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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 595 records · Page 33
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Modeling fast ion losses due to tearing and internal kink perturbations in MAST-U

Fast ion (FI) loss properties in the presence of tearing mode and internal kink perturbations are numerically investigated for discharges in the MAST-U spherical tokamak, utilizing the MARS-F magnetohydrodynamic stability code and the REORBIT test particle guiding-center orbit-following module. Here, tracing about 100 000 particle markers sampled from the equilibrium distribution of the neutral-beam injection induced FIs, it is found that about 10% out of the total strike the limiting surface (including the divertor surface) in MAST-U discharge 46943, assuming a maximum perturbation of 100 G inside the plasma (corresponding to ~6 G at the Mirnov probe location at the outboard mid-plane). Detailed particle tracing, assuming a uniform initial distribution in the 2D phase space (at given radial locations), reveals that initially counter-current FIs launched near the plasma edge are subject to significant prompt losses, while almost all initially co-current ions remain well confined at the assumed perturbation level. Most lost FIs strike the lower-half of the limiting surface. Finite gyro-radius effects prevent lost ions from striking the top-outer corner of the super-X divertor chamber. A scan of the perturbation level (based on discharge 45163) reveals, not surprisingly, an approximately linear scaling of the particle loss fraction (for counter-current FIs) with respect to the perturbation amplitude.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2026

Defect-induced displacement of topological surface state in quantum magnet MnBi2Te4

The topological magnet MnBi2⁢Te4 (MBT), with gapped topological surface state, is an attractive platform for realizing quantum anomalous Hall and axion insulator states. However, the experimentally observed surface state gaps fail to meet theoretical predictions, although the exact mechanism behind the gap suppression has been debated. Recent theoretical studies suggest that intrinsic antisite defects push the topological surface state away from the MBT surface, closing its gap and making it less accessible to scanning probe experiments. Here, we report on the local effect of defects on the MBT surface states and demonstrate that high defect concentrations lead to a displacement of the surface states well into the MBT crystal, validating the theorized mechanism. The local and global influence of antisite defects on the topological surface states are studied with samples of varying defect densities by combining scanning tunneling microscopy, angle-resolved photoemission spectroscopy, and density functional theory. Our findings identify a combination of increased defect density and reduced defect spacing as the primary factors underlying the displacement of the surface states and suppression of surface gap, guiding further development of topological quantum materials.

Lupke, Felix [Carnegie Mellon University (CMU)]↗
DOE OSTI2023

Impact of Oxygen Storage Components in Prototype Pd-Based Three-Way Catalysts under Exhaust Conditions Relevant to Propane Engines

With increasing concerns about global warming, the push for sustainable and eco-friendly fuels is accelerating. Propane, recognized as liquefied petroleum gas or LPG, has garnered research interest as an alternative fuel due to its notable advantages, including a high-octane rating, reduced greenhouse gas emissions, and potential cost-effectiveness. However, to realize its full potential as an alternative fuel it is essential to develop catalysts that efficiently handle emissions at low temperatures. In our research, we investigated three distinct palladium (Pd)-based three-way catalyst (TWC) formulations (PdRh, Pd-only, and Pd-OSC) to investigate the influence of typical TWC components rhodium (Rh) and oxygen storage components (OSC) in exhaust scenarios relevant to propane-fueled engines. Among these, the formulation containing oxygen storage components (Pd-OSC) showed the highest reactivity for both NO and C 3 H 8 while minimizing performance degradation from hydrothermal aging (HTA). Notably, the temperature of 50% conversion (T50) for propane in the Pd-OSC fresh and HTA sample was lower by 30 °C and 13 °C, respectively, compared to the Pd-only sample, highlighting the role of oxygen storage materials in enhancing catalyst performance, even without dithering. Additionally, N 2 physisorption showed that the PdOSC sample has a higher surface area and increased pore volume. This underscores the idea that OSC materials not only augment the catalyst’s porosity but also optimize reactant accessibility to active sites, thus elevating catalytic efficiency. In addition to evaluating performance, we further explored the performance and characteristics of the catalysts using catalytic probe reactions, such as water–gas shift and steam reforming reactions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2014

Exploring Local Electrostatic Effects with Scanning Probe Microscopy: Implications for Piezoresponse Force Microscopy and Triboelectricity

The implementation of contact mode Kelvin probe force microscopy (KPFM) utilizes the electrostatic interactions between tip and sample when the tip and sample are in contact with each other. Surprisingly, the electrostatic forces in contact are large enough to be measured even with tips as stiff as 4.5 N/m. As for traditional non-contact KPFM, the signal depends strongly on electrical properties of the sample, such as the dielectric constant, and the tip-properties, such as the stiffness. Since the tip is in contact with the sample, bias-induced changes in the junction potential between tip and sample can be measured with higher lateral and temporal resolution compared to traditional non-contact KPFM. Significant and reproducible variations of tip-surface capacitance are observed and attributed to surface electrochemical phenomena. Lastly, observations of significant surface charge states at zero bias and strong hysteretic electromechanical responses at non-ferroelectric surface have significant implications for fields such as triboelectricity and piezoresponse force microscopy.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2019

Identifying the Role of Dynamic Surface Hydroxides in the Dehydrogenation of Ti-Doped NaAlH 4

Solid-state metal hydrides are prime candidates to replace compressed hydrogen for fuel cell vehicles due to their high volumetric capacities. Sodium aluminum hydride has long been studied as an archetype for higher-capacity metal hydrides, with improved reversibility demonstrated through the addition of titanium catalysts; however, atomistic mechanisms for surface processes, including hydrogen desorption, are still uncertain. Here in this paper, operando and ex situ measurements from a suite of diagnostic tools probing multiple length scales are combined with ab initio simulations to provide a detailed and unbiased view of the evolution of the surface chemistry during hydrogen release. In contrast to some previously proposed mechanisms, the titanium dopant does not directly facilitate desorption at the surface. Instead, oxidized surface species, even on well-protected NaAlH 4 samples, evolve during dehydrogenation to form surface hydroxides with differing levels of hydrogen saturation. Additionally, the presence of these oxidized species leads to considerably lower computed barriers for H 2 formation compared to pristine hydride surfaces, suggesting that oxygen may actively participate in hydrogen release, rather than merely inhibiting diffusion as is commonly presumed. These results demonstrate how close experiment–theory feedback can elucidate mechanistic understanding of complex metal hydride chemistry and potentially impactful roles of unavoidable surface impurities.

25 ENERGY STORAGE↗
DOE OSTI2012

A DETECTION OF WEAK-LENSING MAGNIFICATION USING GALAXY SIZES AND MAGNITUDES

Weak lensing is commonly measured using shear through galaxy ellipticities or using the effect of magnification bias on galaxy number densities. Here, we report on the first detection of weak-lensing magnification with a new, independent technique using the distribution of galaxy sizes and magnitudes. These data come for free in galaxy surveys designed for measuring shear. We present the magnification estimator and apply it to an X-ray-selected sample of galaxy groups in the COSMOS Hubble Space Telescope survey. The measurement of the projected surface density {Sigma}(r) is consistent with the shear measurements within the uncertainties and has roughly 40% of the signal to noise of the latter. We discuss systematic issues and challenges to realizing the potential of this new probe of weak lensing.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2024

Chiral kinematic theory and converse vortical effects

Response theories in condensed matter typically describe the response of an electron fluid to external electromagnetic fields, while perturbations on neutral particles are often designed to mimic such fields. Here, we study the response of fermions to a space-time-dependent velocity field, thereby sidestepping the issue of gauge charge. First, we use a semiclassical chiral kinematic theory to obtain the local density of current and extract the orbital magnetization. The theory immediately predicts a "converse vortical effect," defined as an orbital magnetization driven by linear velocity. It receives contributions from magnetic moments on the Fermi surface and the Berry curvature of the occupied bands. Then, transcending semiclassics via a complementary Kubo formalism reveals that the uniform limit of a clean system receives only the Berry curvature contribution while other limits sense the Fermi surface magnetic moments too. We propose CoSi as a candidate material and suggest magnetometry of a sample under a thermal gradient to detect the effect. Overall, our study sheds light on the effects of a space-time-dependent velocity field on electron fluids and paves the way for exploring quantum materials using new probes and perturbations.

Chen, Kai↗
DOE OSTI2015

Ferroelectric Switching by the Grounded Scanning Probe Microscopy Tip

The process of polarization reversal by the tip of scanning probe microscope was intensively studied for last two decades. Number of the abnormal switching phenomena was reported by the scientific groups worldwide. In particularly it was experimentally and theoretically shown that slow dynamics of the surface screening controls kinetics of the ferroelectric switching, backswitching and relaxation and presence of the charges carriers on the sample surface and in the sample bulk significantly change polarization reversal dynamics. Here we experimentally demonstrated practical possibility of the history dependent polarization reversal by the grounded SPM tip. This phenomenon was attributed to induction of the slowly dissipating charges into the surface of the grounded tip that enables polarization reversal under the action of the produced electric field. Analytical and numerical electrostatic calculations allow additional insight into nontrivial abnormal switching phenomena reported earlier.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2019

Hydrothermally robust Ti/SiO 2 epoxidation catalysts via surface modification with oligomeric PMHS

We investigate grafting of poly(methylhydrosiloxane) (PMHS) onto Ti/SiO 2 catalysts for improving their robustness to water, using olefin epoxidation catalysis with organic hydroperoxide as oxidant as a relevant probe reaction. Our approach involves triggering catalyst deactivation with added water in the reactants as a means to simulate catalyst deactivation, thereby causing grafted Ti-site aggregation. When using harsh aqueous Soxhlet extraction conditions as a trigger for this aggregation, significant differences are observed via diffuse-reflectance UV-Vis spectrscopy on samples before and after treatment, for Ti/SiO 2 catalysts containing grafted PMHS. Not only was there a lack of appearance of red-shifted bands in the UV-Vis spectrum following Soxhlet extraction, the batch catalytic activity for catalysts before and after PMHS grafting remained virtually unchanged. This was in stark contrast to an unmodified Ti/SiO 2 catalyst, which showed a more than 60% decrease in catalytic activity following Soxhlet extraction as a result of aggregation, as ascertained by red shifts in its UV-Vis spectrum after Soxhlet extraction. Similar red shifts were also observed for a hydrophobically modified TMS Ti/SiO 2 catalyst. However, when comparing these catalysts under more gentle olefin epoxidation catalysis conditions with added water in a flow reactor, it was more difficult to differentiate the TMS Ti/SiO2 and grafted PMHS catalysts. Both catalysts exhibited similar activity and selectivity after a prolonged time on stream, though the rate of initial deactivation in the latter was less pronounced. Altogether, our data demonstrate that grafted PMHS catalysts are positively differentiated from conventional catalysts based on either TMS surface modification or no surface modification, under conditions involving aggregation induced via extreme hydrothermal environmentst. Thus, we expect that PMHS grafting of Lewis acid catalysts can offer an alternative approach for endowing hydrolytic stability to such catalysts, as demonstrated here for Ti/SiO 2 epoxidation catalysts.

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

M-STAR: Magnetism second target advanced reflectometer at the Spallation Neutron Source

M-STAR is a next generation polarized neutron reflectometer with advanced capabilities. A new focusing guide concept is optimized for samples with dimensions down to a millimeter range. A proposed hybrid pulse-skipping chopper will enable experiments at constant geometry at one incident angle in a broad range of wavevector transfer Q up to 0.3 A –1 for specular, off-specular, and GISANS measurements. M-STAR will empower nanoscience and spintronics studies routinely on small samples (~2 × 2 mm 2 ) and of atomic-scale thickness using versatile experimental conditions of magnetic and/or electric fields, light, and temperature applied in situ to novel complex device-like nanosystems with multiple buried interfaces. M-STAR will enable improved grazing incidence diffraction measurements, as a surface-sensitive depth-resolved probe of, e.g., the out-of-plane component of atomic magnetic moments in ferromagnetic, antiferromagnetic, and more complex structures as well as in-plane atomic-scale structures inaccessible with contemporary diffractometry and reflectometry. New horizons will be opened by the development of an option to probe near-surface dynamics with inelastic grazing incidence scattering in the time-of-flight mode. These novel options in combination with ideally matched parameters of the second target station will place M-STAR in the world’s leading position for high resolution polarized reflectometry.

47 OTHER INSTRUMENTATION↗
NASA NTRS1974

The use of the ion probe mass spectrometer in the measurement of hydrogen concentration gradients in Monel K 500

The ion probe mass spectrometer was used to measure hydrogen concentration gradients in cathodically charged Monel K 500. Initial work with the ion probe involved the calibration of the instrument and the establishment of a suitable experimental procedure for this application. Samples of Monel K 500 were cathodically charged in a weak sulfuric acid solution. By varying the current density, different levels of hydrogen were introduced into the samples. Hydrogen concentration gradients were taken by ion sputtering on the surface of these samples and monitoring the behavior of the hydrogen mass peak as a function of time. An attempt was made to determine the relative amounts of hydrogen in the bulk and grain boundaries by analyzing a fresh fracture surface with a higher proportion of grain boundary area. It was found that substantially more hydrogen was detected in the grain boundaries than in the bulk, confirming the predictions of previous workers. A sputter rate determination was made in order to establish the rate of erosion.

Truhan, J. J., Jr.↗
NASA NTRS1983

Gravitational lens effects of a cosmological density of compact objects

Amplification of quasar light by a cosmological density of compact objects causes significant effects on many quasars in magnitude-limited samples. For lens masses solar mass less than 100,000 solar mass the continuum would be amplified by a magnitude or more but the line emission would not. Examination of the UV selected sample of Marshall et al. (1983) gives limits to more than 90 percent statistical confidence of Omega(c) less than 0.1 for a mass between 200 and 100,000 solar mass, where Omega(c) is the mean density of objects of mass M relative to the closure density. Preliminary results from an X-ray selected sample may probe to more than 0.1 solar mass and give a value for Omega(c) of less than one. These limits indicate that the remnants of an early population of massive stars cannot make a cosmologically significant contribution to the mass density of the universe. On a separate topic, recent work on the enhanced surface density of quasars near galaxies due to lensing by stars in the galaxy halos is reviewed.

Canizares, C. R.↗
NASA NTRS1999

The Meteorological Experiment on the Mars Surveyor '98 Polar Lander

When it lands on Mars on December 3, 1999, the Mars Surveyor '98 Mars Polar Lander (MPL) will provide the first opportunity to make in-situ measurements of the near-surface weather climate, and volatile inventory in the Martian south polar region. To make the most of this opportunity, the MPL's Mars Volatiles and Climate Surveyor (MVACS) payload includes the most comprehensive complement of meteorological instruments ever sent to Mars. Like the Viking and the Mars Pathfinder Lander, the MVACS Meteorological (Met) package includes sensors for measuring atmospheric pressures, temperatures, and wind velocities. This payload also includes a 2-channel tunable diode laser spectrometer for in-situ measurements of the atmospheric water vapor abundance near the ground, and improved instruments for measuring the relative abundances of oxygen isotopes (in water vapor and CO2) and a surface temperature probe for measuring the surface and sub-surface temperatures. This presentation will provide a brief overview of the environmental conditions anticipated at the surface in the Martian regions. We will then provide an over-view of the MVACS Met instrument and describe the MET sensors in detail, including their principle of operation, range, resolution, accuracy, sampling strategy, heritage, accommodation on the Lander, and their control and data handling system. Finally, we will describe the operational sequences, resource requirements, and the anticipated data volumes for each of the Met instruments.

Crisp, D.↗
DOE OSTI2016

On the induction of homogeneous bulk crystallization in Eu-doped calcium aluminosilicate glass by applying simultaneous high pressure and temperature

From initial calcium aluminosilicate glass, transparent glass-ceramics have been successfully synthesized under simultaneous high pressure and temperature (SHPT). Possible homogeneous volumetric crystallization of this glassy system, which was not achieved previously by means of conventional heat treatment, has been put in evidence with a SHPT procedure. Structural, mechanical, and optical properties of glass and glass-ceramic obtained were investigated. Raman spectroscopy and X-ray diffraction allowed to identify two main crystalline phases: merwinite [Ca{sub 3}Mg(SiO{sub 4}){sub 2}] and diopside [CaMgSi{sub 2}O{sub 6}]. A Raman scanning profile showed that the formation of merwinite is quite homogeneous over the bulk sample. However, the sample surface also contains significant diopside crystals. Instrumented Berkovich nanoindentation was applied to determine the effect of SHPT on hardness from glass to glass-ceramic. For Eu-doped samples, the broadband emission due to 4f{sup 6}5d{sup 1} → 4f{sup 7} transition of Eu{sup 2+} was studied in both host systems. Additionally, the {sup 5}D{sub 0} → {sup 7}F{sub J} transition of Eu{sup 3+} was used as an environment probe in the pristine glass and the glass-ceramic.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2011

Photovoltaic properties of graphene oxide sheets beaded with ZnO nanoparticles

A hybrid material of graphene oxide (GO) sheets beaded with ZnO nanoparticles was prepared. The material extends over a few hundred square nanometers, in which the ZnO nanoparticles (average diameter ({approx}5 nm)) are dispersed evenly on the GO sheet. Both the surface photovoltage or surface photocurrent intensity for the material are much stronger than for pure ZnO nanoparticles, meaning that the free charge carriers can effectively be transferred from ZnO nanoparticles to GO sheets, which can serve as a probe to monitor the electron transfer from excited ZnO to GO. Anchoring ZnO nanoparticles on two dimensional carbon nanostructures such as GO can pave a way towards the design of ordered nanostructure assemblies that can harvest light energy efficiently. -- Graphical Abstract: Upon irradiating the GO-ZnO sample with a light having an energy equalizing the band gap energy, the photogenerated charge-hole pairs are produced, and have been separated effectively. Display Omitted Research highlights: > A hybrid material of graphene oxide (GO) sheets beaded with ZnO nanoparticles was prepared. > The ordered nanostructure assemblies can harvest light energy efficiently and the free charge carriers can effectively be transferred from ZnO nanoparticles to GO sheet. > A hybrid material can serve as a probe to monitor the electron transfer from excited ZnO to GO.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2013

FUELING ACTIVE GALACTIC NUCLEI. I. HOW THE GLOBAL CHARACTERISTICS OF THE CENTRAL KILOPARSEC OF SEYFERTS DIFFER FROM QUIESCENT GALAXIES

In a matched sample of Seyfert and quiescent galaxies we simultaneously probe the stellar and molecular gas kinematics from 1 kpc down to 50 pc with the aim of identifying the dynamical processes dictating black hole accretion rates. This first paper compares the global characteristics of a sample of 10 galaxies. We find several differences within a radius of 500 pc that are correlated with active galactic nucleus (AGN) activity. The Seyferts have (1) a more centrally concentrated nuclear stellar surface brightness with lower stellar luminosities beyond a radius of 100 pc, (2) a lower stellar velocity dispersion within a radius of 200 pc, (3) elevated H{sub 2} 1-0 S(1) luminosity out to a radius of at least 250 pc, and (4) more centrally concentrated H{sub 2} surface brightness profiles. These observed differences can be interpreted as evidence for Seyfert galaxies having a dynamically cold (in comparison to the bulge) nuclear structure composed of a significant gas reservoir and a relatively young stellar population. This structure is undetected (and possibly does not exist) in quiescent galaxies. The presence of such a nuclear structure in Seyfert galaxies provides evidence for inflow of the surrounding interstellar medium since the nuclear stellar population requires a supply of gas from which to form. The fueling of a Seyfert AGN is thus associated with the formation of a dynamically cold component of gas and stars on scales of hundreds of parsecs.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2023

Fast Surface Oxygen Release Kinetics Accelerate Nanoparticle Exsolution in Perovskite Oxides

Exsolution is a recent advancement for fabricating oxide-supported metal nanoparticle catalysts via phase precipitation out of a host oxide. A fundamental understanding and control of the exsolution kinetics are needed to engineer exsolved nanoparticles to obtain higher catalytic activity toward clean energy and fuel conversion. Since oxygen release via oxygen vacancy formation in the host oxide is behind oxide reduction and metal exsolution, we hypothesize that the kinetics of metal exsolution should depend on the kinetics of oxygen release, in addition to the kinetics of metal cation diffusion. In this report we probe the surface exsolution kinetics both experimentally and theoretically using thin-film perovskite SrTi 0.65 Fe 0.35 O 3 (STF) as a model system. We quantitatively demonstrated that in this system the surface oxygen release governs the metal nanoparticle exsolution kinetics. As a result, by increasing the oxygen release rate in STF, either by reducing the sample thickness or by increasing the surface reactivity, one can effectively accelerate the Fe 0 exsolution kinetics. Fast oxygen release kinetics in STF not only shortened the prereduction time prior to the exsolution onset, but also increased the total quantity of exsolved Fe 0 over time, which agrees well with the predictions from our analytical kinetic modeling. The consistency between the results obtained from in situ experiments and analytical modeling provides a predictive capability for tailoring exsolution, and highlights the importance of engineering host oxide surface oxygen release kinetics in designing exsolved nanocatalysts.

36 MATERIALS SCIENCE↗
NASA NTRS2005

The Gas Chromatograph Mass Spectrometer (GCMS) Experiment on the Cassini-Huygens Probe: First Results

The Huygens Probe of the Cassini Huygens Mission entered the atmosphere of the moon Titan on January 14, 2005. The GCMS was part of the instrument complement on the Probe to measure in situ the chemical composition of the atmosphere during the probe descent and to support the Aerosol Collector Pyrolyzer (ACP) experiment by serving as detector for the pyrolization products. The GCMS collected data from an altitude of 146 km to ground impact for a time interval of 2 hours and 37 minutes. The Probe and the GCMS survived the ground impact and collected data for 1 hour and 9 minutes on the surface in the near surface environment until signal loss by the orbiter. The instrument collected 5634 mass spectra during descent and 2692 spectra on the ground over a range of m/z from 2 to 141. Eight gas chromatograph samples were taken during the descent and two on the ground. This is a report on work in progress. The major constituents of the lower atmosphere were found to be N2 and CH4. The methane-mixing ratio was found to increase below the turbopause, about 35 km altitude, monotonically toward the surface to levels near saturation. After surface impact a steep increase of the mixing ratio was observed suggesting evaporation of surface condensed methane due to heating by the GCMS sample inlet heater. Other constituents were found to be in very low concentrations, below ppm levels. The presence of Argon 40 was confirmed. The results for the other noble gases are still being evaluated. Other hydrocarbons and nitriles were also observed and quantitative evaluation is in progress. Preliminary ratios for the major carbon and nitrogen isotopes were computed from methane and molecular nitrogen measurements.

Niemann, H.↗