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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 451 records · Page 25

Study of the Au-Cr bilayer system using X-ray reflectivity, GDOES, and ToF-SIMS

Here, we study a Au (25 nm)/Cr (10 nm) bilayer system as a model of mirror for the soft X–ray energy range. The Au and Cr thin films are a few nanometer thick and are deposited on a float glass substrate. The sample is characterized by using 3 complementary techniques: soft X–ray reflectivity, glow discharge optical emission spectrometry (GDOES), and time–of–flight secondary ion mass spectroscopy (ToF–SIMS). Soft X–ray reflectivity provides information about the thickness and roughness of the different layers, while GDOES is used to obtain the elemental depth profile of the stack and ToF–SIMS to obtain the elemental and chemical depth profiles. GDOES and ToF–SIMS have both a nanometer depth resolution. A coherent description of the bilayer stack is obtained through the combination of these techniques. It consists in 5 layers namely a surface contamination layer, a principal gold layer, a Au–Cr mixed layer, a Cr layer, and another contamination layer at the top of the substrate.

36 MATERIALS SCIENCE↗

Determination of the Ability to Measure Traces of Water in Dehydrated Residues of Waste Water by IR Diffuse Reflectance Spectra

Rapid measurement of the moisture content of dehydrated residues is a critical problem, the solution of which will increase the efficiency of treatment facilities and optimize the process of applying flocculants. The ability to determine the moisture content of dehydrated residues using a meter operating on the IR reflectance principle was confirmed experimentally. The most suitable interference filters were selected based on an analysis of the obtained diffuse reflectance spectrum of the dehydrated residue in the range 1.0–2.7 μm. Calibration curves were constructed and compared for each filter set. A measuring filter with a transmittance maximum at 1.19 μm and a reference filter with a maximum at 1.3 μm gave the best agreement with the laboratory measurements.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Spectral reflectance reconstruction with the locally weighted linear model

Spectral reflectance reconstruction by the local linear model has many advantages such as simple model structure, fast calculation speed and less chance to be over-fitting. However, local linear model often suffers from the outliers and prone to be under-fitting. In this paper, we propose a locally weighted linear model for spectral reflectance reconstruction. It improves the contribution of the local neighbors with higher similarity to the test point, which can reduce the influence of noisy points and redundant points. Experimental results show that the locally weighted linear model can effectively reduce the reconstruction error.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Electronic Melting of Silicon in Nanostructures using X-ray Forbidden Bragg Reflections

Abstract We carried out a short beamtime at the Pohang Accelerator Laboratory x-ray Free Electron Laser to perform a pump-probe (PP) laser excitation diffraction experiment on the silicon (222) forbidden Bragg peak. To limit the x-ray penetration, we used a “device layer” silicon film wafer bonded to a silicon substrate. The sample, specially fabricated by MEMC Electronic Materials, had a Si(100) substrate bonded to a 170 nm Si(100) film rotated at 45° for crystallographic isolation. A second sample was reactive-ion-etched down to 52 nm thickness. In the silicon lattice, the covalent bonds are seen exclusively at the 222 reflection. Upon laser excitation, these electrons are expected to be excited to the valence band on femtosecond electronic time scales. The Si(222) reflection is therefore expected to be extinguished on this fast time scale, while the electron–phonon coupled acoustic response is determined by the lattice dynamics. The latter is determined by the speed of sound over the device thickness, which is in the mid-picosecond range.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

Simultaneous study of mechanical property development and early hydration chemistry in Portland cement slurries using X-ray diffraction and ultrasound reflection

A sample cell for the simultaneous measurement of synchrotron X-ray powder diffraction and ultrasound shear-wave reflection data from cement slurries is described. White cement slurries at 25 and 50 C with 0-3% bwoc CaCl{sub 2} were studied to illustrate the potential of the apparatus. The decrease in reflected S-wave amplitude, in dB, showed a linear correlation with C{sub 3}S hydration. CaCl{sub 2} retarded the development of G{prime} and G{double_prime} relative to the extent of C{sub 3}S hydration. At short times, there was a correlation between the time evolution of both G{prime} and G{double_prime}, and the amount of precipitated CH seen by diffraction, which was almost independent of CaCl{sub 2} concentration and temperature. CaCl{sub 2} addition resulted in a decrease in the amount of CH visible to X-rays, relative the degree of C{sub 3}S hydration. This may indicate a change in C-S-H gel C:S ratio or the presence of nanoscale CH that could not be seen by diffraction.

36 MATERIALS SCIENCE↗

Assessing the thermal maturity of black shales using vitrinite reflectance: Insights from Devonian black shales in the eastern United States

Thermal maturity of source rocks indicated by vitrinite reflectance (R o ) is an important and reliable parameter to determine the petroleum potential of sedimentary basins. Originally, R o was used to characterize the degree of coalification of coals and thus works well for coal seams, but it has limitations when used to determine the thermal maturity of black shale successions. A suite of six coal-shale pairs from the Upper Devonian black shale formations in the eastern United States (New Albany Shale, Ohio Shale, Dunkirk Shale, and Rhinestreet Shale) was selected to study the applicability of R o in assessing the thermal maturity of black shale successions. The results show that vitrinite in the studied coal samples is dominated by collotelinite, whereas vitrinite in black shales occurs as small dispersed particles (~5 μm) in the mineral matrix. When comparing the size and morphology of dispersed vitrinite particles in shales and collotelinite fragments in coals, vitrinite in shales and adjacent coals should have the same origin. The measured mean random R o of vitrinite in coals ranges from 0.51–0.68%, and is 0.04–0.11% (average 0.07%) lower than that of dispersed vitrinite particles in enclosing shales. This observation contrasts with previously reported R o suppression in liptinite-rich black shales. A high standard deviation of R o measurements indicates a highly heterogeneous nature of vitrinite in black shales. Three mechanisms can be envisioned to contribute to the higher R o of dispersed vitrinite particles in black shales relative to enclosed coals. First, small vitrinite particles may become more oxidized because small particles are more frequently suspended during transport to the site of deposition and reworking of bottom sediments after deposition than large pieces of driftwood that will turn into enclosed coal lenses during burial diagenesis. Second, misidentification of zooclast (e.g., chitinozoan) fragments as vitrinite due to loss of diagnostic morphology. Third, various macerals in the vitrinite group (e.g., corpogelinite and collotelinite) may have had different original reflectance values. Based on the petrographic characteristics of vitrinite and vitrinite-like particles, caution should be applied when using the R o values of dispersed vitrinite and vitrinite-like particles in black shales as indicators of thermal maturity.

58 GEOSCIENCES↗

Interlaboratory Study: Testing Reproducibility of Solid Biofuels Component Identification Using Reflected Light Microscopy

Considering global market trends and concerns about climate change and sustainability, increased biomass use for energy is expected to continue. As more diverse materials are being utilized to manufacture solid biomass fuels, it is critical to implement quality assessment methods to analyze these fuels thoroughly. One such method is reflected light microscopy (RLM), which has the potential to complement and enhance current standard testing, leading to improving fuel quality assessment and, ultimately, preventing avoidable air pollution. An interlaboratory study (ILS) was conducted to test the reproducibility of biomass fuels component identification using a reflected light microscopy technique. The exercise was conducted on thirty photomicrographs showing biomass and various undesired components (like plastics or mineral matter), which were purposely added (by the ILS organizers) to contaminate wood pellets and charcoal-based grilling fuels. Forty-six participants had various levels of difficulty identifying the marked components, and as a result, the percentage of correct answers ranged from 52.2 to 94.4%. Among the most difficult components to distinguish were petroleum products and inorganic matter. Various reasons led to the misidentification, including insufficient morphological descriptions of the components provided to participants, ambiguities of the nomenclature, limitations of the analytical and exercise method, and insufficient experience of the participants. Overall, the results indicate that RLM has the potential to enhance the quality assessment of biomass fuels. However, they also demonstrate that the petrographic classification used in this exercise requires further refinement before it can be standardized. While a new simplified classification of solid biomass fuels components was created as an outcome of this study, future research is necessary to refine the nomenclature, develop a microscopic morphological description of the components, and verify the accuracy of component identification with a follow-up ILS.

biomass↗

Specular reflection treatment for the 3D radiative transfer equation solved with the discrete ordinates method

The contribution of this paper relies in the development of numerical algorithms for the mathematical treatment of specular reflection on borders when dealing with the numerical solution of radiative transfer problems. The radiative transfer equation being integro-differential, the discrete ordinates method allows to write down a set of semi-discrete equations in which weights are to be calculated. The calculation of these weights is well known to be based on either a quadrature or on angular discretization, making the use of such method straightforward for the state equation. Also, the diffuse contribution of reflection on borders is usually well taken into account. However, the calculation of accurate partition ratio coefficients is much more tricky for the specular condition applied on arbitrary geometrical borders. This paper presents algorithms that calculate analytically partition ratio coefficients needed in numerical treatments. The developed algorithms, combined with a decentered finite element scheme, are validated with the help of comparisons with analytical solutions before being applied on complex geometries.

97 MATHEMATICS AND COMPUTING↗

Hydrothermal synthesis and thermal change in IR reflectance of Al/W co-doped VO2 powder

Highlights: • Al/W-doped VO{sub 2} powders were synthesized by a hydrothermally method. • The Al/W-doped VO{sub 2} underwent a phase transition at around room temperature. • The Al/W-doped VO{sub 2} had the larger IR reflectance compared with W-VO{sub 2}(M). - Abstract: Al/W co-doped VO{sub 2} with a monoclinic structure, space group P2{sub 1}/c, was synthesized (hereafter, Al/W-doped VO{sub 2}(M1)) and its thermochromic property was investigated. First, to prepare the precursor for Al/W-doped VO{sub 2}(M1), V{sub 2}O{sub 5}, (NH{sub 4}){sub 10}W{sub 12}O{sub 41}·5H{sub 2}O, and AlCl{sub 3}·H{sub 2}O were dispersed in a citric acid solution and then hydrothermally treated in an autoclave. Then, the Al/W-doped VO{sub 2}(M1) powders were synthesized by heating the obtained precursor at various temperatures under an Ar gas flow. The Al/W-doped VO{sub 2}(M1) has a monoclinic structure with space group P2{sub 1}/c, similar to undoped VO{sub 2}(M1) and W-doped VO{sub 2}(M1). The Al/W-doped VO{sub 2}(M1) indicated that the monoclinic to tetragonal transition temperature was lowered to approximately room temperature by the Al and W doping. The Al/W-doped VO{sub 2}(M1) had the lower optical band gap and showed a larger IR reflectance in the 800–2000 nm range, compared with W-doped VO{sub 2}(M1) and pure VO{sub 2}(M1).

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

UV–Visible reflectance of common light reflectors and their degradation after an ionization dose up to 100 Mrad

We report light reflectors are widely used to enhance scintillation light collection. Their enhancement level depends on the reflector’s reflectance at the scintillator’s emission wavelength. We report UV–Visible reflectance spectra, relative to BaSO 4 , for several common reflectors. Also reported is their radiation hardness against an ionization dose up to 100 Mrad. The results of this investigation provide a reference for applications of these reflectors in a severe radiation environment.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Emissivity of solar cell cover glass calculated from infrared reflectance measurements

The thermal emissivity of solar cell cover glasses with differences in glass composition or manufacture and surface texture are evaluated using specular and specular+diffuse infrared reflectance at different angles of incidences. Non-textured and textured glasses all exhibit similar emissivity at all angles of incidence regardless of composition and patterning. Both diffuse and specular reflectance must be included for textured glass at any angle of incidence and may be needed for planar glass at a high angle of incidences to properly determine emissivity.

14 SOLAR ENERGY↗

Sub-micrometer random-pyramid texturing of silicon solar wafers with excellent surface passivation and low reflectance

Select emerging solar cell technologies, ranging from very narrow screen-printed fingers to perovskite/silicon tandems, would benefit from a reduction of the height of the standard pyramidal texture of monocrystalline silicon wafers to below 1 μm. However, fabricating such small surface features usually compromises the requisite low reflectance and high passivation quality. Through systematic design of experiments, we demonstrate that conventional alkaline-based wet-chemical etching processes can be tuned to produce dense, spatially homogeneous, and uniformly sized sub-micrometer pyramids. Precise texture size can be further controlled by adding potassium silicate to the texturing solution to effectively slow the pyramid growth rate and promote nucleation. With pyramid size distribution data—extracted from multiple atomic force microscopy images across each wafer—we demonstrate 16 nanotextures with average pyramid sizes ranging from 62 to 512 nm, with the largest having only 0.3% of its pyramids taller than 1 μm. Six of the nanotextures exhibit light trapping and surface defect densities comparable to state-of-the-art microtextured wafers. In conclusion, the best nanotexture achieved an AM1.5G-weighted reflectance of 11.8% and a minority-carrier lifetime of 3.4 ms after passivation with amorphous silicon, demonstrating that smaller textures need not deteriorate solar cell performance.

14 SOLAR ENERGY↗

Development of an Attenuated Total Reflectance–Ultraviolet–Visible Probe for the Online Monitoring of Dark Solutions

Optical spectroscopy is a valuable tool for on-line monitoring of a variety of processes. Ultraviolet-visible (UV-vis) spectroscopy in particular, can monitor the concentration of analytes as well as identify speciation and oxidation state. However, it can be difficult to impossible to employ UV-vis based sensors on chemical systems that are very dark (i.e., high optical density) as exceedingly short pathlengths are required (for transmission approaches) or effective means of backscattering are needed (for reflectance approaches). Examples of processes that would benefit significantly from the use of optical sensors and encounter these challenges include used nuclear fuel recycling and molten salts with high concentrations of dissolved uranium. Utilizing an attenuated total reflectance (ATR) UV-vis approach can overcome these challenges and allow for the measurement of solutions orders of magnitude more concentrated than transmission UV-vis. However, determining ideal sensor specifications for varied processes can be time consuming and expensive. Here, in this study, we evaluate the ability for a novel ATR-UV-vis probe to measure very concentrated solutions of Co(II) and Ni(II) nitrate as well as organic dyes (methylene blue, acid red 1, and crystal violet). This sensor design provides a modular method for exploring possible “pathlengths” by altering the exposed ATR fiber length. Also studied were approaches to loading and measuring the sensor cell. These results are compared to a traditional 1 cm cuvette measured by transmission UV-vis. It was found that the ATR-UV-vis probe was capable of measuring solutions 600 times more concentrated than the 1 cm cuvette. Advanced data analysis in the form of multivariate curve resolution (MCR) was used to analyze the speciation of methylene blue over a large concentration range. The application of this novel ATR-UV-vis probe to the interrogation of dark solutions is a promising avenue for use in on-line monitoring of nuclear processes.

47 OTHER INSTRUMENTATION↗

Quantitative enhancement of fatigue crack monitoring by imaging surface acoustic wave reflection in a space-cycle-load domain

The surface wave acoustic method is applied to the in-situ monitoring of fatigue crack initiation and evolution on tension specimens. A small low-frequency periodic loading is also applied, resulting in a nonlinear modulation of reflected pulses. The acoustic wave reflections are collected for: each experimental cycle; a range of applied tension and modulation load levels; and a range of spatial propagation positions, and are presented in image form to aid pattern identification. Salient features of the image are then extracted and processed to evaluate the initiation time of the crack and its subsequent size evolution until sample failure. Additionally, a method for enhancing signal to noise ratio in Ti-6242 alloy samples is demonstrated.

36 MATERIALS SCIENCE↗

Azimuthal reflection high-energy electron diffraction study of MnAs growth on GaAs(001) by molecular beam epitaxy

Azimuthal reflection high-energy electron diffraction (ARHEED) and in situ grazing incidence synchrotron x-ray diffraction techniques are employed to investigate the growth, epitaxial orientation, and interfacial structure of MnAs layers grown on GaAs(001) by molecular beam epitaxy (MBE). We demonstrate the power and reliability of ARHEED scans as a routine tool in characterizing the formation of epitaxial films. The ARHEED scans clearly reveal the formation of the rectangular MnAs unit cell during growth on GaAs(001) for a MnAs layer thickness of 2.1 {+-} 0.2 monolayers with a tensile strain along the MnAs[1120] direction. A periodic coincidence site lattice, which is known to form along the MnAs [0001] direction to release the strain due to the huge lattice mismatch ({approx}30%) also produces periodic satellites of the diffraction spots in the ARHEED scan. The formation of different epitaxial orientations of MnAs during MBE growth can be directly observed using ARHEED scans. ARHEED is demonstrated to have a resolution similar to synchrotron x-ray diffraction with a double crystal monochromator, yielding full width at half maximum values of reflections as small as 0.005 reciprocal lattice units.

36 MATERIALS SCIENCE↗

Chain-length dependent growth dynamics of n-alkanes on silica investigated by energy-dispersive x-ray reflectivity in situ and in real-time

We compare the growth dynamics of the three n-alkanes C{sub 36}H{sub 74}, C{sub 40}H{sub 82}, and C{sub 44}H{sub 90} on SiO{sub 2} using real-time and in situ energy-dispersive x-ray reflectivity. All molecules investigated align in an upright-standing orientation on the substrate and exhibit a transition from layer-by-layer growth to island growth after about 4 monolayers under the conditions employed. Simultaneous fits of the reflected intensity at five distinct points in reciprocal space show that films formed by longer n-alkanes roughen faster during growth. This behavior can be explained by a chain-length dependent height of the Ehrlich-Schwoebel barrier. Further x-ray diffraction measurements after growth indicate that films consisting of longer n-alkanes also incorporate more lying-down molecules in the top region. While the results reveal behavior typical for chain-like molecules, the findings can also be useful for the optimization of organic field effect transistors where smooth interlayers of n-alkanes without coexistence of two or more molecular orientations are required.

36 MATERIALS SCIENCE↗

A study of the applicability of ZnO thin-films as anti-reflection coating on Cu{sub 2}ZnSnS{sub 4} thin-films solar cell

Transparent ZnO thin-films are prepared using the RF magnetron sputtering and spray pyrolysis techniques on the glass substrates. Reflectance spectra and thin films heights are measured using spectrophotometer and stylus surface profiler, respectively. Measured optical data is used for investigating the effect of the ZnO prepared by above two processes on the performance of Cu{sub 2}ZnSnS{sub 4} (CZTS) thin films solar cell (TFSC). One dimensional simulation approach is considered using the simulation program, SCAPS. External quantum efficiency and J-V characteristics of CZTS TFSC is simulated on the basis of optical reflectance data of ZnO films with and without ZnO thin-films as antireflection coating (ARC). Study shows that ARC coated CZTS TFSC provides a better fill factor (FF) as compared to other ARC material such as MgF{sub 2}. Sprayed ZnO thin-films as ARC show comparable performance with the sputtered samples.

36 MATERIALS SCIENCE↗

Reflectivity of linear and nonlinear gamma radiated apodized chirped Bragg grating under ocean

In this paper, the effect Co{sup 60} gamma radiation is investigated on the effective refractive index of apodized chirped Bragg grating. Nine apodization profiles are considered. Comparison between the reflectivity of the gamma radiated and non radiated fiber Bragg grating has been carried out. The electric field of signals propagating through the apodized chirped fiber Bragg grating (ACFBG) is first calculated from which, new values for the refractive index are determined. The nonlinear effects appear on the ACFBG reflectivity. The effect of nonlinearity and undersea temperature and pressure on the grating is also studied.

36 MATERIALS SCIENCE↗