We present a simple analytical formalism based on the Lorentz-Scherrer equation and Bernoulli statistics for estimating the fraction of crystallites (and the associated uncertainty parameters) contributing to all finite Bragg peaks of a typical powder pattern obtained from a static polycrystalline sample. We test and validate this formalism using numerical simulations, and show that they can be applied to experiments using monochromatic or polychromatic (pink-beam) radiation. Our results show that enhancing the sampling efficiency of a given powder diffraction experiment for such samples requires optimizing the sum of the multiplicities of reflections included in the pattern along with the wavelength used in acquiring the pattern. Utilizing these equations in planning powder diffraction experiments for sampling efficiency is also discussed.
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Vibrational and structural properties of lead-free piezoelectric (1-x)Na0.5Bi0.5TiO3–xCaTiO3 (0 < x < 1.00) solid solutions have been investigated using Raman spectroscopy and X-ray diffraction. Different anomalies were detected and analyzed taking into consideration the phase transition from rhombohedral to orthorhombic phase at room temperature. All Raman bands were interpreted through the variation in the peak positions (frequency) and the corresponding half-widths at half maximum (HWHM) as a function of x. XRD used as a complementary technique to Raman spectroscopy, showed that the rhombohedral – orthorhombic phase transition went gradually through an intermediate phase consisting of a mixture of rhombohedral (R3c) and orthorhombic (Pnma) structures and that the fraction of orthorhombic phase increased with CT composition. The results show that the morphotropic phase boundary (MPB) is located between 0.09 and 0.15.
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The reaction of the alkyl complexes Cp*2LnCH(SiMe 3)2 (Ln = Y 1-Y, Ce 1-Ce, La 1-La; Cp* = η5-C5Me5) and Me2Si(η 5-C5Me4)2LnCH(SiMe3) 2 (Ln = Ce 5-Ce) with 1-methylalk-2-ynes CH3C≡CR (R = Me 3a, Et 3b, nPr 3c, tBu 3d, SiMe3 3e, Ph 3f, C6H4Me-2 3g, C6H3Me 2-2,6 3h, C6H3iPr2-2,6 3i, C6F5 3j) affords the corresponding η3-propargyl/allenyl complexes Cp*2LnCH 2CCR (4a-j-Ln) and Me2Si(η5-C 5Me4)2CeCH2CCR (6a-j-Ce) via propargylic metalation. The hydride complexes [Cp*2Ln(μ-H)] 2 (Ln = Y 2-Y, Ce 2-Ce, La 2-La) react rapidly with 3 to produce mixtures of insertion and propargylic metalation products, and the relative rate of these processes depends on the metal and alkyne substituent. Selected η3-propargy/allenyl complexes Cp*2YCH 2CCR (R = Me 4a-Y, Ph 4f-Y), Cp*2CeCH2CCR (R = Me 4a-Ce, Ph 4f-Ce), Cp*2CeCH(Me)CCEt (9b-Ce), Cp*2LaCH2CCR (R = Ph 4f-La, C6H 3Me2-2,6 4h-La) are obtained on a preparative scale and characterized by NMR spectroscopy, IR spectroscopy, and cryoscopy. Compounds 4f-Y and 4f-La are also characterized by single-crystal X-ray diffraction. The reactions of the η3-propargyl/allenyl complexes with Brønsted acids, such as alcohols and acetylenes, afford the corresponding substituted allenes (RCH=C=CH2) and 1-methylalk-2-ynes (CH 3C≡CR) as organic products. The reactions of 4f-Y and 4f-La with Lewis bases, such as pyridine and THF, yield die corresponding base adducts. The adduct 4f-La · py is characterized by single-crystal X-ray diffraction, revealing an η3-coordinated propargyl/allenyl ligand. © 2008 American Chemical Society.
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This study provides insights into novel combinations of hydrothermal modifications and mineral enrichment by demonstrating the versatility of this environmentally more benign approach compared to other common chemical starch modifications like crosslinking. Heat-moisture treatment (HMT) (15 % moisture, 100 °C) of native potato starch (NPS) affords granular products that gelatinise at lower temperatures, hold more water as gel, and are more susceptible to enzymatic digestion. Prior mineral enrichment of NPS with sodium, potassium, magnesium and calcium ions yielded significant changes in pasting curves, with monovalent cations increasing peak viscosity, while divalent cations decrease peak viscosity through ionic crosslinking of phosphate groups, allowing further fine tuning of swelling behaviour. Both short and long HMT (4 h and 16 h) triggered partial disruption of crystallinity and an increase in particle size without visible surface damage as evidenced by X-ray diffraction, laser diffraction and scanning electron microscopy. These novel products may find applications where a thickening agent is needed, and high levels of target minerals are desirable like sport nutrition. The viscosity behaviour, available energy and essential minerals may be beneficial to the formulation and nutritional value of energy gels, while adhering to clean-label requirements of today`s food industry.
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Light scattering is a fundamental property that can be exploited to create essential devices such as particle analysers. The most common particle size analyser relies on measuring the angle-dependent diffracted light from a sample illuminated by a laser beam. Compared to other non-light-based counterparts, such a laser diffraction scheme offers precision, but it does so at the expense of size, complexity and cost. In this paper, we introduce the concept of a new particle size analyser in a collimated beam configuration using a consumer electronic camera and machine learning. The key novelty is a small form factor angular spatial filter that allows for the collection of light scattered by the particles up to predefined discrete angles. The filter is combined with a light-emitting diode and a complementary metal-oxide-semiconductor image sensor array to acquire angularly resolved scattering images. From these images, a machine learning model predicts the volume median diameter of the particles. To validate the proposed device, glass beads with diameters ranging from 13 to 125 µm were measured in suspension at several concentrations. We were able to correct for multiple scattering effects and predict the particle size with mean absolute percentage errors of 5.09% and 2.5% for the cases without and with concentration as an input parameter, respectively. When only spherical particles were analysed, the former error was significantly reduced (0.72%). Given that it is compact (on the order of ten cm) and built with low-cost consumer electronics, the newly designed particle size analyser has significant potential for use outside a standard laboratory, for example, in online and in-line industrial process monitoring.
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Particle image velocimetry has been widely used in various sectors from the automotive to aviation, research, and development, energy, medical, turbines, reactors, electronics, education, refrigeration for flow characterization and investigation. In this study, articles examined in open literature containing the particle image velocimetry techniques are reviewed in terms of components, lasers, cameras, lenses, tracers, computers, synchronizers, and seeders. The results of the evaluation are categorized and explained within the tables and figures. It is anticipated that this paper will be a starting point for researchers willing to study in this area and industrial companies willing to include PIV experimenting in their portfolios. In addition, the study shows in detail the advantages and disadvantages of past and current technologies, which technologies in existing PIV laboratories can be renewed, and which components are used in the PIV laboratories to be installed.
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The research presented in this thesis has highlighted (bio)geochemical, hydrological, and wetland ecological processes that interact and enhance ecosystem development on wetlands built on fine sediment. A combination of greenhouse and laboratory experiments were conducted. Some measured data from these experiments formed important input for subsequent analysis in a modeling environment. The findings presented in Chapters 2-6 can be divided into four topics: 1) Plant–soil interactions in the terrestrial zone, 2) wetland–terrestrial processes influencing nutrient availability in the land–water zone, 3) effects of plants on sediment consolidation in the terrestrial zone, and 4) effects of bioturbation on nutrient availability in the aquatic zone. The next sections give a summary of the results for these four topics. The last section summarizes the recommendations formulated for the Marker Wadden project.
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