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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 37 records · Page 2

A dual-layer structure with record-high solar reflectance for daytime radiative cooling

We demonstrate a diffusive solar reflector with record high reflectance when integrated over the wavelength region from 0.28-4.0 μm. The reflector has a dual-layer structure consisting of a polytetrafluoroethylene (PTFE) sheet on top of a silver film. The thickness of the PTFE varies from 0.25 mm to 1 mm. Spectral reflectance and transmittance of the PTFE sheets (with and without a silver film) were measured using a monochromator and a Fourier-transform infrared spectrometer, with integrating spheres, at wavelengths from 0.28 μm to 15 μm. The scattering and absorption coefficients of the PTFE samples were obtained by fitting the reflectance and transmittance spectra. Integration over the solar irradiation spectrum (AM1.5) reveals that the total solar reflectance is approximately 0.99 for the reflector. This is the highest solar reflectance reported to date. A Monte Carlo ray-tracing method and a modified two-flux model were used to calculate the reflectance and compare with the experiments to shed light on mechanisms for the high reflectance. Our measurements also suggest that PTFE has a high emittance around 0.9 in the mid-infrared region. Therefore, we conclude the proposed structure holds promise for passive daytime radiative cooling.

14 SOLAR ENERGY↗

Tunable surface acoustic wave device using semiconducting MgZnO and piezoelectric NiZnO dual-layer structure on glass

Tunable surface acoustic wave (SAW) devices have attracted considerable interests due to its applications in emerging fields, such as secured wireless communication, adaptive signal processing, and smart sensing systems. We report a dual-input-voltage-controlled tunable SAW built on glass, which uses a ZnO-based dual-layer structure consisting of a piezoelectric Ni- doped ZnO (NZO) and semiconducting Mg-doped ZnO (MZO). The interdigital (IDT) electrodes are buried in the piezoelectric NZO layer to form the delay line for SAW propagation, while the semiconductor MZO layer serves as the channel of a thin film transistor (TFT) to modulate the conductivity. Results show the interface between MZO channel and SiO 2 gate dielectric layer of the TFTT significantly impacts on SAW tuning performances due to Zn diffusion from MZO into SiO 2 . The TFT-SAW device using an ultra-thin MgO layer as interface modification enables SAW frequency tuning of 0.53% under solely V gs control with 0–12 V. The required voltage range is significantly reduced compared regular MZO-NZO TFT-SAW counterpart (Δf/f c ~ 0.25%; V gs –30 to –14 V) without interface modification. With additional control of V ds , the SAW frequency tunability is further expanded from 0.46% to 0.63%. As a result, this dual-input voltage-controlled frequency tuning device on glass is promising for low-voltage, low-cost portable smart sensors and voltage-controlled reconfigurable radio-frequency identification tags.

36 MATERIALS SCIENCE↗

Ablating nanoscale pores in crystalline quartz using laser-induced micro-plasmas in tri-layer structures

We demonstrate a novel approach for achieving rapid, consistent, and controllable micro-pore fabrication in single-crystalline quartz. These micro-pores are essential for applications in biology, i.e., studying ion channels in general and mechano-sensitive channels (MSC) in particular. The fabrication process consists of direct material ablation using pulsed UV light from a 193 nm excimer laser. These pulses ablate single-crystalline quartz chips by burning a laser-induced plasma in a tri-layer structure. Controllable plasma confinement and thus pore size is achieved by sandwiching a thin layer of a selected organic solution between the quartz chip and different substrates. This solution causes the confined micro-plasma to generate special ablation conditions, to create uniformly sized and shaped nanopores.

36 MATERIALS SCIENCE↗

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↗

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↗

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↗

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↗

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↗

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↗

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↗

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↗

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↗

Widespread Negative Longitudinal Piezoelectric Responses in Ferroelectric Crystals with Layered Structures

In this study, we investigate the underlying mechanisms of the universal negative piezoelectricity in low-dimensional layered materials by carrying out first-principles calculations. Two-dimensional layered ferroelectric CuInP 2 S 6 is analyzed in detail as a typical example, but the theory can be applied to any other low-dimensional layered piezoelectrics. Consistent with the theory proposed in [Phys. Rev. Lett. 119, 207601 (2017), the anomalous negative piezoelectricity in CuInP 2 S 6 also results from its negative clamped-ion term, which cannot be compensated by the positive internal-strain part. Here, we focus on a more general rule by proposing that having a negative clamped-ion term should be universal among piezoelectric materials, which is attributed to the “lag of Wannier center” effect. The internal-strain term, which is the change in polarization due to structural relaxation in response to strain, is mostly determined by the spatial structure and chemical bonding of the material. In a low-dimensional layered piezoelectric material such as CuInP 2 S 6 , the internal-strain term is approximately zero. This is because the internal structure of the molecular layers, which are bonded by the weak van der Waals interaction, responds little to the strain. As a result, the magnitude of the dipole, which depends strongly on the dimension and structure of the molecular layer, also has a small response with respect to strain. An equation bridging the internal strain responses in low-dimensional and three-dimensional piezoelectrics is also derived to analytically express this point. This work aims to deepen our understanding about this anomalous piezoelectric effect, especially in low-dimensional layered materials, and provide strategies for discovering materials with novel electromechanical properties.

2-dimensional systems↗

Magnetic and Superconducting Properties of the Heterogeneous Layered Structures V/Fe{sub 0.7}V{sub 0.3}/V/Fe{sub 0.7}V{sub 0.3}/Nb and Nb/Ni{sub 0.65(0.81)}Cu{sub 0.35(0.19)}

The heterogeneous ferromagnetic–superconducting layered heterostructures V/Fe{sub 0.7}V{sub 0.3}/V/Fe{sub 0.7}V{sub 0.3}/Nb and Nb/Ni{sub 0.65(0.81)}Cu{sub 0.35(0.19)}, which contain magnetic clusters and ferromagnetic domains, are studied. The magnetic and superconducting properties of the structures depend on the magnetic-layer thickness, the magnetic field, and the time elapsed from structure preparation. We detected the interaction of clusters with a domain structure, diamagnetism and magnetization reversal of the magnetic layer during the superconducting transition in a ferromagnetic–superconducting heterostructure, and a superconducting transition in the magnetic layer. The magnetic and resistive properties of the heterostructures changed in several weeks and months.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Additive engineering for robust interphases to stabilize high-Ni layered structures at ultra-high voltage of 4.8 V

Nickel-rich layered cathode materials promise high energy density for next-generation batteries when coupled with lithium metal anodes. However, the practical capacities accessible are far less than the theoretical values due to their structural instability during cycling, especially when charged at high voltages. Here we demonstrate that stable cycling with an ultra-high cut-off voltage of 4.8 V can be realized by using an appropriate amount of lithium difluorophosphate in a common commercial electrolyte. The Li||LiNi 0.76 Mn 0.14 Co 0.10 O 2 cell retains 97% of the initial capacity (235 mAh g -1 ) after 200 cycles. The cycling stability is ascribed to the robust interphase on the cathode. It is formed by lithium difluorophosphate decomposition, which is facilitated by the catalytic effect of transition metals. The decomposition products (Li 3 PO 4 and LiF) form a protective interphase. This suppresses transition metal dissolution and cathode surface reconstruction. It also facilitates uniform Li distribution within the cathode, effectively mitigating the strain and crack formation.

25 ENERGY STORAGE↗

Boundary Layer Structures Over the Northwest Atlantic Derived From Airborne High Spectral Resolution Lidar and Dropsonde Measurements During the ACTIVATE Campaign

The Planetary Boundary Layer height (PBLH) is essential for studying PBL and ocean-atmosphere interactions. Marine PBL is usually defined to include a mixed layer (ML) and a capping inversion layer. The ML height (MLH) estimated from the measurements of aerosol backscatter by a lidar was usually compared with PBLH determined from radiosondes/dropsondes in the past, as the PBLH is usually similar to MLH in nature. However, PBLH can be much greater than MLH for decoupled PBL. Here, in this study, we evaluate the retrieved MLH from an airborne lidar (HSRL-2) by utilizing 506 co-located dropsondes during the ACTIVATE field campaign over the Northwest Atlantic from 2020 to 2022. First, we define and determine the MLH and PBLH from the temperature and humidity profiles of each dropsonde, and find that the MLH values from HSRL-2 and dropsondes agree well with each other, with a coefficient of determination of 0.66 and median difference of 18 m. In contrast, the HSRL-2 MLH data do not correspond to dropsonde-derived PBLH, with a median difference of -47 m. Therefore, we modify the current operational and automated HSRL-2 wavelet-based algorithm for PBLH retrieval, decreasing the median difference significantly to -8 m. Further data analysis indicates that these conclusions remain the same for cases with higher or lower cloud fractions, and for decoupled PBLs. These results demonstrate the potential of using HSRL-2 aerosol backscatter data to estimate both marine MLH and PBLH and suggest that lidar-derived MLH should be compared with radiosonde/dropsonde-determined MLH (not PBLH) in general.

54 ENVIRONMENTAL SCIENCES↗