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All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

Operando Synchrotron Studies of Inhomogeneity during Anode-Free Plating of Li Metal in Pouch Cell Batteries

Operando synchrotron X-ray diffraction (XRD) studies have not previously been used to directly characterize Li metal in standard batteries due to the extremely weak scattering from Li atoms. In this work, it is demonstrated the stripping and plating of Li metal can be effectively quantified during battery cycling in appropriately designed synchrotron XRD experiments that utilize an anode-free battery configuration in which a Li-containing cathode material of LiNi 0.6 Mn 0.2 Co 0.2 O 2 (NMC622) is paired with a bare anode current collector consisting of either Cu metal (Cu/NMC) or Mo metal (Mo/NMC). In this configuration, it is possible to probe local variations in the deposition and stripping of Li metal with sufficient spatial sensitivity to map the inhomogeneity in pouch cells and to follow these processes with sufficient time resolution to track state-of-charge-dependent variations in the rate of Li usage at a single point. For the Cu/NMC and Mo/NMC batteries, it was observed that the initial plating of Li occurred in a very homogeneous manner but that severe macroscopic inhomogeneity arose on a mm-scale during the subsequent stripping of Li, contrasting with the conventional wisdom that the greatest challenges in Li metal batteries are associated with Li deposition.

25 ENERGY STORAGE↗
DOE OSTI2017

GAPS IN PROTOPLANETARY DISKS AS SIGNATURES OF PLANETS. III. POLARIZATION

Polarimetric observations of T Tauri and Herbig Ae/Be stars are a powerful way to image protoplanetary disks. However, interpretation of these images is difficult because the degree of polarization is highly sensitive to the angle of scattering of stellar light off the disk surface. We examine how disks with and without gaps created by planets appear in scattered polarized light as a function of inclination angle. Isophotes of inclined disks without gaps are distorted in polarized light, giving the appearance that the disks are more eccentric or more highly inclined than they truly are. Apparent gap locations are unaffected by polarization, but the gap contrast changes. In face-on disks with gaps, we find that the brightened far edge of the gap scatters less polarized light than the rest of the disk, resulting in slightly decreased contrast between the gap trough and the brightened far edge. In inclined disks, gaps can take on the appearance of being localized “holes” in brightness rather than full axisymmetric structures. Photocenter offsets along the minor axis of the disk in both total intensity and polarized intensity images can be readily explained by the finite thickness of the disk. Alone, polarized scattered light images of disks do not necessarily reveal intrinsic disk structure. However, when combined with total intensity images, the orientation of the disk can be deduced and much can be learned about disk structure and dust properties.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2016

SEARCHING FOR SCATTERERS: HIGH-CONTRAST IMAGING OF YOUNG STARS HOSTING WIDE-SEPARATION PLANETARY-MASS COMPANIONS

We have conducted an angular differential imaging survey with NIRC2 at Keck in search of close-in substellar companions to a sample of seven systems with confirmed planetary-mass companions (PMCs) on wide orbits (>50 au). These wide-separation PMCs pose significant challenges to all three possible formation mechanisms: core accretion plus scattering, disk instability, and turbulent fragmentation. We explore the possibility that these companions formed closer in and were scattered out to their present-day locations by searching for other massive bodies at smaller separations. The typical sensitivity for this survey is Δ K ∼ 12.5 at 1″. We identify eight candidate companions, whose masses would reach as low as one Jupiter mass if gravitationally bound. From our multi-epoch astrometry we determine that seven of these are conclusively background objects, while the eighth near DH Tau is ambiguous and requires additional monitoring. We rule out the presence of >7 M {sub Jup} bodies in these systems down to 15–50 au that could be responsible for scattering. This result combined with the totality of evidence suggests that dynamical scattering is unlikely to have produced this population of PMCs. We detect orbital motion from the companions ROXs 42B b and ROXs 12 b, and from this determine 95% upper limits on the companions’ eccentricities of 0.58 and 0.83 respectively. Finally, we find that the 95% upper limit on the occurrence rate of additional planets with masses between 5 and 15 M {sub Jup} outside of 40 au in systems with PMCs is 54%.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS2013

Natural Air-Sea Flux of CO2 in Simulations of the NASA-GISS Climate Model: Sensitivity to the Physical Ocean Model Formulation

Results from twin control simulations of the preindustrial CO2 gas exchange (natural flux of CO2) between the ocean and the atmosphere are presented here using the NASA-GISS climate model, in which the same atmospheric component (modelE2) is coupled to two different ocean models, the Russell ocean model and HYCOM. Both incarnations of the GISS climate model are also coupled to the same ocean biogeochemistry module (NOBM) which estimates prognostic distributions for biotic and abiotic fields that influence the air-sea flux of CO2. Model intercomparison is carried out at equilibrium conditions and model differences are contrasted with biases from present day climatologies. Although the models agree on the spatial patterns of the air-sea flux of CO2, they disagree on the strength of the North Atlantic and Southern Ocean sinks mainly because of kinematic (winds) and chemistry (pCO2) differences rather than thermodynamic (SST) ones. Biology/chemistry dissimilarities in the models stem from the different parameterizations of advective and diffusive processes, such as overturning, mixing and horizontal tracer advection and to a lesser degree from parameterizations of biogeochemical processes such as gravitational settling and sinking. The global meridional overturning circulation illustrates much of the different behavior of the biological pump in the two models, together with differences in mixed layer depth which are responsible for different SST, DIC and nutrient distributions in the two models and consequently different atmospheric feedbacks (in the wind, net heat and freshwater fluxes into the ocean).

Gas exchange↗
DOE OSTI2018

Estimate of the signal from the chiral magnetic effect in heavy-ion collisions from measurements relative to the participant and spectator flow planes

An interpretation of the charge-dependent correlations sensitive to the chiral magnetic effect (CME)—–the separation of the electric charges along the system magnetic field (across the reaction plane)—–is ambiguous due to possible large background (non-CME) effects. Here, the background contribution is proportional to the elliptic flow v 2 ; it is the largest in measurements relative to the participant plane and is smaller in measurements relative to the flow plane determined by spectators, where the CME signal, in contrast, is likely larger. In this paper, I discuss a possible strategy for corresponding experimental measurements and list and evaluate different assumptions related to this approach.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2018

Influence of pH on the balance between methanogenesis and iron reduction

Methanogenesis and iron reduction play major roles in determining global fluxes of greenhouse gases. Despite their importance, environmental factors that influence their interactions are poorly known. Here, we present evidence that pH significantly influences the balance between each reaction in anoxic environments that contain ferric (oxyhydr)oxide minerals. In sediment bioreactors that contained goethite as a source of ferric iron, both iron reduction and methanogenesis occurred but the balance between them varied significantly with pH. Compared to bioreactors receiving acidic media (pH 6), electron donor oxidation was 85% lower for iron reduction and 61% higher for methanogenesis in bioreactors receiving alkaline media (pH 7.5). Thus, methanogenesis displaced iron reduction considerably at alkaline pH. Geochemistry data collected from U.S. aquifers demonstrate that a similar pattern also exists on a broad spatial scale in natural settings. In contrast, in bioreactors that were not augmented with goethite, clay minerals served as the source of ferric iron and the balance between each reaction did not vary significantly with pH. We therefore conclude that pH can regulate the relative contributions of microbial iron reduction and methanogenesis to carbon fluxes from terrestrial environments. We further propose that the availability of ferric (oxyhydr)oxide minerals influences the extent to which the balance between each reaction is sensitive to pH. Here, the results of this study advance our understanding of environmental controls on microbial methane generation and provide a basis for using pH and the occurrence of ferric minerals to refine predictions of greenhouse gas fluxes.

58 GEOSCIENCES↗
DOE OSTI2019

Evaluating the Bias of South China Sea Summer Monsoon Precipitation Associated with Fast Physical Processes Using a Climate Model Hindcast Approach

Abstract The present study aims to identify the precipitation bias associated with the interactions among fast physical processes in the Community Atmospheric Model, version 5 (CAM5), during the abrupt onset of the South China Sea (SCS) summer monsoon, a key precursor of the overall East Asia summer monsoon (EASM). The multiyear hindcast approach is utilized to obtain the well-constrained synoptic-scale horizontal circulation each year during the onset period from the years 1998 to 2012. In the pre-onset period, the ocean precipitation over the SCS is insufficiently suppressed in CAM5 hindcasts and thus weaker land–ocean precipitation contrasts. This is associated with the weaker and shallower convection simulated over the surrounding land, producing weaker local circulation within the SCS basin. In the post-onset period, rainfall of the organized convection over the Philippine coastal ocean is underestimated in the hindcasts, with overestimated upper-level heating. These biases are further elaborated as the underrepresentation of the convection diurnal cycle and coastal convection systems, as well as the issue of precipitation sensitivity to environmental moisture during the SCS onset period. The biases identified in hindcasts are consistent with the general bias of the EASM in the climate simulation of CAM5. The current results highlight that the appropriate representation of land–ocean–convection interactions over coastal areas can potentially improve the simulation of seasonal transition over the monsoon regions.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2017

Impact of Monoenergetic Photon Sources on Nonproliferation Applications Final Report

Near-monoenergetic photon sources (MPSs) have the potential to improve sensitivity at greatly reduced dose in existing applications and enable new capabilities in other applications, particularly where passive signatures do not penetrate or are insufficiently accurate. MPS advantages include the ability to select energy, energy spread, flux, and pulse structures to deliver only the photons needed for the application, while suppressing extraneous dose and background. Some MPSs also offer narrow angular divergence photon beams which can target dose and/or mitigate scattering contributions to image contrast degradation. Current bremsstrahlung photon sources (e.g., linacs and betatrons) produce photons over a broad range of energies, thus delivering unnecessary dose that in some cases also interferes with the signature to be detected and/or restricts operations. Current sources must be collimated (reducing flux) to generate narrow divergence beams. While MPSs can in principle resolve these issues, they remain at relatively low TRL status. Candidate MPS technologies for nonproliferation applications are now being developed, each of which has different properties (e.g. broad vs. narrow angular divergence). Within each technology, source parameters trade off against one another (e.g. flux vs. energy spread), representing a large operation space. This report describes a broad survey of potential applications, identification of high priority applications, and detailed simulations addressing those priority applications. Requirements were derived for each application, and analysis and simulations were conducted to define MPS parameters that deliver benefit. The results can inform targeting of MPS development to deliver strong impact relative to current systems.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS1982

Contrast reduction by the atmosphere and retrieval of nonuniform surface reflectance

A radiative transfer model is developed which gives the upward radiance at nadir for any 1-D Lambertian surface reflectance. This model is used to depict the atmospheric effect on the transmittance of contrast for any 1-D surface reflectance. Here by contrast we mean a general variation of the radiation field across the image. With the aid of this model an inversion algorithm is developed for retrieval of true surface reflectance from high resolution satellite data (e.g., Landsat). This inversion technique can be a useful tool for extraction of surface reflectance from satellite data in the case of a surface reflectance variable in one dimension only (e.g., seashore or near borders of big fields). A sensitivity study of the inversion procedure on the knowledge of atmospheric parameters and sensor calibration was performed. It is shown that this inversion technique is stable even in the presence of errors in the sensor calibration and the atmospheric parameters. The method was applied to Landsat data in two wavelengths. The results show reasonable dependence of the derived surface reflectance on the distance from the seashore.

Mekler, Y.↗
NASA NTRS2003

Multiple-etalon systems for the Advanced Technology Solar Telescope

Multiple etalon systems are discussed that meet the science requirements for a narrow-passband imaging system for the 4-meter National Solar Observatory (NSO)/Advance Technology Solar Telescope (ATST). A multiple etalon system can provide an imaging interferometer that works in four distinct modes: as a spectro-polarimeter, a filter-vector magnetograph, an intermediate-band imager, and broadband high-resolution imager. Specific dual and triple etalon configurations are described that provide a spectrographic passband of 2.0-3.5 micron and reduce parasitic light levels to 10(exp -4) as required for precise polarization measurement, e.g., Zeeman measurements of magnetic sensitive lines. A TESOS-like (Telecentric Etalon SOlar Spectrometer) triple etalon system provides a spectral purity of 10(exp -5). The triple designs have the advantage of reducing the finesse requirement on each etalon; allow the use of more stable blocking filters, and have very high spectral purity. A dual-etalon double-pass (Cavallini-like) system can provide a competing configuration. Such a dual-etalon design can provide high contrast. The selection of the final focal plane instrument will depend on a trade-off between an ideal instrument and practical reality. The trade study will include the number of etalons, their aperture sizes, complexities of the optical train, number of blocking filters, configuration of the electronic control system, computer interfaces, temperature controllers, etalon controllers, and their associated feedback electronics. The heritage of single and multiple etalon systems comes from their use in several observatories, including the Marshall Space Flight Center (MSFC) Solar Observatory, Sacramento Peak Observatory (NSO), and Kiepenheuer-Institut fur Sonnenphysik (KIS, Germany), Mees Solar Observatory (University of Hawaii), and Arcetri Astrophysical Observatory (Italy). The design of the ATST multiple etalon system will benefit from the experience gained at these observatories.

Gary, G. Allen↗
DOE OSTI2021

SO3/H2SO4 continuous real-time sensor demonstration at a power plant

We present results from field testing of a new, innovative sensor developed to measure SO3/H2SO4 continuously and in real time at a coal-fired power plant. The system utilizes the sensitivity, specificity, and real-time capabilities of mid-infrared (Mid-IR) laser-based sensor technology, along with a heated, close-coupled cell mounted directly to a power plant duct. Measurements were made by the laser sensor over a 2-day period and compared to results from the accepted method, EPA 8A, which requires a 30-minute collection, labor intensive processing, and off-site analysis at a lab. In contrast to the condensation method, the laser sensor continuously samples flue gas and reports measurements of the concentration of SO3/H2SO4, SO2 ever second with unattended operation. This initial demonstration proved the sensor concept and paves the way for its use for optimizing sorbent injection used to neutralize SO3/H2SO4. Optimized sorbent injection will enable significant cost savings associated with efforts to mitigate the presence and effects of SO3/H2SO4 such as “Blue Plume”, air heater fouling, and duct corrosion. In particular, the real-time, actionable information will enable better control of additive injection in flex conditions and variable fuels.

20 FOSSIL-FUELED POWER PLANTS↗
DOE OSTI2023

Probing three-dimensional mesoscopic interfacial structures in a single view using multibeam X-ray coherent surface scattering and holography imaging

Abstract Visualizing surface-supported and buried planar mesoscale structures, such as nanoelectronics, ultrathin-film quantum dots, photovoltaics, and heterogeneous catalysts, often requires high-resolution X-ray imaging and scattering. Here, we discovered that multibeam scattering in grazing-incident reflection geometry is sensitive to three-dimensional (3D) structures in a single view, which is difficult in conventional scattering or imaging approaches. We developed a 3D finite-element-based multibeam-scattering analysis to decode the heterogeneous electric-field distribution and to faithfully reproduce the complex scattering and surface features. This approach further leads to the demonstration of hard-X-ray Lloyd’s mirror interference of scattering waves, resembling dark-field, high-contrast surface holography under the grazing-angle scattering conditions. A first-principles calculation of the single-view holographic images resolves the surface patterns’ 3D morphology with nanometer resolutions, which is critical for ultrafine nanocircuit metrology. The holographic method and simulations pave the way for single-shot structural characterization for visualizing irreversible and morphology-transforming physical and chemical processes in situ or operando .

47 OTHER INSTRUMENTATION↗
DOE OSTI2015

Femtosecond stimulated Raman spectroscopy by six-wave mixing

Femtosecond Stimulated Raman Spectroscopy (FSRS) is motivated by the knowledge of the molecular geometry changes that accompany sub-picosecond chemical reactions. The detection of vibrational resonances throughout the entire fingerprint region of the spectrum with sub-100-fs delay precision is fairly straightforward to accomplish with the FSRS technique. Despite its utility, FSRS must contend with substantial technical challenges that stem from a large background of residual laser light and lower-order nonlinearities when all laser pulses are electronically resonant with the equilibrium system. In this work, a geometry based on five incident laser beams is used to eliminate much of this undesired background in experiments conducted on metmyoglobin. Compared to a three-beam FSRS geometry with all electronically resonant laser pulses, the five-beam approach described here offers major improvements in the data acquisition rate, sensitivity, and background suppression. The susceptibility of the five-beam geometry to experimental artifacts is investigated using control experiments and model calculations. Of particular concern are undesired cascades of third-order nonlinearities, which are known to challenge FSRS measurements carried out on electronically off-resonant systems. It is generally understood that “forbidden” steps in the desired nonlinear optical processes are the origin of the problems encountered under off-resonant conditions. In contrast, the present experiments are carried out under electronically resonant conditions, where such unfortunate selection rules do not apply. Nonetheless, control experiments based on spectroscopic line shapes, signal phases, and sample concentrations are conducted to rule out significant contributions from cascades of third-order processes. Theoretical calculations are further used to estimate the relative intensities of the direct and cascaded responses. Overall, the control experiments and model calculations presented in this work suggest promise for multidimensional resonance Raman investigations of heme proteins.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2018

Enhanced gel formation in binary mixtures of nanocolloids with short-range attraction

Colloidal suspensions transform between fluid and disordered solid states as parameters such as the colloid volume fraction and the strength and nature of the colloidal interactions are varied. Seemingly subtle changes in the characteristics of the colloids can markedly alter the mechanical rigidity and flow behavior of these soft composite materials. This sensitivity creates both a scientific challenge and an opportunity for designing suspensions for specific applications. In this paper, we report a novel mechanism of gel formation in mixtures of weakly attractive nanocolloids with modest size ratio. Employing a combination of x-ray photon correlation spectroscopy, rheometry, and molecular dynamics simulations, we find that gels are stable at remarkably weaker attraction in mixtures with size ratio near two than in the corresponding monodisperse suspensions. In contrast with depletion-driven gelation at larger size ratio, gel formation in the mixtures is triggered by microphase demixing of the species into dense regions of immobile smaller colloids surrounded by clusters of mobile larger colloids that is not predicted by mean-field thermodynamic considerations. These results point to a new route for tailoring nanostructured colloidal solids through judicious combination of interparticle interaction and size distribution.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Assessing the sensitivity of aerosol mass budget and effective radiative forcing to horizontal grid spacing in E3SMv1 using a regional refinement approach

Abstract. Atmospheric aerosols have important impacts on air quality and the Earth–atmospheric energy balance. However, as computing power is limited, Earth system models generally use coarse spatial grids and parameterize finer-scale atmospheric processes. These parameterizations and the simulation of atmospheric aerosols are often sensitive to model horizontal resolutions. Understanding the sensitivities is necessary for the development of Earth system models at higher resolutions with the deployment of more powerful supercomputers. Using the Energy Exascale Earth System Model (E3SM) version 1, this study investigates the impact of horizontal grid spacing on the simulated aerosol mass budget, aerosol–cloud interactions, and the effective radiative forcing of anthropogenic aerosols (ERFaer) over the contiguous United States. We examine the resolution sensitivity by comparing the nudged simulation results for 2016 from the low-resolution model (LR) and the regional refinement model (RRM). As expected, the simulated emissions of natural dust, sea salt, and marine organic matter are substantially higher in the RRM than in the LR. In addition, RRM simulates stronger aqueous-phase production of sulfate through the enhanced oxidation of sulfur dioxide by hydrogen peroxide due to increased cloud liquid water content. In contrast, the gas-phase chemical production of sulfate is slightly suppressed. The RRM resolves more large-scale precipitation and produces less convective precipitation than the LR, leading to increased (decreased) aerosol wet scavenging by large-scale (convective) precipitation. Regarding aerosol effects on clouds, RRM produces larger temporal variabilities in the large-scale liquid cloud fractions than LR, resulting in increased microphysical cloud processing of aerosols (more interstitial aerosols are converted to cloud-borne aerosols via aerosol activation) in RRM. Water vapor condensation is also enhanced in RRM compared to LR. Consequently, the RRM simulation produces more cloud droplets, a larger cloud droplet radius, a higher liquid water path, and a larger cloud optical depth than the LR simulation. A comparison of the present-day and pre-industrial simulations indicates that, for this contiguous United States domain, the higher-resolution increases ERFaer at the top of the model by about 12 %, which is mainly attributed to the strengthened indirect effect associated with aerosol–cloud interactions.

54 ENVIRONMENTAL SCIENCES↗
NASA NTRS1977

Unsteady linearized transonic flow analysis for slender bodies

An unsteady linearized formulation based on Oswatitsch-Keune's parabolic method is developed to analyze transonic flow past oscillating slender bodies. In contrast to the widely used integral transform method, it is shown that all solutions can be derived by a simpler method directly in the physical plane. By various expansion procedures, low-frequency solutions then are derived according to two clearly defined frequency ranges. Adams-Sears' iteration is employed to account for the second-order effects. Stability derivatives are compared with available theories and data. It is found that the derivatives depend more sensitively on thickness than on the reduced frequency. Finally, a critical assessment of the present method is given.

Liu, D. D.↗
NASA NTRS1987

The frequency of enhanced star formation in interacting and isolated galaxies

To probe the sensitivity of the star formation rate and extent in galaxies to gravitational encounters, ground based near and mid-infrared and IRAS far-infrared measurements of complete samples of isolated and interacting pairs of galaxies were obtained. The observed infrared properties of the isolated galaxies are used to gauge the magnitude of star formation in galaxies free from external influences, and to define the relationships between morphological type and infrared luminosity. These properties were contrasted with those of the interacting sample to examine the extent to which interactions can enhance or alter the nature of star formation. The mechanisms by which interactions influence activity such as star formation are investigated through correlations of the infrared characteristics with radio and optical measurements, and with morphological and physical parameters such as galaxy types, separations, encounter velocities and interaction types. Limits to the physical extent of the star formation are obtained by comparing the large aperture measurements of IRAS with the small aperture ground based photometry.

Cutri, Roc M.↗
NASA NTRS2011

Blur Clarified: A review and Synthesis of Blur Discrimination

Blur is an important attribute of human spatial vision, and sensitivity to blur has been the subject of considerable experimental research and theoretical modeling. Often these models have invoked specialized concepts or mechanisms, such as intrinsic blur, multiple channels, or blur estimation units. In this paper we review the several experimental studies of blur discrimination and find they are in broad empirical agreement. But contrary to previous modeling efforts, we find that the essential features of blur discrimination are fully accounted for by a visible contrast energy model (ViCE), in which two spatial patterns are distinguished when the integrated difference between their masked local contrast energy responses reaches a threshold value.

Watson, Andrew B.↗