Optimization of the vane geometry

The use of nonstandard geometries like the vane is essential to measure the rheological characteristics of complex fluids such as non-Newtonian fluids or particle dispersions. For this geometry which is of Couette type, there is no analytical simple model defining the relation between the shear stress and the torque or relating the angular velocity to the shear rate. This study consists on calibrating a nonstandard vane geometry using a finite volume method with the Ansys Fluent software. The influence of geometrical parameters and rheological characteristics of the complex fluids are considered. First, the Newtonian fluid flow in a rotative vane geometry was simulated and a parametric model is derived therefrom. The results show an excellent agreement between the calculated torque and the measured one. They provide the possibility to define equivalent dimensions by reference to a standard geometry with concentric cylinders where the relationships between shear stress (resp. shear rate) and the torque (resp. the angular rotation) are classical. Non-Newtonian fluid flows obeying a power law rheology with different indices were then simulated. The results of these numerical simulations are in very good agreement with the preceding Newtonian-based model in some ranges of indices. The absolute difference still under 5 % provided the index is below 0.45. Finally, this study provides a calibration protocol in order to use nonstandard vane geometries with various heights, gaps, and distance to the cup bottom for measuring the rheology of complex fluids like shear thinning fluids and concentrated suspensions.     

Préparation,caractérisation et réactivité de l’acide 1-vanado-11-molybdo-phosphorique supporté sur des matériaux silicatés mésoporeux dans l’oxydation du propène

The H₄PMo₁₁VO₄₀ heteropolyacid (HPA) was supported at 30 wt.% by the dry impregnation method on HMS, CMI-1 and SBA-15 mesoporous materials. The state of the HPA and those of the supports were examined by nitrogen physisorption, X-ray diffraction, (DR) FT–IR and X-ray photoelectron spectroscopies, thermal analysis (TG–ATD) and scanning electron microscopy (SEM). The effect of support on the catalytic behavior of H₄PMo₁₁VO₄₀ was studied in the propene oxidation at 350 °C. It was shown that the presence of H₄PMo₁1VO₄₀, modifies the textural properties of mesoporous materials (decrease of surface area) without destroying their structure. The interaction support–heteropolyacid leads to the formation of (SiOH²⁺)(H₃PMo₁₁VO₄₀^?) surface species more stable than H₄PMo₁₁VO₄₀ species and that appear to be the active sites in the propene oxidation.     

Electrophoretic deposition of PVA coated hydroxyapatite on 316L stainless steel

Polyvinyl alcohol (PVA) coated hydroxyapatite was deposited onto a 316L stainless steel substrate by electrophoretic deposition. Deposition was carried out in a methanol suspension at pH 5.5 using a graphite rod as an anode. Parameters such as PVA concentration, deposition voltage and time were optimized to achieve a homogeneous, crack-free adhesive coating. Techniques such as X-ray diffraction and Fourier transform infrared spectroscopy were used to study the phase composition of the coated materials and the stability of hydroxyapatite in the presence of PVA.     

Magnesium azaphthalocyanines: an emerging family of excellent red-emitting fluorophores

Magnesium(II), zinc(II), and metal-free phthalocyanines (Pcs) and azaphthalocyanines (AzaPcs) containing alkylsulfanyl, aryloxy, and dialkylamino peripheral substituents have been synthesized. The complexation of magnesium(II) by metal-free Pcs and AzaPcs has been studied in detail to determine the optimal reaction conditions necessary to ensure a complete conversion. Photophysical and photochemical measurements in tetrahydrofuran showed that magnesium(II) AzaPcs with aryloxy and alkylsulfanyl substituents have excellent fluorescent properties (Φ(F) up to 0.73) and that the corresponding zinc(II) Pcs are efficient singlet oxygen producers (Φ(Δ) up to 0.68). The presence of dialkylamino substituents causes intramolecular charge transfer within the molecule that competes with fluorescence and singlet oxygen formation. Alkylsulfanyl MgAzaPc and ZnAzaPc were the most photostable compounds among the series of studied derivatives. In addition, high molar absorption coefficients (ε ～ 300,000 M(-1) cm(-1)), absorption (λ(max) ～ 650 nm), and emission (λ(em) ～ 660 nm, high Φ(F)) in the red region suggest that these molecules are potential fluorescent probes that are superior to the commercial red cyanine dye Cy5. MgAzaPc, when incorporated into lipidic bilayers of liposomes, maintains excellent fluorescence properties (Φ(F) = 0.64). Water-soluble MgAzaPc with quaternary ammonium peripheral substituents retained a high fluorescence quantum yield even in water (Φ(F) = 0.25). The described properties show that magnesium(II) AzaPcs are excellent red-emitting fluorophores with potential applications as fluorescent probes in sensing or in vitro imaging applications.     

A local boundary condition coupled to a finite element method to compute guided modes of optical fibres under the weak guidance assumptions

An efficient method coupling a local boundary condition to a finite element technique is proposed to compute guided modes of optical fibres under the weak guidance assumptions. This method is designed to provide accurate solutions for optical fibres with no restriction on their shape as well as on their refractive index profile. Several numerical experiments are performed to demonstrate this point. Copyright © 2000 John Wiley & Sons, Ltd.     

Belief and Possibility Belief Interval-Valued N-Soft Set and Their Applications in Multi-Attribute Decision-Making Problems

In this research article, we motivate and introduce the concept of possibility belief interval-valued N-soft sets. It has a great significance for enhancing the performance of decision-making procedures in many theories of uncertainty. The N-soft set theory is arising as an effective mathematical tool for dealing with precision and uncertainties more than the soft set theory. In this regard, we extend the concept of belief interval-valued soft set to possibility belief interval-valued N-soft set (by accumulating possibility and belief interval with N-soft set), and we also explain its practical calculations. To this objective, we defined related theoretical notions, for example, belief interval-valued N-soft set, possibility belief interval-valued N-soft set, their algebraic operations, and examined some of their fundamental properties. Furthermore, we developed two algorithms by using max-AND and min-OR operations of possibility belief interval-valued N-soft set for decision-making problems and also justify its applicability with numerical examples.     

Microwave spectral emission from a glow discharge-filled 18–26 GHz fabry-perot cavity spectrometer

A Fabry-Perot semiconfocal cavity resonator containing air at reduced pressure forms part of a Stark-modulated microwave spectrometer operated near the water 22.235-GHz (6₁₆–5₂₃) and ammonia 23.870 GHz (J = 3, K = 3) absorption lines. A glow discharge is formed in the cavity by an 8.333-kHz sinusoidal electric field of strength up to 140 kV m^?1. Under these conditions in the pressure region near 0.01–1 mbar, microwave emission from water and ammonia is observed when microwave energy between 4 to 6 dBm (source output power) at frequencies near that of the line is coupled into the cavity. Spectral features indicate that the emitting molecules arise from recombination of H + OH and H + NH₂. Predischarge features indicate that H₂O is excited directly by electron impact with simultaneous dissociation to OH and its excitation. NH₃ appears to be excited indirectly by energy transfer possibly from a metastable state resulting in dissociation to radicals in the discharge. Significant signal/noise treatment of the signals is found, compared with signals arising from coventional rotational (H₂O) or inversion (NH₃) absorption at these lines.     

Evaluation of antibacterial and antioxidant activities of Artemisia campestris (Astraceae) and Ziziphus lotus (Rhamnacea)

The present work quantitatively evaluates the antimicrobial and antioxidant potentials of two Libyan folk medicinal plants [Artemisia campestris (Astraceae) and Ziziphus lotus (Rhamnacea)] that commonly grow in the south of Libya. The crude methanolic leaves extracts of both plants are appreciably active against Gram-positive species, associated with week anti-Gram-negative activity. These two plant extracts also showed reasonably high contents of polyphenolics and alkaloids, with minimal inhibitory concentrations between 12.5–25 and 250–1000 μg/ml for Gram-positive and Gram-negative species, respectively. Results collectively suggest that A. campestris and Z. lotus are not only reliable natural sources of antimicrobials but also potential sources of phenolic antioxidants and hence could be nominated for future intensive studies.     

Intramolecular BSSE and dispersion affect the structure of a dipeptide conformer

B3LYP and MP2 calculations with the commonly-used 6-31+G(d) basis set predict qualitatively different structures for the Tyr–Gly conformer book1, which is the most stable conformer identified in a previous study. The structures differ mainly in the ψ_tyr Ramachandran angle (138° in the B3LYP structure and 120° in the MP2 structure). The causes for the discrepant structures are attributed to missing dispersion in the B3LYP calculations and large intramolecular BSSE in the MP2 calculations. The correct ψ_tyr value is estimated to be 130°. The MP2/6-31+G(d) profile identified an additional conformer, not present on the B3LYP surface, with a ψ_tyr value of 96° and a more folded structure. This minimum is, however, likely an artefact of large intramolecular BSSE values. We recommend the use of basis sets of at least quadruple-zeta quality in density functional theory (DFT), DFTaugmented with an empirical dispersion term (DFT-D) and second-order Møller-Plesset perturbation theory (MP2 ) calculations in cases where intramolecular BSSE is expected to be large.