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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 523 records · Page 29

Violation of Field Line Conservation and Associated Spatial Scales in Particle-In-Cell Simulations and MMS Data

For the first time, space flight technology exists to detect, in situ, violation of magnetic field line conservation. The violation of magnetic line conservation on scales smaller than the system size is a necessary and sufficient condition for finite magnetic field reconnection. We demonstrate that violation of line conservation produces a detectable, structured signature both in particle-in-cell simulations of reconnection and in data from the Magnetospheric Multi-Scale mission. In particle-in-cell simulations of asymmetric reconnection, the quantity-which we call M-that identifies this violation achieves significant values in electron skin depth-scale layers that extend away from the separator, with higher values emerging on the low-density, high-magnetic-field side of the current sheet. At the separator, M owes largely to perpendicular gradients in the parallel electric field, while it attains its highest values away from the separator in dispersed, layered structures associated with gradients in the perpendicular nonideal electric field and electron transport. Sub-ion scale bipolar forms of the quantity also appear further from the separator. In two MMS burst data intervals detecting the electron diffusion region, we find that M exceeds measurement uncertainties both at the separator and near the separatrices. One interval has highly sheared reconnecting fields and the other a stronger guide field. For one event, we determine the location and scale of M and the inner electron diffusion region relative to electron outflows and the magnetic separatrices. The measure can therefore serve as a potent diagnostic for magnetic reconnection in space measurements.

Wendel, Deirdre E.↗

Synthesis and anisotropic magnetism in quantum spin liquid candidates A YbSe 2 ( A = K and Rb)

The quantum spin liquid (QSL) state in rare-earth triangular lattices has attracted much attention recently due to its potential application in quantum computing and communication. Here, we report the single-crystal growth synthesis, crystal structure characterizations, and magnetic properties of AYbSe 2 (A = K and Rb) compounds. The x-ray diffraction analysis shows that AYbSe 2 (A = K and Rb) crystallizes in a trigonal space group, R-3m (No. 166) with Z = 3. AYbSe 2 possesses a two-dimensional (2D) Yb–Se–Yb layered structure formed by edged-shared YbSe 6 octahedra. The magnetic properties are highly anisotropic for both title compounds, and no long-range order is found down to 0.4 K, revealing the possible QSL ground state in these compounds. The isothermal magnetization exhibits a one-third magnetization plateau when the magnetic fields are applied in the ab-plane. Heat capacity is performed along both ab-plane and c axis and features the characteristic dome for triangular magnetic lattice compounds as a function of magnetic fields. Due to the change in the interlayer and intralayer distance of Yb 3+ , the dome shifts to low fields from KYbSe 2 to RbYbSe 2 . All these results indicate that the AYbSe 2 family presents unique frustrated magnetism close to the possible QSL and noncollinear spin states.

36 MATERIALS SCIENCE↗

Progress in the Development of Metamorphic Multi-Junction III-V Space-Solar Cells at Essential Research Incorporated

Theoretical calculations have shown that highest efficiency III-V multi-junction solar cells require alloy structures that cannot be grown on a lattice-matched substrate. Ever since the first demonstration of high efficiency metamorphic single junction 1.1 eV and 1.2 eV InGaAs solar cells by Essential Research Incorporated (ERI), interest has grown in the development of multi-junction cells of this type using graded buffer layer technology. ERI is currently developing a dual-junction 1.6 eV InGaP/1.1 eV InGaAs tandem cell (projected practical air-mass zero (AM0), one-sun efficiency of 28%, and 100-sun efficiency of 37.5%) under a Ballistic Missile Defense Command (BMDO) SBIR Phase II program. A second ongoing research effort at ERI involves the development of a 2.1 eV AlGaInP/1.6 eV InGaAsP/1.2 eV InGaAs triple-junction concentrator tandem cell (projected practical AM0 efficiency of 36.5% under 100 suns) under a SBIR Phase II program funded by the Air Force. We are in the process of optimizing the dual-junction cell performance. In case of the triple-junction cell, we have developed the bottom and the middle cell, and are in the process of developing the layer structures needed for the top cell. A progress report is presented in this paper.

Sinharoy, Samar↗

Unique optical excitations in topological insulators (Final Technical Report)

The overall objective of this research is to understand how light interacts with topological insulator (TI) films and layered structures. Unlike normal materials, the electrons in TI films are trapped at the top and bottom surfaces of the film. These electrons have unusual properties, including low mass and high velocity. Light shining on these trapped electrons will excite electron density waves, called plasmons, which inherit the unusual properties of the electrons. This project aims to understand how these plasmons interact with each other and how the plasmon properties change as the film dimensions change. By controlling the physical properties of the films, the optical response of the film can also be controlled. In addition to single TI films, the project will also investigate the properties of stacks of TI films layered with normal insulating films. Stacking these materials results in multiple layers of trapped electrons whose plasmons can interact in ever more complex ways. After these interactions are understood, we can begin to engineer complex TI structures to obtain designer optical phenomena in the far-infrared and THz, wavelength ranges of interest for environmental monitoring and chemical sensing. This research directly addresses DOE Grand Challenges, including understanding how properties of matter emerge from complex electronic correlations and learning how to control these properties as well as the mission of the Basic Energy Sciences program to understand and control matter at the electronic/atomic level.

36 MATERIALS SCIENCE↗

Shear Band Formation in Thin-Film Multilayer Columns Under Compressive Loading: A Mechanistic Study

Micro-pillar compression is a popular experimental technique used for characterizing the mechanical behavior of nano- and micro-laminates. The compressive stress–strain response of the column-shaped thin-film composite can be measured, and the deformation and damage features can be revealed by post-test cross-section microscopy. The development of plastic instability in the form of localized strain concentration (shear bands), leading to eventual failure, is frequently observed. In the present study, a computational approach is used to illustrate the commonality of shear band formation from a continuum standpoint. Systematic finite element analyses are conducted, showing that the strain field tends to become localized once plastic yielding commences. Distinct shear offsets of the layered structure can be revealed from the numerical model, which is similar to those observed in experiments. The actual appearance of shear bands depends on the materials’ constitutive behavior and precise geometries. Post-yield strain hardening reduces the propensity of shear band formation, while strain softening enhances it. Imperfections such as the undulated layer geometry, as well as the frictional characteristics between the specimen and test apparatus, can also influence the shear band morphology and overall stress–strain response.

finite element modeling↗

On turbulent spots in plane Poiseuille flow

Turbulence characteristics inside a turbulent spot in plume Poiseuille flow are investigated by analyzing a data base obtained from a direct numerical simulation. The spot is found to consist of two distinct regions - a turbulent area and a wave area. The flow inside the turbulent area has a strong resemblance to that found in the fully developed turbulent channel. Suitably defined mean and rms fluctuations as well as the internal shear layer structures are found to be similar to the turbulent counterpart. In the wave area, the inflexional mean spanwise profiles cause a rapid growth of oblique waves, which break down to turbulence. The breakdown process of the oblique waves is reminiscent of the secondary instability observed during transition to turbulence in channel and boundary layer flows. Other detailed characteristics associated with the Poiseuille spot are presented and are compared with experimental results.

Henningson, Dan S.↗

On turbulent spots in plane Poiseuille flow

Turbulence characteristics inside a turbulent spot in plane Poiseuille flow are investigated by analyzing a database obtained from a direct numerical simulation. The spot is found to consist of two distinct regions - a turbulent area and a wave area. The flow inside the turbulent area has a strong resemblance to that found in the fully developed turbulent channel. Suitably defined mean and r.m.s. fluctuations as well as the internal shear-layer structures are found to be similar to the turbulent counterpart. In the wave area the inflexional mean spanwise profiles cause a rapid growth of oblique waves, which break down to turbulence. The breakdown process of the oblique waves is reminiscent of the secondary instability observed during transition to turbulence in channel and boundary-layer flows. Other detailed characteristics associated with the Poiseuille spot are presented and are compared with experimental results.

Henningson, Dan S.↗

Estimating Forest Vertical Structure from Multialtitude, Fixed-Baseline Radar Interferometric and Polarimetric Data

Parameters describing the vertical structure of forests, for example tree height, height-to-base-of-live-crown, underlying topography, and leaf area density, bear on land-surface, biogeochemical, and climate modeling efforts. Single, fixed-baseline interferometric synthetic aperture radar (INSAR) normalized cross-correlations constitute two observations from which to estimate forest vertical structure parameters: Cross-correlation amplitude and phase. Multialtitude INSAR observations increase the effective number of baselines potentially enabling the estimation of a larger set of vertical-structure parameters. Polarimetry and polarimetric interferometry can further extend the observation set. This paper describes the first acquisition of multialtitude INSAR for the purpose of estimating the parameters describing a vegetated land surface. These data were collected over ponderosa pine in central Oregon near longitude and latitude -121 37 25 and 44 29 56. The JPL interferometric TOPSAR system was flown at the standard 8-km altitude, and also at 4-km and 2-km altitudes, in a race track. A reference line including the above coordinates was maintained at 35 deg for both the north-east heading and the return southwest heading, at all altitudes. In addition to the three altitudes for interferometry, one line was flown with full zero-baseline polarimetry at the 8-km altitude. A preliminary analysis of part of the data collected suggests that they are consistent with one of two physical models describing the vegetation: 1) a single-layer, randomly oriented forest volume with a very strong ground return or 2) a multilayered randomly oriented volume; a homogeneous, single-layer model with no ground return cannot account for the multialtitude correlation amplitudes. Below the inconsistency of the data with a single-layer model is followed by analysis scenarios which include either the ground or a layered structure. The ground returns suggested by this preliminary analysis seem too strong to be plausible, but parameters describing a two-layer compare reasonably well to a field-measured probability distribution of tree heights in the area.

Treuhaft, Robert N.↗

Modelling of Blast Furnace with Respective Chemical Reactions in Coke and Ore Burden Layers

The ironmaking blast furnace (BF) is an efficient chemical reactor for producing liquid iron from solid iron ore, where the solids of coke and iron ore are charged in alternative layers and different chemical reactions occur in the two solid layers as they descend. Such respective reacting burden layers have not been considered explicitly in the previous BF models. In this article, a mathematical model based on multi-fluid theory is developed for describing the multiphase reacting flows considering the respective reacting burden layers. Then, this model is applied to a BF, covering the area from the burden surface at the furnace top to the liquid surface above the hearth, to describe the inner states of a BF in terms of the multiphase flows, temperature distribution and reduction process. The results show that some key important features in the layered burden with respective chemical reactions are captured, including fluctuating iso-lines in terms of gas flow and thermochemical behaviours; particularly the latter cannot be well captured in the previous BF models. The temperature difference between gas–solid phases is found to be larger near the raceway, at the cohesive zone and at the furnace top, and the thermal reserved zone can be identified near the shaft. Three chemical reserve zones of hematite, magnetite and wustite can also be observed near the stockline, in the shaft near the wall and near centre, respectively. Inside each reserve zone, the corresponding ferrous oxides stay constantly high in alternative layers; the overall performance indicators including gas utilization efficiency and reduction degree also stay stable in an alternative-layered structure. This model provides a cost-effective tool to investigate the BF in-furnace process and optimize BF operation.

36 MATERIALS SCIENCE↗

Structure of Diamond-Like Silicon–Carbon Films Alloyed by Vanadium

The structure of diamond-like silicon–carbon films formed on silicon substrates by magnetron and plasmatron codeposition using a closed-field magnetron and a plasmatron activated by tungsten cathode has been studied by transmission electron microscopy. The main feature of the films alloyed by vanadium to concentrations of 12–31 at % was found to be a layered structure of the film cross section. It was established that vanadium alloying leads to the formation of vanadium carbide (VC) nanocrystals; the nanocrystal size increases from 1–2 to 10 nm. At the maximum vanadium content, VC nanocrystals have an anisotropic shape: they are extended in the direction perpendicular to the film–substrate interface.

36 MATERIALS SCIENCE↗

Cleavable magnetic materials from van der Waals layered transition metal halides and chalcogenides

The study of exfoliated 2D magnetic materials is a vibrant and rapidly progressing field and is impacting many areas of condensed matter research including fundamental magnetism, spintronics and optoelectronics, and topological spin and electronic systems. The availability of promising candidate materials has enabled much of the progress in this field. Here, I present my perspective on the development of cleavable magnetic materials with a focus on transition metal halides and chalcogenides and an emphasis on crystal structure and magnetic order. To give proper context for these discussions, brief and incomplete surveys of recent work are included, focusing on specific aspects that I find most useful for guiding work on emerging materials and motivating expansion into other compounds and material families. Several instances of structural changes that can differentiate behaviors of bulk and ultrathin specimens are noted. Probing and understanding potential structural differences present a challenge but also an opportunity for material and device development, if they can be predicted and controlled. It is clear that careful investigations of structure, layer stacking, and defects in materials, how they may relate to the crystal chemistry, and how they may be different in crystals and mono- or few-layer specimens provide invaluable context for understanding the behavior of van der Waals layered magnetic materials.

36 MATERIALS SCIENCE↗

Organosilane-assisted selective etching strategy for fabrication of hollow/rattle-type mesoporous organosilica nanospheres

Highlights: • Effective fabrication of organic hollow/rattle-type mesoporous organosilica. • The addition of CTES could increase the porosity of the materials. • Pore-making agent (CTES) could be removed by alkali treatment without additional step. - Abstract: A facile strategy to fabricate hollow or rattle-type mesoporous silica nanospheres (HMSNs or RMSNs) with organic functional groups and porous shell was developed. Herein, thiol-HMSNs were obtained via treating vinyl-SiO{sub 1.5} @cyano&thiol-SiO{sub 1.5} prepared by using 3-mercaptopropyltrimethoxysilane (MPTMS) as organosilane precursor, vinyltriethoxysilane (VTES) as sacrificial template precursor and cyanoethyltriethoxysilane (CTES) as pore-making agent. In this method, CTES was co-condensed with MPTMS to form hybrid shell and played an important role in the formation of pore structures. When the volume ratio of MPTMS to CTES was 1:1, well-defined thiol-HMSNs with a specific surface area of 295.6 m{sup 2} g{sup −1} and pore volume of 0.51 cm{sup 3} g{sup −1} could be obtained. Moreover, [email protected] could also be synthesized through this method from three-layered structures (thiocyanato-SiO{sub 1.5} @vinyl-SiO{sub 1.5} @cyano&thiol-SiO{sub 1.5}). The as-prepared RMSNs presented good performance for the adsorption of 2, 4-dichloropheno in water. And this selective etching strategy was versatile and might be extended to fabricate more valuable organic hollow/rattle-type composites for different applications.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Preliminary results of measurements by automated probes Vega 1 and 2 or particle concentration in clouds of Venus at heights 47-63 KM

Results of the preliminary processing of the Vega 1 and 2 descender data on the cloud layer structure of the Venusian atmosphere are discussed. A photoelectric counter for aerosol particles is described together with its optical and pneumatic circuits and operation algorithm. Vertical profiles of concentrations of particles with a diameter of 0.4 microns agree quantitatively with the Pioneer-Venus and Venera 9 and 10 data. Concentrations of these particles are: in the B layer, up to 190/cu cm; in the C layer, up to 10/cu cm; and in the D layer, up to 130/cu cm. Layers have sharp boundaries with a significant vertical heterogeneity of the aerosol concentration field inside them.

Zhulanov, Y. V.↗

Computation of three-dimensional mixed convective boundary layer flow

The paper presents the numerical solution of heat and mass transfer during cross-flow (orthogonal) mixed convection. In this class of flow, a buoyancy-driven transport in the vertical direction and a forced convective flow in the horizontal direction results in a three-dimensional boundary layer structure adjacent to the plate. The rates of heat and mass transfer are determined by a combined influence of the two transport processes. The equations for the conservation of mass, momentum, energy, and species concentration were solved along with appropriate boundary conditions to determine the distributions of velocity components, temperature, and concentration across the thickness of the boundary layer at different locations on the plate. Results were expressed in dimensionless form using Reynolds number, Richardson number for heat transfer, Richardson number for mass transfer, Prandtl number, and Schmidt number as parameters. It was found that the transport is dominated by buoyancy at smaller vertical locations and at larger distances away from the forced convection leading edge. Effects of forced convection appeared to be very strong at smaller horizontal distances from the leading edge. The cross stream forced convection enhanced the rate of heat and mass transfer by a very significant amount.

Gadepalli, Prashandt↗

Cr 2.37 Ga 3 Se 8 : A Quasi-Two-Dimensional Magnetic Semiconductor

We present a novel magnetic semiconductor, Cr 2.37 Ga 3 Se 8 , synthesized by partially replacing magnetic Cr 3+ in antiferromagnetic Cr 5+δ Se 8 with nonmagnetic Ga 3+ . The crystal structure of Cr 2.37 Ga 3 Se 8 was determined by both powder and single-crystal X-ray diffraction. The title compound crystallizes in a monoclinic structure with space group C2/m (No. 12). In Cr 2.37 Ga 3 Se 8 , the Cr atoms are surrounded by 6 Se atoms and form filled octahedral clusters, while Ga atoms are centered in the Se 4 tetrahedral clusters. The two kinds of clusters pack alternatingly along the c-axis, which results in a quasi-two-dimensional layered structure. The magnetization (M) measurement shows the development of short-range ferromagnetic coupling below the Curie-Weiss (CW) temperature θ CW ~ 92 K, evidenced by the nonlinear field dependence of M. However, the magnetic susceptibility exhibits a peak at low fields at ~18 K, indicating the existence of an antiferromagnetic interaction as well. Electronic structure calculations using the WIEN2k program in the local spin density approximation indicate that the magnetism arises exclusively from local moments of the Cr atoms. Here, the electrical resistivity measurement of the Cr 2.37 Ga 3 Se 8 sample confirms that this material is a semiconductor with the band gap ~0.26 eV. Meanwhile, the experimental band gap (~0.26 eV) is close to the theoretical prediction using the WIEN2k program (~0.35 eV).

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

GaAs vapor-grown bipolar transistors.

Discussion of an approach for the fabrication of high-temperature GaAs transistors which is centered on the preparation of n-p-n three-layered structures entirely by a vapor-phase growth technique, as described by Tietjen and Amick (1966). The low growth temperature of approximately 750 C is thought to reduce contamination during crystal growth and to contribute to the reasonably high minority-carrier lifetimes obtained for the vapor-grown p-n junctions. The fact that impurity concentrations and layer thicknesses can be precisely controlled for epitaxial layers as thin as 1 micrometer is an important feature of this growth technique.

Nuese, C. J.↗

Assessment of Aerosol Optical Property and Radiative Effect for the Layer Decoupling Cases over the Northern South China Sea During the 7-SEAS Dongsha Experiment

The aerosol radiative effect can be modulated by the vertical distribution and optical properties of aerosols, particularly when aerosol layers are decoupled. Direct aerosol radiative effects over the northern South China Sea (SCS) were assessed by incorporating an observed data set of aerosol optical properties obtained from the Seven South East Asian Studies (7-SEAS)/Dongsha Experiment into a radiative transfer model. Aerosol optical properties for a two-layer structure of aerosol transport were estimated. In the radiative transfer calculations, aerosol variability (i.e., diversity of source region, aerosol type, and vertical distribution) for the complex aerosol environment was also carefully quantified. The column-integrated aerosol optical depth (AOD) at 500nm was 0.1-0.3 for near-surface aerosols and increased 1-5 times in presence of upper layer biomass-burning aerosols. A case study showed the strong aerosol absorption (single-scattering albedo (omega) approx. = 0.92 at 440nm wavelength) exhibited by the upper layer when associated with predominantly biomass-burning aerosols, and the omega (approx. = 0.95) of near-surface aerosols was greater than that of the upper layer aerosols because of the presence of mixed type aerosols. The presence of upper level aerosol transport could enhance the radiative efficiency at the surface (i.e., cooling) and lower atmosphere (i.e., heating) by up to -13.7 and +9.6W/sq m2 per AOD, respectively. Such enhancement could potentially modify atmospheric stability, can influence atmospheric circulation, as well as the hydrological cycle over the tropical and low-latitude marginal northern SCS.

biomass burning↗

Cryo-FIB for TEM Investigation of Soft Matter and Beam Sensitive Energy Materials

Primarily driven by structural biology, the rapid advances in cryogenic electron microscopy techniques are now being adopted and applied by materials scientists. Samples that inherently have electron transparency can be rapidly frozen (vitrified) in amorphous ice and imaged directly on a cryogenic transmission electron microscopy (cryo-TEM), however this is not the case for many important materials systems, which can consist of layered structures, embedded architectures, or be contained within a device. Cryogenic focused ion beam (cryo-FIB) lift-out procedures have recently been developed to extract intact regions and interfaces of interest, that can then be thinned to electron transparency and transferred to the cryo-TEM for characterization. Several detailed studies have been reported demonstrating the cryo-FIB lift-out procedure, however due to its relative infancy in materials science improvements are still required to ensure the technique becomes more accessible and routinely successful. Here, we review recent results on the preparation of cryo-TEM lamellae using cryo-FIB and show that the technique is broadly applicable to a range of soft matter and beam sensitive energy materials. We then present a tutorial that can guide the materials scientist through the cryo-FIB lift-out process, highlighting recent methodological advances that address the most common failure points of the technique, such as needle attachment, lift-out and transfer, and final thinning.

36 MATERIALS SCIENCE↗