Raman Spectroscopy of Nanocrystalline Ceria and Zirconia Thin Films

The results of Raman-scattering studies of nanocrystalline CeO₂ and ZrO₂:16% Y (YSZ) thin films are presented. The relationship between the lattice disorder and the form of the Raman spectra is discussed and correlated with the microstructure. It is shown that the Raman line shape results from phonon confinement and spatial correlation effects and yields information about the material nonstoichiometry level.     

Mechanism of ZrTiO4 Synthesis by Mechanochemical Processing of TiO2 and ZrO2

High-energy ball milling initiates a solid-state reaction in an equimolar mixture of TiO₂ and ZrO₂. The first stage of ball milling induced the transformation of anatase TiO₂ to high-pressure phase TiO₂ (II), isostructural with ZrTiO₄. The formation of solid solutions monoclinic ZrO₂/TiO₂ and TiO₂ (II)/ZrO₂ was observed in the intermediate stage. Afterward, a nanosized ZrTiO₄ phase was formed in the milled product from the TiO₂ (II)/ZrO₂ solid solution. The sintering of the milled product at a temperature <1100°C was examined in situ by Raman spectroscopy. The full solid-state reaction toward ZrTiO₄ ceramic is completed at a temperature considerably lower than reported in the literature.     

Measurement of soybean fatty acids by near-infrared spectroscopy: Linear and nonlinear calibration methods

A key element of successful development of new soybean cultivars is availability of inexpensive and rapid methods for measurement of FA in seeds. Published research demonstrated applicability of NIR spectroscopy for FA profiling in oilseeds. The objectives of this study were to investigate the applicability of NIR spectroscopy for measurement of FA in whole soybeans and compare performance of calibration methods. Equations were developed using partial least squares (PLS), artificial neural networks (ANN), and support vector machines (SVM) regression methods. Validation results demonstrated that (i) equations for total saturates had the highest predictive ability (r ²=0.91–0.94) and were usable for quality assurance applications, (ii) palmitic acid models (r ²=0.80–0.84) were usable for certain research applications, and (iii) equations for stearic (r ²=0.49–0.68), oleic (r ²=0.76–0.81), linoleic (r ²=0.73–0.76), and linolenic (r ²=0.67–0.74) acids could be used for sample screening. The SVM models produced significantly more accurate predictions than those developed with PLS. ANN calibrations were not different from the other two methods. Reduction in the number of calibration samples reduced predictive ability of all equations. The rate of performance degradation of SVM models with sample reduction was the lowest.     

Electrostatic capillary collector for in-situ spectroscopic analysis of aerosols

Identification of particulate matter is important in assessing an individual’s exposure to potentially harmful particles, such as aeroallergens, toxins, and emissions from combustion sources, which can contribute to cardio-pulmonary diseases. Efficient collection of aerosols is essential for aerosol exposure studies such as analysis of chemical and biological components. We present the design and evaluation of a capillary collector that collects PM_2.5 onto the outer surface of a capillary for in-situ spectroscopic analysis. The capillary collector uses a needle-to-ring corona generator to charge particles; the electric field between a cylinder and a wire inserted into the bore of a capillary is used to collect the charged particles. Corona and repelling voltages are optimized for maximum collection of ambient PM_2.5 particles and fluorescent polystyrene latex microspheres in the PM_2.5 size range, on the capillary. The capillary collection efficiency of ambient PM_2.5 at 3 slpm operating flow rate and optimal operating voltages is 63%. Fluorescence spectroscopy is used to quantify the collection of polystyrene latex microspheres. The fluorescence-based capillary collection efficiency is in close agreement with the capillary collection efficiency of ambient PM_2.5. The collection and analysis methodology can be used to develop a compact, low-cost sensor for in-situ spectroscopic analysis of aerosols to determine their chemical composition for source apportionment.

Copyright © 2019 American Association for Aerosol Research     

Crystallization behavior of polymer/montmorillonite nanocomposites. Part II. Intercalated poly(ε-caprolactone)/montmorillonite nanocomposites

The combination of surfactant modified montmorillonite (MMT) silicate layers, poly(ε-caprolactone) (PCL) and the adopted melt processing procedure results in intercalated nanocomposites in which the silicate layers act as nucleating agents for the crystallization of the PCL matrix and by which in turn the overall crystallization rate increases. At a sufficiently high MMT concentration and degree of supercooling the polymer-swollen silicate layer stacks disturb crystal growth, resulting in a decrease in the overall crystallization rate. Simultaneous, time resolved, synchrotron small and wide angle X-ray scattering experiments reveal that—when the retarding effect is absent at a sufficiently high temperature—the final semicrystalline structures of pure PCL and its nanocomposites are identical. The poorer nucleation in the case of pure PCL, however, results in a time wise smearing of primary and secondary crystallization whereas in the nanocomposites these events are well separated due to a nucleation induced, efficient and rapid primary crystallization. Secondary crystallization involves the insertion of new lamellar crystals in between the already existing ones.     

Verification of randomized consensus algorithms under round-rigid adversaries

International Journal on Software Tools for Technology Transfer - Randomized fault-tolerant distributed algorithms pose a number of challenges for automated verification: (i) parameterization in...     

Effects of Al:Si and (Al + Na):Si ratios on the properties of the international simple glass,part II: Structure

High-alumina containing high-level waste (HLW) will be vitrified at the Waste Treatment Plant at the Hanford Site. The resulting glasses, high in alumina, will have distinct composition-structure-property (C-S-P) relationships compared to previously studied HLW glasses. These C-S-P relationships determine the processability and product durability of glasses and therefore must be understood. The main purpose of this study is to understand the detailed structural changes caused by Al:Si and (Al + Na):Si substitutions in a simplified nuclear waste model glass (ISG, international simple glass) by combining experimental structural characterizations and molecular dynamics (MD) simulations. The structures of these two series of glasses were characterized by neutron total scattering and ²⁷Al, ²³Na, ²⁹Si, and ¹¹B solid-state nuclear magnetic resonance (NMR) spectroscopy. Additionally, MD simulations were used to generate atomistic structural models of the borosilicate glasses and simulation results were validated by the experimental structural data. Short-range (eg, bond distance, coordination number, etc) and medium-range (eg, oxygen speciation, network connectivity, polyhedral linkages) structural features of the borosilicate glasses were systematically investigated as a function of the degree of substitution. The results show that bond distance and coordination number of the cation-oxygen pairs are relatively insensitive to Al:Si and (Al + Na):Si substitutions with the exception of the B-O pair. Additionally, the Al:Si substitution results in an increase in tri-bridging oxygen species, whereas (Al + Na):Si substitution creates nonbridging oxygen species. Charge compensator preferences were found for Si-[NBO] (Na⁺), ^[3]B-[NBO] (Na⁺), ^[4]B (mostly Ca²⁺), ^[4]Al (nearly equally split Na⁺ and Ca²⁺), and ^[6]Zr (mostly Ca²⁺). The network former-BO-network former linkages preferences were also tabulated; Si-O-Al and Al-O-Al were preferred at the expense of lower Si-O-^[3]B and ^[3]B-O-^[3]B linkages. These results provide insights on the structural origins of property changes such as glass-transition temperature caused by the substitutions, providing a basis for future improvements of theoretical and computer simulation models.     

INSIGMA: an intelligent transportation system for urban mobility enhancement

Intelligent Transportation Systems (ITS) aim to improve safety, mobility and environmental performance of road transport. The INSIGMA project provides a fresh look at the possible innovations in this field, by enhancing the functionality and accuracy of ITS in urban environments. This paper describes the architecture, sensors, processing algorithms, output modules and advantages of the developed system. A comparison of existing ITS systems has been provided as background. Special attention has been given to performance and privacy issues, as the system includes social aspects such as location monitoring.     

HFPaC: GPU friendly height field parallel compression

In this paper, we present a novel method for fast lossy or lossless compression and decompression of regular height fields. The method is suitable for SIMD parallel implementation and thus inherently suitable for modern GPU architectures. Lossy compression is achieved by approximating the height field with a set of quadratic Bezier surfaces. In addition, lossless compression is achieved by superimposing the residuals over the lossy approximation. We validated the method’s efficiency through a CUDA implementation of compression and decompression algorithms. The method allows independent decompression of individual data points, as well as progressive decompression. Even in the case of lossy decompression, the decompressed surface is inherently seamless. In comparison with the GPU-oriented state-of-the-art method, the proposed method, combined with a widely available lossless compression method (such as DEFLATE), achieves comparable compression ratios. The method’s efficiency slightly outperforms the state-of-the-art method for very high workloads and considerably for lower workloads.