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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 73 records · Page 4
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

Investigating the Impacts of Daytime Boundary Layer Clouds on Surface Energy Fluxes and Boundary Layer Structure During CHEESEHEAD19

Studies of land-atmosphere interactions under a clear sky and low cumulus cloud conditions are common from long-term observatories like at the southern great plains. How well the relationships and responses of surface radiative and turbulent heat fluxes determined from these investigations hold for more heterogeneous surfaces in other climate regimes, however, is uncertain. In this study, detailed observations of the surface energy budget and daytime boundary layer properties are analyzed using measurements from the Chequamegon Heterogenous Ecosystem Energy-Balance Study Enabled by a High-Density Extensive Array of Detectors 2019 (CHEESEHEAD19) field campaign, July-October 2019, across a heterogeneous forested landscape of northern Wisconsin. A cloud regime framework is employed to classify consecutive periods of clear skies from lower atmosphere stratiform and cumulus clouds. A seasonal transition from low cumulus to low stratiform periods occurred, together with a diurnal pattern in cloudy or clear sky period dominance. Radiative forcing was highly dependent on sky conditions, leading to changes in the redistribution efficiency of radiative energy by the surface turbulent heat fluxes. During CHEESEHEAD19, small Bowen ratios dominated with daytime latent heat fluxes three times as large as sensible heat fluxes for all sky conditions studied; the forested region, therefore, falls within an energy-limited regime. The depth of the daytime mixed layer depended upon the sky condition and thermodynamic setting; deeper mixed layers occurred during periods of low cumulus and not clear skies. Profiles of vertical velocity were found to have enhanced variance under low cumulus compared to clear sky periods, suggesting potential for cloud feedbacks on boundary layer structure and surface energy fluxes.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2015

Synthesis and electrochemical properties of layered structure Li[Ni{sub 0.5}Co{sub 0.25}Mn{sub 0.25}]O{sub 2} cathode material

Lithium ion (Li-ion) batteries are currently the energy source of choice for cell phones, laptops, and other mobile electronic devices due to their balance of high energy density with high power density compared to other electrochemical energy carriers. In the present study, mixed hydroxide method is used to prepare Li[Ni{sub 0.5}Co{sub 0.25}Mn{sub 0.25}]O{sub 2} from the precursors and analyze qualitatively and studied the electrochemical properties. The XRD spectrum exhibited predominant (003) orientation at 2θ =18.39{sup o} corresponding to hexagonal layered structure of R3m symmetry with evaluated lattice parameters are a= 2.84 Å, c= 14.43 Å. Raman measurements were performed to understand the microstructure and vibrational modes of the prepared sample. From the electrochemical (EC) studies an initial discharge capacity of about 140 mAhg{sup −1} with good cyclic stability was observed for the prepared sample in the potential range 0.0 −1.0V in aqueous medium.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

An Optical Differentiator Based on a Three-Layer Structure with a W-Shaped Refractive Index Profile

An optical differentiator based on a three-layer resonant structure with a W-shaped refractive index profile is proposed. The differentiation operation is performed in reflection and is associated with the resonant excitation of an eigenmode of the structure localized in the central layer. The presented results of numerical simulations demonstrate the possibility of spatial differentiation of the transverse profile of an incident optical beam, temporal differentiation of the envelope of an incident optical beam, and simultaneous spatial and temporal differentiation with a high quality. The proposed structure can find applications in designing analog optical computing and optical information processing systems.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2022

Layered structures of assembled imine-linked macrocycles and two-dimensional covalent organic frameworks give rise to prolonged exciton lifetimes

Ordered organic materials and assemblies have great potential to be tailored to have desirable properties for optoelectronic applications, such as long exciton lifetime and high directional exciton mobility. Framework materials, such as two-dimensional covalent organic frameworks (2D COFs), as well as their truncated macrocyclic analogues, are versatile platforms to organize functional aromatic systems into designed assemblies and robust materials. In this study we investigate the exciton dynamics in a 2D COF, its corresponding hexagonal macrocycle, and extended nanotubes comprised of stacked macrocycles. The excitonic behavior of these three systems provide an understanding of excitonic processes that occur in the plane of the covalently bonded 2D macromolecules and between layers of the nanotubes and 2D COF. The nanotube and analogous 2D COF exhibit longer excited-state lifetimes (~100 ps) compared to the individual, solvated macrocycles (<0.5 ps). These differences are attributed to the internal conversion facilitated by the internal motions of the imine linkages which are significantly reduced in the assembled macrocycles in the nanotube and 2D COF sheets in the layered structures. The exciton diffusion processes in the assembled nanotubes and 2D COF systems were characterized by the autocorrelations of the transition dipole moment of the excitons, giving the depolarization time constants for both systems to be ~1 ps. This work also reveals the anisotropic exciton dynamics related to the in-plane and inter-plane structural factors in these systems. These studies provide guidance for the design of future COF materials, where the longer excited state lifetimes imparted by assembly are beneficial for optoelectronic applications.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

Marine boundary layer structure as observed by A-train satellites

Abstract. The marine boundary layer (MBL) structure is important to the marine low cloud processes, and the exchange of heat, momentum, and moisture between oceans and the low atmosphere. This study examines the MBL structure over the eastern Pacific region and further explores the controlling factors of MBL structure over the global oceans with a new 4-year satellite-based data set. The MBL top (boundary layer height, BLH) and the mixing layer height (MLH) were identified using the MBL aerosol lidar backscattering from the CALIPSO (Cloud–Aerosol Lidar and Infrared Pathfinder Satellite Observations). Results showed that the MBL is generally decoupled with MLH ∕ BLH ratio ranging from ∼ 0.5 to ∼ 0.8 over the eastern Pacific Ocean region. The MBL decoupling magnitude is mainly controlled by estimated inversion strength (EIS), which in turn controls the cloud top entrainment process. The systematic differences between drizzling and non-drizzling stratocumulus tops also show dependence on EIS. This may be related to the meso-scale circulations or gravity wave in the MBL. Further analysis indicates that the MBL shows a similar decoupled structure for clear-sky and cumulus-cloud-topped conditions, but is better mixed under stratiform cloud breakup and overcast conditions.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2018

Waveguide Modes in a Planar Graphene–Dielectric Thin-Layer Structure

Particular features of waveguide propagation of modes in a planar structure that consists of alternating layers of a dielectric and graphene are investigated. Within the effective-medium approximation, dispersion relations are obtained for symmetric and antisymmetric waveguide modes. Based on their numerical analysis, the frequency dependences of the propagation and decay constants, of the group and phase velocities, and of the energy flux carried by waveguide modes are constructed. The influence of the fraction of graphene in the structure on the behavior of waveguide modes is analyzed.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2014

Enhancement of perpendicular magnetic anisotropy and transmission of spin-Hall-effect-induced spin currents by a Hf spacer layer in W/Hf/CoFeB/MgO layer structures

We report that strong perpendicular magnetic anisotropy of the ferromagnetic layer in a W/CoFeB/MgO multilayer structure can be established by inserting a Hf layer as thin as 0.25 nm between the W and CoFeB layers. The Hf spacer also allows transmission of spin currents generated by an in-plane charge current in the W layer to apply strong spin torque on the CoFeB, thereby enabling current-driven magnetic switching. The antidamping-like and field-like components of the spin torque exerted on a 1 nm CoFeB layer are of comparable magnitudes in this geometry. Both components originate from the spin Hall effect in the underlying W layer.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2025

Understanding the impact of the gas diffusion layer structure on catalyst utilization in the PEM water electrolyzer

A multiphysics half-cell model of a polymer electrolyte membrane water electrolyzer (PEMWE) was developed to probe impacts of the detailed 3-dimensional pore structure of the gas diffusion layer (GDL) on performance characteristics. We show that pores in the titanium GDL mesh led to significant underutilization of the catalyst layer (CL), with only 45% of the catalyst effectively utilized. This contradicts the assumption of uniform electron flow across the CL, as shown in graphical abstract (a), as near-zero current was observed near GDL pore regions and the current distribution in CL was influenced by GDL structure, as shown in graphical abstract (b). Instead, oxygen generation was primarily concentrated under the solid titanium regions, diffusing out around the pore walls. High current density peaks were also noted at the GDL-catalyst contact, correlating with degradation hotspots that were directly observed in companion experiments, as shown in graphical abstract (c). Collectively, these findings point to the critical importance of the heterogeneous GDL porous architecture not only for PEMWE efficiency but also for uneven degradation of the CL.

COMSOL↗
DOE OSTI2017

Reflection of light beams from a chirped dielectric plane-layered structure

The reflection of light beams with various widths of the angular spectrum from a chirped plane-layered dielectric structure is numerically studied. For wide beams, the total lateral shift of the reflected beam depends on the position of the photonic barrier inside the structure and the value of the Goos – Hänchen shift. For narrow beams, the region of the interaction with the structure increases, the profile broadens and the reflected beam wavefront becomes phase modulated. It is shown that the light reflected from a quasi-periodic structure with negative spatial dispersion undergoes focusing. (light beams)

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2014

Double injection, resonant-tunneling recombination, and current-voltage characteristics in double-graphene-layer structures

We evaluate the effect of the recombination associated with interlayer transitions in ungated and gated double-graphene-layer (GL) structures on the injection of electrons and holes. Using the proposed model, we derive analytical expressions for the spatial distributions of the electron and hole Fermi energies and the energy gap between the Dirac points in GLs as well as their dependences on the bias and gate voltages. The current-voltage characteristics are calculated as well. The model is based on hydrodynamic equations for the electron and hole transports in GLs under the self-consistent electric field. It is shown that in undoped double-GL structures with weak scattering of electrons and holes on disorder, the Fermi energies and the energy gap are virtually constant across the main portions of GLs, although their values strongly depend on the voltages and recombination parameters. In contrast, the electron and hole scattering on disorder lead to substantial nonuniformities. The resonant inter-GL tunneling enables N-shaped current-voltage characteristics provided that GLs are sufficiently short. The width of the current maxima is much larger than the broadening of the tunneling resonance. In the double-GL structures with relatively long GLs, the N-shaped characteristics transform into the Z-shaped characteristics. The obtained results are in line with the experimental observations [Britnell et al., Nat. Commun. 4, 1794–1799 (2013)] and might be useful for design and optimization of different devices based on double-GL structures, including field-effect transistors and terahertz lasers.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2022

Mechanochemically Assisted Synthesis of High-Entropy Layer-Structured Dittmarite Analogues

High-entropy solid-solution materials, especially layered ones incorporating five or more near-equimolar components into single-phase crystal structures, may spark functional synergism toward the electrochemistry area because of their unique antisite disordering structures and the synergistic effect of multiple active sites. Herein, high-entropy dittmarite analogues (HEDAs) were synthesized via a mechanochemistry-assisted hydrothermal method. Furthermore, the as-prepared HEDAs have single dittmarite phases with five homogeneously distributed metal elements, exhibiting enhanced activities in oxygen evolution catalysis compared to the single metal counterparts.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Synergetic effects of II-VI sensitization upon TiO{sub 2} for photoelectrochemical water splitting; a tri-layered structured scheme

World's energy demands are growing on a higher scale increasing the need of more reliable and long term renewable energy resources. Efficient photo-electrochemical (PEC) devices based on novel nano-structured designs for solar-hydrogen generation need to be developed. This study provides an insight of the tri-layered-TiO2 based nanostructures. Observing the mechanism of hydrogen production, the comparison of the structural order during the synthesis is pronounced. The sequence in the tri-layered structure affects the photogenerated electron (e{sup −}) and hole (h{sup +}) pair transfer and separation. It is also discussed that not only the semiconductors band gaps alignment is important with respect to the water redox potential but also the interfacial regions. Quasi-Fermi-level adjustment at the interfacial regions plays a key role in deciding the solar to hydrogen efficiency. More efficient multicomponent semiconductor nano-design (MCSN) could be developed with the approach given in this study.

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

Modification of wind turbine wakes by large-scale, convective atmospheric boundary layer structures

In this study, we consider the impact of large-scale, convective structures in an unstable atmospheric boundary layer on wind turbine wakes. Simulation data from a high-fidelity large-eddy simulation (LES) of the AWAKEN wind farm site matching unstable atmospheric conditions were analyzed, and both turbine performance and wake behavior were affected based on their location relative to the convective structures. Turbines located in updraft regions of the flow experienced lower inflow velocity and generated less power, but their wakes were observed to recover faster and saw greater turbulent kinetic energy mixing higher in the boundary layer. The opposite effect was found for turbines in the downdraft regions of the convective structures. A simplified model of this wake behavior was also developed based on a two-dimensional k–ε Reynolds-Averaged Navier–Stokes formulation. This simplified model included the effects of vertical transport, but could be efficiently solved as a parabolic system, and was found to capture similar wake modifications observed in the high-fidelity LES computations.

16 TIDAL AND WAVE POWER↗
DOE OSTI2017

Magnetically Controlled Tunneling of a TE Wave through the Ferrite—ε-Negative Layer Structure

We have considered the tunneling of a normally incident electromagnetic wave through a bilayer structure that consists of a ferrite layer and an adjoining layer with a negative permittivity. The ferrite layer is transversely magnetized by an external magnetic field that corresponds to the range of negative values of the effective permeability. It has been shown that the transmission of the structure can be controlled in wide limits by varying the external magnetic field. In particular, nearly perfect tunneling (viz., nonreflective transmission of incident radiation) can be realized.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

Graphene-silicon layered structures on single-crystalline Ir(111) thin films

Epitaxial growth of graphene on transition metal crystals, such as Ru,⁽¹⁻³⁾ Ir,⁽⁴⁻⁶⁾ and Ni,⁽⁷⁾ provides large-area, uniform graphene layers with controllable defect density, which is crucial for practical applications in future devices. To decrease the high cost of single-crystalline metal bulks, single-crystalline metal films are strongly suggested as the substrates for epitaxial growth large-scale high-quality graphene.⁽⁸⁻¹⁰⁾ Moreover, in order to weaken the interactions of graphene with its metal host, which may result in a suppression of the intrinsic properties of graphene,⁽¹¹ ¹²⁾ the method of element intercalation of semiconductors at the interface between an epitaxial graphene layer and a transition metal substrate has been successfully realized.⁽¹³⁻¹⁶⁾

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2019

Tuning the Hydrophobicity of Layer-Structure Silicates To Promote Adsorption of Nonaqueous Fluids: Effects of F – for OH – Substitution on CO 2 Partitioning into Smectite Interlayers

The intercalation of nonaqueous fluids in the nanopores of organic and inorganic materials is of significant interest, particularly in the energy science community. Recently, X-ray powder diffraction and computational modeling results have shown that structural F – for OH – substitution in layered silicates makes them more hydrophobic. Here, we use grand canonical molecular dynamics calculations to investigate how increasing the F – /(F – + OH – ) ratio of a prototypical layered silicate (the smectite Na-hectorite) impacts the intercalation behavior of CO 2 and H 2 O at elevated temperature and pressure. At the conditions of this study ( T = 323 K, P = 90 bar, water-saturated CO 2 ), increasing F – for OH – substitution causes decreasing total CO 2 + H 2 O intercalation, increasing CO 2 /(CO 2 + H 2 O) ratios in the interlayer galleries, and an increasing energy barrier to CO 2 and H 2 O intercalation. CO 2 intercalation is the greatest at monolayer basal spacings, and the results support the idea that with Na + as the exchangeable cation, the interlayers must be propped open by some H 2 O molecules to allow CO 2 to enter the interlayer galleries. The computed immersion energies suggest that the bilayer or a more expanded structure is the stable state under these conditions, in agreement with experimental results, and that the basal spacings of the minimum energy 2L structures increase with increasing F – for OH – substitution. Finally, these results are consistent with a wide range of experimental data for smectites at ambient conditions and elevated pressures and temperatures and suggest that F – for OH – substitution in conjunction with reduced structural charge and exchange with large, low charge cations may increase the ability of smectite minerals to incorporate hydrophobic species such as CH 4 , CO 2 , H 2 , and other organic compounds.

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

Surface-plasmons lasing in double-graphene-layer structures

We consider the concept of injection terahertz lasers based on double-graphene-layer (double-GL) structures with metal surface-plasmon waveguide and study the conditions of their operation. The laser under consideration exploits the resonant radiative transitions between GLs. This enables the double-GL laser room temperature operation and the possibility of voltage tuning of the emission spectrum. We compare the characteristics of the double-GL lasers with the metal surface-plasmon waveguides with those of such laser with the metal-metal waveguides.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2022

Fine Gradient Electrode and Micro Porous Layer Structures for Improved Heavy Duty Fuel Cells (Final Report)

The commercial deployment of Heavy Duty Fuel Cells(HDFC) for applications such as large trucks (for example, Class 8 capable of carrying 50,000 lb. loads) depends vitally on achieving high efficiency and durability at reasonable costs. Furthermore, the HDFC must operate under practical conditions such as with fuel and air impurities, multiple stop-start cycles, and under the extremes of climate our planet offers – from hot and cold to dry and wet. These conditions place a premium on the stability and utilization of the materials comprising the membrane electrode assemblies (MEAs) powering the fuel cell. and the current catalysts, MicroPorous Layers, and Electrode structures and additives are insufficient for these needs. In Phase I Pajarito and Advent will develop durable electrocatalysts, MicroPorous Layer and electrode additives, and electrode structures for heavy duty fuel cells designed for zero-emission long-haul trucking. The electrocatalyst products are designed to solve the challenging durability and performance needs of fuel cells designed for long life and high efficiency through a combination of uniquely structured designed catalysts as well as new MicroPorous Layers (MPLs) and electrode structure additives. These improved materials will provide Pajarito both an expanded commercial opportunity in electrocatalysts, as well as new markets for MPL and electrode additives. The resulting public benefits include improved economics of fuel cells, a leading zero-emission technology for mobility, as well as reduced reliance on the critical minerals and metals used in the heavy-duty trucks industry. Possible follow-up Phase II and III projects would add full MEA products based on the Phase I efforts catalysts and additives, with full system validation by leading Fuel Cell Truck developers.

08 HYDROGEN↗