a quasi-cylindrical configuration of the TL (presumably related to the NS and disk magnetic open field lines). We also show that the presence of Fe K(sub alpha), emission-line strengths, QPOs, and the link between them does not depend on radio flux in 4U 1728-34.

Titarchuk, Lev↗
DOE OSTI2026

Physics vs structure: A systematic benchmark of learning strategies for multi-zone building thermal dynamics

Recent advances in physics-informed and data-driven machine learning promise improved thermal models for advanced building control, yet there is limited quantitative evidence on when added physics structure and architectural complexity are beneficial. Here, this work presents a systematic benchmark of five representative system identification methods for modeling multi-zone building thermal dynamics: linear state-space models, multi-layer perceptrons, neural state-space models, neural ordinary differential equations, and physically-consistent neural networks. The methods are evaluated across multiple data regimes and zone coupling strategies. Using a high-fidelity multi-zone commercial building emulator, we examine short-term and long-term prediction accuracy, computational efficiency, and ease of development. Our results reveal critical trade-offs between prediction performance, model complexity, and physical consistency. We demonstrate that decoupled, nonlinear black-box models consistently outperform coupled physics-constrained architectures in both predictive accuracy and out-of-distribution robustness in majority of the test cases for the building type considered in the study. Our findings quantify the cost of complexity in building thermal modeling and provide concrete, actionable, scenario-based guidelines for selecting model classes for control-oriented applications.

Building thermal modeling↗
DOE OSTI2026

First-principles simulation of a shocked H-He mixture along the principal Hugoniot

Recent laser-shock experiments on an H–He mixture containing 11% helium (atomic fraction) have suggested the presence of an immiscibility region inside Jupiter. Reflectivity measurements were used as the primary diagnostic of H–He demixing, with discontinuities in the optical reflectivity proposed as a signature of phase separation under conditions relevant to Jupiter's interior. Here, we investigate shock-compressed H–He using ab initio molecular dynamics simulations with optical properties evaluated within the Kubo–Greenwood formalism. The equation of state and ionic configurations were obtained using the thermal Tr 2 SCANL meta-GGA exchange–correlation (XC) functional, while optical properties were computed using the recently developed RS-KDT0 range-separated thermal hybrid XC, which provides state-of-the-art accuracy for band-gap predictions in the warm dense matter regime. The calculated reflectivity shows overall good agreement with experimental measurements; however, no discontinuity is observed at elevated temperatures. Moreover, the reflectivity predictions for the mixed system are consistent with the experimental measurements in the temperature range where the mixture is inferred to be demixed. Furthermore, these results suggest that reflectivity alone may not provide a unique or sensitive diagnostic of H–He demixing at low helium concentrations under these conditions.

Density functional calculations↗
NASA NTRS1981

Space propulsion systems. Present performance limits and application and development trends

Typical spaceflight programs and their propulsion requirements as a comparison for possible propulsion systems are summarized. Chemical propulsion systems, solar, nuclear, or even laser propelled rockets with electrical or direct thermal fuel acceleration, nonrockets with air breathing devices and solar cells are considered. The chemical launch vehicles have similar technical characteristics and transportation costs. A possible improvement of payload by using air breathing lower stages is discussed. The electrical energy supply installations which give performance limits of electrical propulsion and the electrostatic ion propulsion systems are described. The development possibilities of thermal, magnetic, and electrostatic rocket engines and the state of development of the nuclear thermal rocket and propulsion concepts are addressed.

Buehler, R. D.↗
NASA NTRS2005

Thermal Conductivity of Alumina-reinforced Zirconia Composites

10-mol% yttria-stabilized zirconia (10SZ) - alumina composites containing 0-30 mol% alumina were fabricated by hot pressing at 1500 C in vacuum. Thermal conductivity was determined at various temperatures using a steady-state laser heat flux technique. Thermal conductivity of the composites increased with increase in alumina content. Composites containing 0, 5, and 10-mol% alumina did not show any change in thermal conductivity with temperature. However, those containing 20 and 30-mol% alumina showed a decrease in thermal conductivity with increase in temperature. The measured values of thermal conductivity were in good agreement with those calculated from the Maxwell-Eucken model where one phase is uniformly dispersed within a second major continuous phase.

Bansal, Narottam P.↗
NASA NTRS1974

Helium in the Martian atmosphere - Thermal loss considerations

Helium concentrations in the Martian atmosphere are estimated assuming that the helium production on Mars (comparable to its production on earth) via the radioactive decay of uranium and thorium is in steady state equilibrium with its thermal escape. Although nonthermal losses would tend to reduce the estimated concentrations, these concentrations are not necessarily an upper limit since higher production rates and/or a possibly lower effective exospheric temperature over the solar activity cycle could increase them to even higher values. The computed helium concentration at the Martian exobase (200 km) is 8 million atoms/cu cm. Through the lower exosphere, the computed helium concentrations are 30-200 times greater than the Mariner-measured atomic hydrogen concentrations. It follows that helium may be the predominant constituent in the Martian lower exosphere and may well control the orbital lifetime of Mars-orbiting spacecraft.

Levine, J. S.↗
DOE OSTI2023

Thermalization of the Kerr index of refraction in acetone and methanol using femtosecond pump-probe scattering spectroscopy

Femtosecond time-resolved pump-probe scattering is used to temporally investigate the index thermalization Δn(t) of the molecular motions associated with the Kerr nonlinear index n 2 . This is done using an intense 300 fs 1034 nm pump pulse and temporally probed by a 517 nm and supercontinuum pulse in acetone and methanol. The optically pumped molecular states change the index of refraction and through the processes of Raman and Rayleigh scattering are shown to engage in a 4-step energy relaxation process. Here, the pump first initiates the Kerr effect as well as populate resonant vibrational molecular motions, which act as a “mother” energy state. The electronic component of the Kerr effect is shown to couple with these vibrational modes through the process of Born-Oppenheimer coupling, which can be measured through the Raman scattering of the probe. The “mother” coupled state then decays into “daughter” anharmonic non-resonant states, which then further decay into “granddaughter” and thermal bath states. The population of these states alter the index of refraction in time, Δn(t), and can be measured through the changing in the probe beam’s Rayleigh scattering. This thermalization process takes ~5.5 ps in acetone and ~3.7 ps in methanol. The scattering signals from each Δn(t) thermalization stage in the localized region, (“mother”, to “daughter”, to “granddaughter”, to the bath states, to the ground state), are fitted to theoretical decay equations that show the rise and fall times of the energy decay routes.

47 OTHER INSTRUMENTATION↗
NASA NTRS1980

Thermal evolution of Ganymede and Callisto - Effects of solid-state convection and constraints from Voyager imagery

The imaging experiments of the Voyager 1 and 2 fly-by missions have provided a large amount of information about the nature of the surfaces of the Galilean satellites. The present investigation is concerned with the development of models regarding the thermal evolution of Ganymede and Callisto, taking into account the approach of parameterized convection. Attention is given to the physical, chemical, and geological data which are available as constraints on the thermal evolution of Ganymede and Callisto. Both satellites appear to possess surfaces composed of silicates and ice. However, their surface features are distinctly different from each other. In the discussion of thermal evolution models, attention is given to ice-dominant rheology, silicate-dominant rheology, and aspects of phase changes and solid-state convection.

Thurber, C. H.↗
DOE OSTI2020

Contribution of cryogenic thermal cycling to the atomic dynamics in a La-based bulk metallic glass with different initial states

Structural rejuvenation in metallic glasses (MGs) induced by cryogenic thermal cycling has been intensively studied. However, the effect of thermal cycling on the atomic dynamics in MGs is still missing. In this work, we present a systematic study on the atomic dynamics in a La-based MG affected by sub-Tg annealing and thermal cycling. We find that the thermal cycling has little effect on the atomic dynamics in both as-cast and annealed MGs although it could significantly increase the free volume and change mechanical properties of the as-cast MG sample. In contrast, both the structure and mechanical properties of the well-relaxed sample are almost unchanged by thermal cycling. Further, the increased open volume, mainly in the form of atomic vacancies, does not greatly promote the atomic dynamics in the as-cast MG sample, indicating that the free volume induced by thermal cycling is not the key factor in stimulating the β-relaxation and the boson peak in the studied MG.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Distinct Surface and Bulk Thermal Behaviors of LiNi 0.6 Mn 0.2 Co 0.2 O 2 Cathode Materials as a Function of State of Charge

Understanding how structural and chemical transformations take place in particles under thermal conditions can inform designing thermally robust electrode materials. Such a study necessitates the use of diagnostic techniques that are capable of probing the transformations at multiple length scales and at different states of charge (SOC). In this study, the thermal behavior ofLiNi 0.6 Mn 0.2 Co 0.2 O 2 (NMC-622) was examined as a function of SOC, using an array of bulk and surface-sensitive techniques. In general, thermal stability decreases as lithium content is lowered and conversion in the bulk to progressively reduced metal oxides (spinels, rock salt) occurs as the temperature is raised. Hard X-ray absorption spectroscopy (XAS) and X-ray Raman spectroscopy (XRS) experiments, which probe the bulk, reveal that Ni and Co are eventually reduced when partially delithiated samples (regardless of the SOC) are heated, although Mn is not. Surface-sensitive synchrotron techniques, such as soft XAS and transmission X-ray microscopy (TXM), however, reveal that for 50% delithiated samples, apparent oxidation of nickel occurs at particle surfaces under some circumstances. This is partially compensated by reduction of cobalt but may also be a consequence of redistribution of lithium ions upon heating. TXM results indicate the movement of reduced nickel ions into particle interiors or oxidized nickel ions to the surface or both. These experiments illustrate the complexity of the thermal behavior of NMC cathode materials. The study also informs the importance of investigating the surface and bulk difference as a function of SOC when studying the thermal behaviors of battery materials.

25 ENERGY STORAGE↗
NASA NTRS1979

On the effects of higher convection modes on the thermal evolution of small planetary bodies

The effects of higher modes of convection on the thermal evolution of a small planetary body is investigated. Three sets of models are designed to specify an initially cold and differentiated, an initially hot and differentiated, and an initially cold and undifferentiated Moon-type body. The strong temperature dependence of viscosity enhances the thickening of lithosphere so that a lithosphere of about 400 km thickness is developed within the first billion years of the evolution of a Moon-type body. The thermally isolating effect of such a lithosphere hampers the heat flux out of the body and increases the temperature of the interior, causing the solid-state convection to occur with high velocity so that even the lower modes of convection can maintain an adiabatic temperature gradient there. It is demonstrated that the effect of solid-state convection on the thermal evolution of the models may be adequately determined by a combination of convection modes up to the third or the fourth order harmonic. The inclusion of higher modes does not affect the results significantly.

Arkani-Hamed, J.↗
DOE OSTI2023

Bio-Based Phase Change Materials (PCMs) for Thermal Energy Storage (Final Scientific/Technical Report)

The goal of this project is to develop a novel bio-based phase change material (PCM) derived from squid ring teeth (SRT) proteins, and design a prototype heat exchanger based on these bio-based PCMs for energy storage and dynamic heat exchange for building thermal energy storage systems. The PCMs, derived from SRT proteins, will demonstrate room temperature energy storage capacities and switchable thermal conductivities that redefine the current state-of-the-art (SOA) for building thermal energy storage. Further, in a single material and with a single manufacturing processes, our proposed thermal battery will be developed with “on demand” thermal conductivity for rapid charging/discharging but superior insulation during energy storage periods. More specifically, our bio-based PCMs have demonstrated: 1) the potential for increased energy storage capacity (i.e., greater than paraffines at room temperature); 2) tunability in thermal conductivity with the largest thermal conductivity switching ratios for an intrinsic material reported to date, and 3) a 100% recyclable and biodegradable PCM with low volatility and toxicity and scalability in its manufacture for both residential and commercial applications. The already established ability for roll-to-roll processing of these non-toxic, non-flammable SRT composites along with their carbon-neutral manufacturing processes that has been pioneered by our team make this solution a disruptive and impactful technology to redefine the current SOA of energy storage technologies. The outcomes of this effort have been: 1) the identification of new bio-based PCM that establishes a new SOA for thermal conductivity and energy storage density at room temperature and 2) the development of a new experimental technique to measure the energy storage density via latent heat measurements during melting of thin films. This new technique can be applied to thin films (as thin as < 1 micrometer), and represents a novel approach for thin film energy storage density measurements. Dynamic thermal energy storage is the missing technology that will enable a grid- interactive efficient building (GEB). For a “smart” building capable of connecting with the power grid, the media must be inexpensive and possess thermal switching capabilities to control the time-dependent heat flow into (and out of) the PCM on demand. Unique to the material system in this program, programmable SRT-based PCM show improvements as compared to traditionally used PCMs, and thus its technical performance will represent a leap forward for the future GEB concept.

25 ENERGY STORAGE↗
NASA NTRS1975

A comparison of the temperature and density structure in high and low speed thermal proton flows

Steady-state altitude profiles of H(+) density, drift velocity, and temperature and O(+) density and temperature were deduced for a wide range of H(+) outflow velocities from subsonic to supersonic flow for plasma densities typical of both undisturbed and trough regions of the ionsophere. Allowance was made for the effects of inertia, parallel stress, and the velocity dependence of the H(+) collision frequencies. It was found that at supersonic outflow velocities there is a decrease in H(+) temperature with increasing outflow velocity. The H(+) temperatures are substantially increased above the O(+) temperatures when H(+) is flowing, with T(H+)/T(O+) reaching a maximum ratio of about 3:1.

Raitt, W. J.↗
NASA NTRS2011

X-Ray Spectra from MHD Simulations of Accreting Black Holes

We present new global calculations of X-ray spectra from fully relativistic magneto-hydrodynamic (MHO) simulations of black hole (BH) accretion disks. With a self consistent radiative transfer code including Compton scattering and returning radiation, we can reproduce the predominant spectral features seen in decades of X-ray observations of stellar-mass BHs: a broad thermal peak around 1 keV, power-law continuum up to >100 keV, and a relativistically broadened iron fluorescent line. By varying the mass accretion rate, different spectral states naturally emerge: thermal-dominant, steep power-law, and low/hard. In addition to the spectral features, we briefly discuss applications to X-ray timing and polarization.

Schnittman, Jeremy D.↗
NASA NTRS2022

Surface Biology and Geology (SBG) Thermal Infrared (TIR) Free -Flyer Concept

Scientists and engineers from the United States and Italy are developing a thermal infrared (TIR) free-flyer concept that forms an essential element of the NASA Surface Biology & Geology (SBG) designated observable and the greater NASA Earth System Observatory (ESO), which also includes observations of aerosols, clouds, convection, and precipitation; mass change; and surface deformation & change.In response to the recommendations from the 2017 National Academies decadal survey for Earth science, NASA initiated the SBG designated observable with five key research and applications focus areas: ecosystems and natural resources, hydrology, weather, climate, and solid Earth. SBG includes spaceborne measurements of hyperspectral imagery in the visible to shortwave infrared (0.4-2.5 um) and multispectral imagery in the mid and thermal infrared (3-12 um) that provide the remote sensing data needed to inform each research and applications area. High-level TIR data products include Earth surface temperature & emissivity, evapotranspiration, substrate composition, volcanic plumes, and high-temperature features. While the science, applications, and technology build on prior mission studies conducted for more than a decade, it has only been recently that a joint team of scientists and engineers from the NASA Jet Propulsion Laboratory (JPL), Agenzia Spaziale Italiana (ASI), Istituto Nazionale Geofisica e Volcanologia (INGV), and the Istituto Nazionale Astrofisica (INAF) have developed a compelling concept for a TIR free-flyer. In this concept, the TIR instrument is an eight-band radiometer. Seven of the bands are between 3 and 12 um with an additional band at 1.65 um. The instrument’s 68.8 deg total viewing angle and the free-flyer’s 665 km operational altitude results in a ground sampling distance (GSD) of <60 m at nadir, produces a swath width of 935 km, and allows for a 2-3-day revisit time. A two-band visible and near infrared (VNIR) camera, with <30 m GSD at nadir and 935 km swath width, will complement the TIR instrument. VNIR high-level data products include top & bottom of atmosphere reflectance and normalized difference vegetation indices (NDVI). The TIR instrument and VNIR camera will be mounted on a PLATiNO+ spacecraft, a multi-application, reconfigurable, and scalable platform. The launcher selected for the TIR free-flyer is the VEGA-C. To maximize the science and applications benefits the SBG-TIR free-flyer team are collaborating with personnel from the ESA Land Surface Temperature Monitoring mission (LSTM) as well individuals from the Thermal Infrared Imaging Satellite for High-resolution Natural resource Assessment (TRISHNA), a joint mission by CNES and ISRO. Pre-Phase A concept studies for the SBG-TIR free-flyer commenced in the spring 2021. This allows for the concept to be refined; for technical risks to be identified and mitigated, as necessary; and strategies for reducing the development schedule to be defined and assessed before conducting a NASA-ASI Mission Concept Review (MCR) in the spring of 2022 and a NASA Key Decision Point-A (KDP-A) as early as the summer of 2022. These are key milestones in being able to launch and begin operating the SBG-TIR free-flyer in the second half of the decade, so that many of the questions posed by the National Academies in the 2017 decadal survey can be answered.

Fabrizia-Buongiorno, Maria↗
NASA NTRS1986

A study on thermal barrier coatings including thermal expansion mismatch and bond coat oxidation

The present investigation deals with a plasma-sprayed thermal barrier coating (TBC) intended for high temperature applications to advanced gas turbine blades. Typically, this type of coating system consists of a zirconia-yttria ceramic layer with a nickel-chromium-aluminum bond coat on a superalloy substrate. The problem on hand is a complex one due to the fact that bond coat oxidation and thermal mismatch occur in the TBC. Cracking in the TBC has also been experimentally illustrated. A clearer understanding of the mechanical behavior of the TBC is investigated. The stress states in a model thermal barrier coating as it cools down in air is studied. The powerful finite element method was utilized to model a coating cylindrical specimen. Four successively refined finite element models were developed. Some results obtained using the first two models have been reported previously. The major accomplishment is the successful development of an elastic TBC finite element model known as TBCG with interface geometry between the ceramic layer and the bond coat. An equally important milestone is the near-completion of the new elastic-plastic TBC finite element model called TBCGEP which yielded initial results. Representative results are presented.

Chang, George C.↗