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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 OSTI2021

A Tracer Study on sCO2 Corrosion with Multiple Oxygen-Bearing Impurities

Abstract Several modern power production systems utilize supercritical CO 2 (sCO 2 ), which can contain O 2 and H 2 O as impurities. These impurities may degrade the compatibility of structural alloys through accelerated oxidation. However, it remains unclear which of these impurities plays a bigger role in high-temperature reactions taking place in sCO 2 . In this study, various model and commercial Fe‐ and Ni‐based alloys were exposed in 300 bar sCO 2 at 750 °C to low levels (50 ppm) of O 2 and H 2 O for 1,000 h. 18 O-enriched water was used to enable the identification of the oxygen source in the post-exposure characterization of the samples. However, oxygen from the water did not accumulate in the scale, which consisted of Cr 2 O 3 in the cases where a protective oxide formed. A 2wt.% Ti addition to a Ni-22%Cr model alloy resulted in the formation of thicker oxides in sCO 2 , while a 1wt.% Al addition reduced the scale thickness. A synergistic effect of both Al and Ti additions resulted in an even thicker oxide than what was formed solely by Ti, similar to observations for Ni-based alloy 282.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

I ntera C hem : Exploring Excited States in Virtual Reality with Ab Initio Interactive Molecular Dynamics

InteraChem is an ab initio interactive molecular dynamics (AI-IMD) visualizer that leverages recent advances in virtual reality hardware and software, as well as the graphical processing unit (GPU)-accelerated TeraChem electronic structure package, in order to render quantum chemistry in real time. We introduce the exploration of electronically excited states via AI-IMD using the floating occupation molecular orbital-complete active space configuration interaction method. The optimization tools in InteraChem enable identification of excited state minima as well as minimum energy conical intersections for further characterization of excited state chemistry in small- to medium-sized systems. We demonstrate that finite-temperature Hartree–Fock theory is an efficient method to perform ground state AI-IMD. InteraChem allows users to track electronic properties such as molecular orbitals and bond order in real time, resulting in an interactive visualization tool that aids in the interpretation of excited state chemistry data and makes quantum chemistry more accessible for both research and educational purposes.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Machine learning dielectric screening for the simulation of excited state properties of molecules and materials

Accurate and efficient calculations of absorption spectra of molecules and materials are essential for the understanding and rational design of broad classes of systems. Solving the Bethe–Salpeter equation (BSE) for electron–hole pairs usually yields accurate predictions of absorption spectra, but it is computationally expensive, especially if thermal averages of spectra computed for multiple configurations are required. We present a method based on machine learning to evaluate a key quantity entering the definition of absorption spectra: the dielectric screening. We show that our approach yields a model for the screening that is transferable between multiple configurations sampled during first principles molecular dynamics simulations; hence it leads to a substantial improvement in the efficiency of calculations of finite temperature spectra. We obtained computational gains of one to two orders of magnitude for systems with 50 to 500 atoms, including liquids, solids, nanostructures, and solid/liquid interfaces. Importantly, the models of dielectric screening derived here may be used not only in the solution of the BSE but also in developing functionals for time-dependent density functional theory (TDDFT) calculations of homogeneous and heterogeneous systems. Overall, our work provides a strategy to combine machine learning with electronic structure calculations to accelerate first principles simulations of excited-state properties.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Implosion dynamics of triple-nozzle gas-puff z pinches on COBRA

Experiments on the 1-MA, 220-ns COBRA generator at Cornell University were conducted to provide detailed measurements of structured cylindrical gas-puff z pinches. In the experiments, a 7 cm diameter triple-nozzle gas valve assembly with concentric outer and inner annular nozzles and a central gas jet initialize the z-pinch load with various working gases, radial density profiles, and externally applied axial magnetic fields. Planar laser-induced fluorescence provides a measure of the initial neutral gas density of the load, while three-frame laser shearing interferometry and multi-frame extreme ultraviolet (XUV) cameras reveal the formation and propagation of a magneto-Rayleigh–Taylor (MRT) unstable shock layer. Implosion trajectories are compared to simple, experimentally informed models and found to be in good agreement. Differences in the structure of the accelerating plasma sheath and evolution of the MRT instability are observed for different gas species and axial magnetic field strengths, correlating with differences in pinch uniformity and x-ray emission. Here, the average instability growth is compared to linear MRT theory predictions using the instantaneous acceleration of the best-fit implosion models and characteristic instability wavelength, with the effective Atwood number and seed perturbation size as fit parameters. For high density argon center jets, ionization prior to the arrival of the imploding plasma sheath suggests a heating mechanism consistent with photoionization by XUV self-emission.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2026

Elevated-Temperature Tribo-Corrosion Response of Eutectic High-Entropy Alloy

The combination of elevated temperature and tribo-corrosion leads to the accelerated degradation of structural components used in many extreme environments. Recently developed high-entropy alloys (HEAs) with multiple principal elements have the potential for superior degradation resistance compared with presently used structural alloys. Here, we demonstrate the microstructural stability, pitting resistance, and superior tribo-corrosion degradation resistance of the AlCoCrFeNi 2.1 eutectic HEA in comparison with duplex stainless steel 2205 in deionized water (controlled low-ionic-strength electrolyte) at 25 °C, 50 °C and 100 °C. The AlCoCrFeNi 2.1 HEA showed excellent microstructural stability and tribo-corrosion resistance at all three temperatures, an order-of-magnitude lower wear rate, and a lower coefficient of friction compared with duplex 2205 steel. The lowest wear volume loss and wear rate for both AlCoCrFeNi 2.1 and duplex steel were recorded at 50 °C, which was attributed to temperature-assisted passivation and formation of a comparatively stable tribological surface condition. These results suggest superior performance of eutectic HEAs in tribo-corrosion applications compared with currently used dual-phase steels and motivate future evaluation in ion-containing industrial water chemistries.

36 MATERIALS SCIENCE↗
DOE OSTI2026

Interconnect: Cooperative Research and Development Final Report, CRADA Number CRD-13-00507 (Project 4)

This CRADA modification involves analyses on a variety of CdTe-PV related materials, test structures, solar cells, and modules produced at FSLR and/or NLR and adds analysis related to module degradation and reliability. Materials will be provided by FSLR, NLR, and/or by interleaving FSLR and NLR layers and processes. Module reliability activities will include technical risk assessment, materials characterization, module and test structure characterization, modeling, accelerated test development, and outdoor testing.

14 SOLAR ENERGY↗
NASA NTRS1977

The ionospheres and plasma tails of comets

The paper reviews the current state of knowledge about cometary plasma (type I) tails and ionospheres. Observational statistics for type I tails are examined along with spectroscopic observations of plasma tails, identified ion species in such tails, and the morphology of cometary plasma tails and ionospheres. Evidence for a strong interaction between comets and the solar wind is evaluated on the basis of observations of plasma-tail orientations, large accelerations of tail structures, and correlations between disturbances in type I tails and solar-wind or geomagnetic disturbances. The use of comets as solar-wind probes is discussed, the nature of comet-solar-wind interactions is investigated, and ionization sources for cometary gases are considered. Hydrodynamic models of comet-solar-wind interaction are summarized, and the structure and ion chemistry of cometary ionospheres are studied. Observations suggesting that significant magnetic fields are associated with comets are briefly reviewed and interpreted.

Mendis, D. A.↗
NASA NTRS1983

Plasma and energetic particle structure of a collisionless quasi-parallel shock

The quasi-parallel interplanetary shock of November 11-12, 1978 from both the collisionless shock and energetic particle points of view were studied using measurements of the interplanetary magnetic and electric fields, solar wind electrons, plasma and MHD waves, and intermediate and high energy ions obtained on ISEE-1, -2, and -3. The interplanetary environment through which the shock was propagating when it encountered the three spacecraft was characterized; the observations of this shock are documented and current theories of quasi-parallel shock structure and particle acceleration are tested. These observations tend to confirm present self consistent theories of first order Fermi acceleration by shocks and of collisionless shock dissipation involving firehouse instability.

Kennel, C. F.↗
NASA NTRS1984

OTV propulsion tecnology programmatic overview

An advanced orbit transfer vehicles (OTV) which will be an integral part of the national space transportation system to carry men and cargo between low Earth orbit and geosynchronous orbit will perform planetary transfers and deliver large acceleration limited space structures to high Earth orbits is reviewed. The establishment of an advanced propulsion technology base for an OTV for the mid 1990's is outlined. The program supports technology for three unique engine concepts. Work is conducted to generic technologies which benefit all three concepts and specific technology which benefits only one of the concepts. Concept and technology definitions to identify propulsion innovations, and subcomponent research to explore and validate their potential benefits are included.

Cooper, L. P.↗
NASA NTRS1985

Orbit on demand - In this century if pushed

Performance requirements and design features of the next generation of manned launch vehicles are discussed. The vehicles will launch within minutes of demand and will have a several-day turnaround time. Launch and landing sites will have minimal facilities. Baseline requirements comprise carriage and return of a 5000 lb, 7 ft diam, 15 ft long payload, a 160 n. mi. polar orbit, a 200 fps on-orbit delt-V capability, provisions for two men for 24 hr, an 1100 n. mi. cross range option, 500 flights/vehicle, land on 10,000 ft runways, and be acceptable passing over populated areas. Significant advances are needed in propulsion and fuel systems, lightweight durable structures and airbreathing acceleration engines. Trade-offs have yet to be fully explored among the number of stages and horizontal or vertical take-off.

Martin, J. A.↗
NASA NTRS1997

Passive Vibration Control of Airborne Equipment using a Circular Steel Ring

Vibration isolation is needed to protect avionics equipment from adverse aircraft vibration environments. Passive isolation is the simplest means to achieve this goal. The system used here consists of a circular steel ring with a lump mass on top and exposed to base excitation. Sinusoidal and filtered zero-mean Gaussian white noise are used to excite the structure and the acceleration response spectra at the top of the ring are computed. An experiment is performed to identify the natural frequencies and modal damping of the circular ring. Comparison is made between the analytical and experimental results and good agreement is observed. The ring response is also evaluated with a concentrated mass attached to the top of the ring. The effectiveness of the ring in isolating the equipment from base excitation is studied. The acceleration response spectra of a single degree of freedom system attached to the top of the ring are evaluated and the results are compared with those exposed directly to the base excitation. It is shown that a properly designed ring could effectively protect the avionics from possible damaging excitation levels.

Ellison, Joseph↗
NASA NTRS1995

Solar Wind Speed Structure in the Inner Corona at 3-12 Ro

Estimates of solar wind speed obtained by Armstrong et al. [1986] based on 1983 VLA multiple-station intensity scintillation measurements inside 12 R(sub o) have been correlated with the electron density structure observed in white-light coronagraph measurements. The observed large- scale and apparently systematic speed variations are found to depend primarily on changes in heliographic latitude and longitude, which leads to the first results on large-scale speed structure in the acceleration region of the solar wind. Over an equatorial hole, solar wind speed is relatively steady, with peak-to-peak variations of 50 km/s and an average of 230 km/s. In contrast, the near-Sun flow speed across the streamer belt shows regular large-scale variations in the range of 100-300 km/s. Based on four groups of data, the gradient is 36 km/s per degree in heliocentric coordinates (corresponding to a rise of 260 km/s over a spatial distance on the Sun of two arcmin) with a standard deviation of 2.4 km/s per degree. The lowest speeds most likely coincide with the stalks of coronal streamers observed in white-light measurements. The detection of significant wind shear over the streamer belt is consistent with in situ and scintillation measurements showing that the density spectrum has a power-law form characteristic of fully developed turbulence over a much broader range of scales than in neighboring regions.

Woo, Richard↗
NASA NTRS2004

Concentration Measurements in Self-Excited, Momentum-Dominated Helium Jets

Flow structure of momentum-dominated pure helium jets discharged vertically into ambient air was investigated using high-speed rainbow schlieren deflectometry (RSD) technique. Effects of the operating parameters, i.e., Reynolds number (Re) and Richardson number (Ri), on the oscillatory behavior of the flow were examined over a range of experimental conditions. To seek the individual effect of these parameters, one of them was fixed and the other was varied with certain constraints. Measurements revealed highly periodic oscillations in the laminar region as well as high regularity in transition and turbulent regions. Maximum spectral power profiles at different axial locations indicated the oscillation amplitude increasing until the breakdown of the jet in the turbulent regime. The transition from the laminar to turbulent flow was also investigated. Fast Fourier transform analysis performed in the transition regime showed that the flow oscillates at a unique frequency, which was the same in the upstream laminar flow region. Measured deflection angle data were used in Abel inversion algorithm to construct the helium concentration fields. Instantaneous helium concentration contours revealed changes in the flow structure and evolution of vortical structures during an oscillation cycle. Temporal evolution plots of helium concentration at different axial location showed repeatable oscillations at all axial and radial locations up to the turbulent regime. A cross-correlation technique, applied to find the spatial displacements of the vortical structures, provided correlation coefficient peaks between consecutive schlieren images. Results show that the vortical structure convected and accelerated only in the axial direction.

Yildirim, Bekir Sedat↗
NASA NTRS2006

Plasma Circulation in the Magnetosphere

We investigate the global structure and dynamics of plasma circulation produced by prototypical solar wind disturbances of the interplanetary magnetic field and dynamic pressure. We track the global circulation and energization of solar wind, polar wind, and auroral wind plasmas throughout the magnetosphere, until they precipitate or escape into the downstream solar wind. We use the full equations of motion of the plasma ions within fields produced by a global MHD simulation of the dynamic solar wind interaction. We use the dynamic hot plasma density and Poynting energy flux specified at the inner boundary of the MHD simulation as drivers of conjugate ion outflow fluxes using local empirical relations obtained from the FAST and Polar missions. Birkeland currents computed by the MHD code are used to derive a field-parallel potential drop from a Knight-like relation [as modified by Lyons and Evans, 1980]. This potential drop is applied to each ion as an initial bulk energy, added to a thermal heating driven by the locally incident Poynting flux. The solar wind pressure increase case (B(sub Y) = 5; B(sub z) = 0 nT) produces an immediate substorm owing to compression of pre-existing plasmas. The SB(sub z), interval (embedded in NB(sub z)) produces a substorm after about one hour of development. Both disturbances enhance the auroral wind flux and heavy ion pressure of the magnetosphere substantially, with complex dynamic structuring by auroral acceleration vortexes and dynamic reconnection. Comparisons are made with observations during disturbed periods including the Halloween 2003 super-storm and other periods.

Moore, T. E.↗
NASA NTRS2006

Using SOHO to Understand CME-Producing Quiet-Region Filament Eruptions

In recent years we have been studying solar eruptions in an attempt to determine their primary initiation mechanism. We have focused on events involving filaments, because motions of the filaments just prior to their violent eruption are indicative of changes in the entire magnetic field system involved in the eruption. When the pre-eruption filament resides in a quiet region, the motions leading up to eruption are slower than in similar eruptions in active regions due to the weaker magnetic field strength and correspondingly lower Alfven velocities. These early motions manifest themselves in a slow rise (a few km/s) of the filament, in some cases lasting several hours. After this the filament and associated magnetic structures erupt rapidly, accelerating to speeds of a few 10 kmh over a few minutes. Because of their slow evolution, quiet-region eruptions such as these can be effectively studied in EUV with SOHO/EIT, with its regular cadence of about 12 min. For several cases we have combined EIT images with SOHO/MDI magnetograms and data from other other instruments, and compared our observations with predictions from various eruption scenarios, in particular the "breakout" (Antiochos 1998), "tether cutting" (e.g., Moore et al. 2001), and MHD instability mechanisms. Here we present a representative example of a quiet-region eruption involving a filament ejection, that occurred on 2001 February 28 in a magnetically quadrupolar region and produced a halo CME in SOHO/LASCO images. In addition to EIT and MDI, we analyzed spectral data from SOHO/CDS and soft X-ray (SXR) images from Yohkoh/SXT. We found that flux emergence occurred near one end of the filament, and that both this emergence and resulting microflaring in SXRs and EUV were temporally and spatially closely related to the start of the filament's slow rise. Intensity changes (dimmings and brightenings) in the EIT and SXT images indicate that fields far removed from the erupting core were involved in the eruption, and that breakout-type reconnection did occur. Our observations allow us to investigate whether breakout was the trigger of the eruption, or merely a consequence of a more fundamental eruption process such as tether cutting or MHD instability occurring in a complex magnetic environment.

Sterling, A. C.↗
NASA NTRS2009

Simulation of Relativistic Shocks and Associated Radiation from Turbulent Magnetic Fields

Plasma instabilities excited in collisionless shocks are responsible for particle acceleration. We have investigated the particle acceleration and shock structure associated with an unmagnetized relativistic electron-positron jet propagating into an unmagnetized electron-positron plasma. Cold jet electrons are thermalized and slowed while the ambient electrons are swept up to create a partially developed hydrodynamic-like shock structure. In the leading shock, electron density increases by a factor of about 3.5 in the simulation frame. Strong electromagnetic fields are generated in the trailing shock and provide an emission site. These magnetic fields contribute to the electron's transverse deflection behind the shock. The jitter'' radiation from deflected electrons in turbulent magnetic fields has different properties than synchrotron radiation, which is calculated in a uniform magnetic field. This jitter radiation may be important for understanding the complex time evolution and/or spectral structure in gamma-ray bursts, relativistic jets in general, and supernova remnants. New spectra based on simulations will be presented.

Nishikawa, K.-I.↗
NASA NTRS2010

Simulation of Relativistic Shocks and Associated Self-Consistent Radiation

Plasma instabilities excited in collisionless shocks are responsible for particle acceleration. We have investigated the particle acceleration and shock structure associated with an unmagnetized relativistic electron-positron jet propagating into an unmagnetized electron-positron plasma. Cold jet electrons are thermalized and slowed while the ambient electrons are swept up to create a partially developed hydrodynamic-like shock structure. In the leading shock, electron density increases by a factor of about 3.5 in the simulation frame. Strong electromagnetic fields are generated in the trailing shock and provide an emission site. These magnetic fields contribute to the electrons transverse deflection behind the shock. We calculate the radiation from deflected electrons in the turbulent magnetic fields. The properties of this radiation may be important for understanding the complex time evolution and/or spectral structure in gamma-ray bursts, relativistic jets in general, and supernova remnants.

Nishikawa, K.-I.↗