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At least 973 records · Page 54

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DOE OSTI2021

CO2ROpt (Feedstock Allocation Optimization Model) [SWR-22-13]

Reducing greenhouse gas emissions remains a critical challenge for the transportation and chemical sectors. The electrochemical reduction of carbon dioxide is a potential pathway for production of fuels and chemicals that uses atmospheric carbon dioxide as a feedstock. Here we present an analysis of the potential for carbon dioxide captured from point sources and via direct air capture to be utilized in electrochemical reduction under different market scenarios. Using a numerical optimization framework and national data sets, scenarios for nationwide production of ethylene, formate, and carbon monoxide are evaluated at scales comparable to current production of these molecules in the United States. We show that developing a network for production of these products at scale requires capture and utilization of significant portions of the carbon dioxide that is currently emitted from large stationary point sources. Because carbon dioxide point sources are spatially and compositionally variable, their use for carbon dioxide reduction depends on electricity prices, capture cost, and location. If the power sector in the United States is decarbonized, carbon dioxide supply decreases significantly, increasing the importance of utilizing other carbon dioxide streams, and increasing the likelihood that direct air capture plays a role in supplying carbon dioxide feedstocks. These findings provide a first insight into the feedstock and energy constraints for carbon dioxide reduction.

Badgett, Alex↗

DOE OSTI2026

Multiscale Cryo Electron Microscopy Reveals Interfacial Degradation and Stabilization in Battery Electrodes

Electrochemical interfaces are dynamic systems, evolving based on their local environment and reactant surface structures. The electrode-electrolyte interface in Li-ion batteries can be protective, limiting parasitic reactions with the electrolyte to passivate the surface [1]. Additionally, this interphase has an impact on the Li-ion transport through that layer based on its composition, bonding environment, and thickness. These parameters are challenging to collect and may vary depending on the electrode surface site investigated relative to its spatial position in a coin cell. This study will detail a multiscale cryogenic electron microscopy approach where millimeter-scale cross-sections through the coin cell batteries were made using a cryogenic stage within a fs-laser plasma focused ion beam (laser PFIB) with complementary energy dispersive X-ray spectroscopy able to detect variations in the composition at electrode interfaces [2]. Microscale cross-sectioning and lamella sample preparation of battery electrodes was conducted at the Center for Integrated Nanotechnologies using a Ga-ion focused ion beam (FIB) with air-free and cryo-transfer [3], followed by nanoscale mapping of composition and bonding within the CEI through cryo-scanning transmission electron microscopy (cryo-STEM) electron energy loss spectroscopy [4]. This multiscale approach enabled identification of millimeter-scale features of a battery stack with visualization of degradation in electrodes such as cracks in cathode particles, gas evolution, and SEI evolution; microscale interfacial characteristics, such as heterogeneity in the SEI or barrier layer and identification of electrolyte networks to the electrode surfaces; and nanoscale measurement of the CEI thickness, mapping of transition metal bonding within the cathode particles to identify loss of active materials, and identification of beneficial electrolyte additives incorporated into the CEI structure. This multiscale approach allows for a statistical understanding of the primary mechanisms and parasitic degradation pathways that impact performance by limiting the ion transport pathways within Li+ batteries.

36 MATERIALS SCIENCE↗

DOE OSTI2026

Warped and Hooked: Mapping the Magellanic Clouds in Three Dimensions Using Red Clump Stars

The Large Magellanic Cloud (LMC) and Small Magellanic Cloud (SMC) are the Milky Way’s nearest interacting galaxy pair, offering a unique laboratory for studying tidal effects on galactic disks. Despite extensive survey efforts, the 3D geometry of the Magellanic Clouds, particularly the putative warp of the LMC, remains poorly constrained due to incompleteness in their crowded centers and the low stellar density of their peripheries, which demand wide-field coverage. Using red clump (RC) stars as standard candles, corrected for age- and metallicity-dependent population effects with empirically calibrated color–magnitude relations and spatially resolved star formation histories, we construct the most detailed distance map of the Magellanic system to date. Based on ∼2.3 million RC stars from Gaia Data Release 3 combined with modern reddening maps, we measure median heliocentric distances of 50.62 ± 2.32 kpc for the LMC (to ∼23°) and 60.75 ± 2.85 kpc for the SMC (to ∼12°). The maps reveal substructures including the LMC Northern Arm, southern hooks, the Magellanic Bridge, and SMC peripheral overdensities, with refreshed distance estimates. Fitting the LMC disk within 7° yields a global inclination of $i=25\mathop{.}\limits^{^\circ }32\pm 0\mathop{.}\limits^{^\circ }10$ and a line-of-nodes position angle of $\theta = 142\mathop{.}\limits^{^\circ }34\pm 0\mathop{.}\limits^{^\circ }21$. Most strikingly, we find the LMC periphery is warped azimuthally into a U-shaped structure reaching a vertical amplitude of ∼7 kpc at a radius of ∼15 kpc. In future work, we will perform detailed comparisons with live N-body simulations to assess possible formation scenarios for the LMC warp.

79 ASTRONOMY AND ASTROPHYSICS↗

NASA NTRS1987

Energetic particle acceleration in spherically symmetric accretion flows and shocks

Steady state, spherically symmetric solutions of the cosmic-ray transport equation describing the acceleration of energetic particles in galactic accretion flows onto neutron stars, black holes, white dwarfs, and protostars are studied. The results indicate that astrophysical accretion flows can be partitioned into distinct classes depending upon whether the accretion rate lies above or below a critical value of a few times 10 to the -7th stellar masses/yr. When the particle transport is convection-dominated, both classes of accretion flows exhibit a spectral index appropriate for first-order Fermi acceleration at a plane shock in the absence of losses. As the particle transport becomes diffusion-dominated, both classes show a break and precipitous falloff in the particle spectrum due to the escape of these particles from the accretion flow. The precise nature of the spectrum depends on the relationship between the particle momentum and the spatial diffusion coefficient.

Webb, G. M.↗

NASA NTRS1989

Stability of compressible boundary layers

The stability of compressible 2-D and 3-D boundary layers is reviewed. The stability of 2-D compressible flows differs from that of incompressible flows in two important features: There is more than one mode of instability contributing to the growth of disturbances in supersonic laminar boundary layers and the most unstable first mode wave is 3-D. Whereas viscosity has a destabilizing effect on incompressible flows, it is stabilizing for high supersonic Mach numbers. Whereas cooling stabilizes first mode waves, it destabilizes second mode waves. However, second order waves can be stabilized by suction and favorable pressure gradients. The influence of the nonparallelism on the spatial growth rate of disturbances is evaluated. The growth rate depends on the flow variable as well as the distance from the body. Floquet theory is used to investigate the subharmonic secondary instability.

Nayfeh, Ali H.↗

NASA NTRS1989

Combined first and second order Fermi acceleration at comets

Two-dimensional, time-dependent model calculations indicate that an interplay between velocity and spatial diffusion may be responsible for the acceleration of implanted heavy ions in the cometary preshock region. Velocity diffusion (second order Fermi acceleration) accelerates the pickup ions to moderate energies thus creating a seed population for the more efficient diffusive-compressive shock acceleration. Solar wind convection limits the time available for diffusive-compressive acceleration, therefore the resulting energy spectrum above 100 keV is a power law with a spectral index of 5 - 6, a value which is in reasonably good agreement with observations.

Gombosi, T. I.↗

NASA NTRS1992

Direct numerical simulations of a spatially developing plane wake

In the present paper, direct numerical methods by which to simulate the spatially developing free shear flows in the transitional region are described and the numerical results of a spatially developing plane wake are presented. The incompressible time-dependent Navier-Stokes equations were solved using Pade finite difference approximations in the streamwise direction, a mapped pseudospectral Fourier method in the cross-stream direction, and a third-order compact Runge-Kutta scheme for time advancement. The unstable modes of the Orr-Sommerfeld equations were used to perturb the inlet of the wake. Statistical analyses were performed and some numerical results were compared with experimental measurements. When only the fundamental mode is forced, the energy spectra show amplification of the fundamental and its higher harmonics. In this case, unperturbed alternate vortices develop in the saturation region of the wake. The phase jitter around the fundamental frequency plays a critical role in generating vortices of random shape and spacing. Large- and small-scale distortions of the fundamental structure are observed. Pairing of vortices of the same sign is observed, as well as vortex coupling of vortices of the opposite sign.

Maekawa, Hiroshi↗

NASA NTRS1990

Instantaneous velocity field measurement of objects in coaxial rotation using digital image velocimetry

The instantaneous velocity fields of time-dependent flows, or of a collection of objects moving with spatially varying velocities, can be measured by means of digital image velocimetry (DIV). DIV overcomes several shortcomings of such existing techniques as laser-speckle or particle-image velocimetry. Attention is presently given to numerically generated images representing objects in uniform motion which are then used for the experimental validation of DIV.

Cho, Y.-C.↗

NASA NTRS1995

Failure models for textile composites

The goals of this investigation were to: (1) identify mechanisms of failure and determine how the architecture of reinforcing fibers in 3D woven composites controlled stiffness, strength, strain to failure, work of fracture, notch sensitivity, and fatigue life; and (2) to model composite stiffness, strength, and fatigue life. A total of 11 different angle and orthogonal interlock woven composites were examined. Composite properties depended on the weave architecture, the tow size, and the spatial distributions and strength of geometrical flaws. Simple models were developed for elastic properties, strength, and fatigue life. A more complicated stochastic model, called the 'Binary Model,' was developed for damage tolerance and ultimate failure. These 3D woven composites possessed an extraordinary combination of strength, damage tolerance, and notch insensitivity.

Cox, Brian↗

NASA NTRS2000

Global Analysis of the Effects of Dust on the Photodissociation Rates

Aerosols scatter and absorb UV radiation and consequently either enhance or reduce the actinic fluxes and photolysis rates. Mineral dust particles are known to absorb UV radiation, but the impact on the photolysis rates is complicated by the optical properties dependency on the particle size, composition and wavelength. The high spatial and temporal variabilities of the dust size distribution add difficulties to the global analysis. The Georgia Tech/Goddard Global Ozone Chemistry Aerosol Radiation and Transport (GOCART) model has been used to simulate several years of the global distribution of mineral dust in the troposphere. The optical parameters (extinction efficiency, single scattering albedo and asymmetry parameter) of the seven particle sizes (from 0.1 to 5 microns), transported by the model, have been inserted in the Tropospheric Ultraviolet-Visible (TUV) radiation model version 4. The photodissociation rates of J(N02) and J(03 to O(1D)) have been calculated with TUV-4 with and without dust particles on the global scale. The effects of dust on J(N02) and J(03) will be analyzed with an emphasis on the difference between major dust sources in Africa and Asia.

Ginoux, Paul↗

NASA NTRS2001

Three-Dimensional Aerodynamic Instabilities In Multi-Stage Axial Compressors

This thesis presents the conceptualization and development of a computational model for describing three-dimensional non-linear disturbances associated with instability and inlet distortion in multistage compressors. Specifically, the model is aimed at simulating the non-linear aspects of short wavelength stall inception, part span stall cells, and compressor response to three-dimensional inlet distortions. The computed results demonstrated the first-of-a-kind capability for simulating short wavelength stall inception in multistage compressors. The adequacy of the model is demonstrated by its application to reproduce the following phenomena: (1) response of a compressor to a square-wave total pressure inlet distortion; (2) behavior of long wavelength small amplitude disturbances in compressors; (3) short wavelength stall inception in a multistage compressor and the occurrence of rotating stall inception on the negatively sloped portion of the compressor characteristic; (4) progressive stalling behavior in the first stage in a mismatched multistage compressor; (5) change of stall inception type (from modal to spike and vice versa) due to IGV stagger angle variation, and "unique rotor tip incidence" at these points where the compressor stalls through short wavelength disturbances. The model has been applied to determine the parametric dependence of instability inception behavior in terms of amplitude and spatial distribution of initial disturbance, and intra-blade-row gaps. It is found that reducing the inter-blade row gaps suppresses the growth of short wavelength disturbances. It is also concluded from these parametric investigations that each local component group (rotor and its two adjacent stators) has its own instability point (i.e. conditions at which disturbances are sustained) for short wavelength disturbances, with the instability point for the compressor set by the most unstable component group. For completeness, the methodology has been extended to describe finite amplitude disturbances in high-speed compressors. Results are presented for the response of a transonic compressor subjected to inlet distortions.

Tan, Choon S.↗

NASA NTRS2002

Tidal Dissipation in Mercury

The spatial pattern and total inventory of tidal dissipation within Mercury depends sensitively on internal structure and on orbital eccentricity. Surface heat flow from this source may exceed 3 mW/sq m, and will vary with time as the orbital eccentricity fluctuates. Additional information is contained in the original extended abstract.

Bills, B. G.↗

NASA NTRS2000

Diversity and regulation of plant Ca2+ pumps: insights from expression in yeast

The spatial and temporal regulation of calcium concentration in plant cells depends on the coordinate activities of channels and active transporters located on different organelles and membranes. Several Ca2+ pumps have been identified and characterized by functional expression of plant genes in a yeast mutant (K616). This expression system has opened the way to a genetic and biochemical characterization of the regulatory and catalytic features of diverse Ca2+ pumps. Plant Ca(2+)-ATPases fall into two major types: AtECA1 represents one of four or more members of the type IIA (ER-type) Ca(2+)-ATPases in Arabidopsis, and AtACA2 is one of seven or more members of the type IIB (PM-type) Ca(2+)-ATPases that are regulated by a novel amino terminal domain. Type IIB pumps are widely distributed on membranes, including the PM (plasma membrane), vacuole, and ER (endoplasmic reticulum). The regulatory domain serves multiple functions, including autoinhibition, calmodulin binding, and sites for modification by phosphorylation. This domain, however, is considerably diverse among several type IIB ATPases, suggesting that the pumps are differentially regulated. Understanding of Ca2+ transporters at the molecular level is providing insights into their roles in signaling networks and in regulating fundamental processes of cell biology.

Review, Academic↗

NASA NTRS2009

The a(4) Scheme-A High Order Neutrally Stable CESE Solver

The CESE development is driven by a belief that a solver should (i) enforce conservation laws in both space and time, and (ii) be built from a nondissipative (i.e., neutrally stable) core scheme so that the numerical dissipation can be controlled effectively. To provide a solid foundation for a systematic CESE development of high order schemes, in this paper we describe a new high order (4-5th order) and neutrally stable CESE solver of a 1D advection equation with a constant advection speed a. The space-time stencil of this two-level explicit scheme is formed by one point at the upper time level and two points at the lower time level. Because it is associated with four independent mesh variables (the numerical analogues of the dependent variable and its first, second, and third-order spatial derivatives) and four equations per mesh point, the new scheme is referred to as the a(4) scheme. As in the case of other similar CESE neutrally stable solvers, the a(4) scheme enforces conservation laws in space-time locally and globally, and it has the basic, forward marching, and backward marching forms. Except for a singular case, these forms are equivalent and satisfy a space-time inversion (STI) invariant property which is shared by the advection equation. Based on the concept of STI invariance, a set of algebraic relations is developed and used to prove the a(4) scheme must be neutrally stable when it is stable. Numerically, it has been established that the scheme is stable if the value of the Courant number is less than 1/3

Chang, Sin-Chung↗

NASA NTRS2022

The Contribution of Planetary Period Oscillations Toward Circulation and Mass Loss in Saturn's Magnetosphere

Magnetic reconnection is a process during which magnetic energy is released as kinetic energy. It is considered a crucial driver of energy transport and mass loss within Saturn's magnetosphere. On longterm timescales, is thought to be predominantly driven by the rapid rotation of equatorially mass-loaded flux tubes (i.e., the Vasyliunas cycle), but there is some non-negligible driving from the solar wind as well (i.e., the Dungey cycle). In this study, we investigate an atmospheric driven phenomenon that modulates Saturn's magnetosphere every ∼10.6–10.8 hr, known as planetary period oscillations (PPOs), as an additional driver of magnetic reconnection at Saturn. Using an empirical model of PPO dynamics and Cassini magnetic field and plasma measurements, we find that PPO-driven magnetic reconnection is likely to occur in Saturn's magnetosphere, however, the occurrence of the phenomenon depends on temporally variable characteristics of the PPO systems and spatial asymmetries within Saturn's equatorial magnetosphere. Thus, it is not expected to be an on-going process. On year-long timescales, we find that PPOs are expected to be on par with the Dungey Cycle in driving circulation within Saturn's magnetosphere. However, on ∼1–2 weeks-long timescales, under specific conditions where PPO-driven reconnection is expected to be active, this phenomenon can become more significant than the Vasyliunas cycle, and thus dominate circulation within Saturn's magnetosphere. On year-long timescales, this process is estimated to remove upwards of ∼20% of the mass loaded into the magnetosphere by Enceladus.

O. Agiwal↗

DOE OSTI2024

Light-driven nanoscale vectorial currents

Controlled charge flows are fundamental to many areas of science and technology, serving as carriers of energy and information, as probes of material properties and dynamics and as a means of revealing or even inducing broken symmetries. Emerging methods for light-based current control offer particularly promising routes beyond the speed and adaptability limitations of conventional voltage-driven systems. However, optical generation and manipulation of currents at nanometre spatial scales remains a basic challenge and a crucial step towards scalable optoelectronic systems for microelectronics and information science. Here we introduce vectorial optoelectronic metasurfaces in which ultrafast light pulses induce local directional charge flows around symmetry-broken plasmonic nanostructures, with tunable responses and arbitrary patterning down to subdiffractive nanometre scales. Local symmetries and vectorial currents are revealed by polarization-dependent and wavelength-sensitive electrical readout and terahertz (THz) emission, whereas spatially tailored global currents are demonstrated in the direct generation of elusive broadband THz vector beams 17 . We show that, in graphene, a detailed interplay between electrodynamic, thermodynamic and hydrodynamic degrees of freedom gives rise to rapidly evolving nanoscale driving forces and charge flows under the extremely spatially and temporally localized excitation. These results set the stage for versatile patterning and optical control over nanoscale currents in materials diagnostics, THz spectroscopies, nanomagnetism and ultrafast information processing.

36 MATERIALS SCIENCE↗

DOE OSTI2021

A parameterization of sub-grid topographical effects on solar radiation in the E3SM Land Model (version 1.0): implementation and evaluation over the Tibetan Plateau

Abstract. Topography exerts significant influences on the incoming solar radiation at the land surface. A few stand-alone regional and global atmospheric models have included parameterizations for sub-grid topographic effects on solar radiation. However, nearly all Earth system models (ESMs) that participated in the Coupled Model Intercomparison Project (CMIP6) use a plane-parallel (PP) radiative transfer scheme that assumes that the terrain is flat. In this study, we incorporated a well-validated sub-grid topographic (TOP) parameterization in the Energy Exascale Earth System Model (E3SM) Land Model (ELM) version 1.0 to quantify the effects of sub-grid topography on solar radiation flux, including the shadow effects and multi-scattering between adjacent terrain. We studied the role of sub-grid topography by performing ELM simulations with the PP and TOP schemes over the Tibetan Plateau (TP). Additional ELM simulations were performed at multiple spatial resolutions to investigate the role of spatial scale on sub-grid topographic effects on solar radiation. The Moderate Resolution Imaging Spectroradiometer (MODIS) data was used to compare with the ELM simulations. The results show that topography has non-negligible effects on surface energy budget, snow cover, snow depth, and surface temperature over the TP. The absolute differences in surface energy fluxes for net solar radiation, latent heat flux, and sensible heat flux between TOP and PP exceed 20, 10, and 5 W m−2, respectively. The differences in land surface albedo, snow cover fraction, snow depth, and surface temperature between TOP and PP exceed 0.1, 0.1, 10 cm, and 1 K, respectively. The magnitude of the sub-grid topographic effects is dependent on seasons and elevations and is also sensitive to the spatial scales. Although the sub-grid topographic effects on solar radiation are larger with more spatial details at finer spatial scales, they cannot be simply neglected at coarse spatial scales. When compared to MODIS data, incorporating the sub-grid topographic effects overall reduces the biases of ELM in simulating surface energy balance, snow cover, and surface temperature, especially in the high-elevation and snow-covered regions over the TP. The inclusion of sub-grid topographic effects on solar radiation parameterization in ELM will contribute to advancing our understanding of the role of the surface topography on terrestrial processes over complex terrain.

Hao, Dalei (ORCID:0000000334979774)↗

NASA NTRS2013

Estimating Ground-Level PM(sub 2.5) Concentrations in the Southeastern United States Using MAIAC AOD Retrievals and a Two-Stage Model

Previous studies showed that fine particulate matter (PM(sub 2.5), particles smaller than 2.5 micrometers in aerodynamic diameter) is associated with various health outcomes. Ground in situ measurements of PM(sub 2.5) concentrations are considered to be the gold standard, but are time-consuming and costly. Satellite-retrieved aerosol optical depth (AOD) products have the potential to supplement the ground monitoring networks to provide spatiotemporally-resolved PM(sub 2.5) exposure estimates. However, the coarse resolutions (e.g., 10 km) of the satellite AOD products used in previous studies make it very difficult to estimate urban-scale PM(sub 2.5) characteristics that are crucial to population-based PM(sub 2.5) health effects research. In this paper, a new aerosol product with 1 km spatial resolution derived by the Multi-Angle Implementation of Atmospheric Correction (MAIAC) algorithm was examined using a two-stage spatial statistical model with meteorological fields (e.g., wind speed) and land use parameters (e.g., forest cover, road length, elevation, and point emissions) as ancillary variables to estimate daily mean PM(sub 2.5) concentrations. The study area is the southeastern U.S., and data for 2003 were collected from various sources. A cross validation approach was implemented for model validation. We obtained R(sup 2) of 0.83, mean prediction error (MPE) of 1.89 micrograms/cu m, and square root of the mean squared prediction errors (RMSPE) of 2.73 micrograms/cu m in model fitting, and R(sup 2) of 0.67, MPE of 2.54 micrograms/cu m, and RMSPE of 3.88 micrograms/cu m in cross validation. Both model fitting and cross validation indicate a good fit between the dependent variable and predictor variables. The results showed that 1 km spatial resolution MAIAC AOD can be used to estimate PM(sub 2.5) concentrations.

aerosol optical depth↗