Electronic and photophysical properties of a novel phenol bound dinuclear ruthenium complex: evidence for a luminescent mixed valence state

A novel dinuclear ruthenium(II) complex bridged by dianionic bridge 3-(2-phenol)-5-(pyridin-2-yl)-1,2,4-triazole in which the ruthenium metal atoms are bound through N,N coordination to the pyridine and triazole and O,N coordination to the triazole and phenolate is described. The electrochemical, spectroscopic and photophysical behaviour of the dimer is compared with its associated N,N- and O,N-coordinated mononuclear complexes. The mixed valence complex was prepared electrochemically and a weak inter-valence charge transfer transition is observed which from Hush theory provides an electronic coupling matrix element of 666 cm(-1), suggesting the complex is weakly coupled and valence trapped. In its native state the dinuclear compound is essentially non-emissive but upon the oxidation of the O,N moiety luminescence from the complex is reversibly switched on at 0.3 V and reversibly switched off by application of 1.3 or 0 V. To our knowledge this is the first report of a luminescent mixed valence ruthenium complex.     

Optimization of rod antennas of mobile phones

Two types of rod antennas of mobile phones are optimized so that the radiated energy absorbed by the head or body of the user is reduced and the radiation intensity to other areas especially to the receiver is increased. The mathematical modelling of this problem leads to an infinite dimensional bicriterial optimization problem. It is shown that this optimization problem and a discretized version of this problem are solvable. The relationship between the infinite and finite dimensional optimization problem is investigated. Numerical results are presented for mobile phones working with the GSM standards 900 and 1800.     

Methodological aspects of an adaptive multidirectional pattern search to optimize speech perception using three hearing-aid algorithms

In this study we investigated the reliability and convergence characteristics of an adaptive multidirectional pattern search procedure, relative to a nonadaptive multidirectional pattern search procedure. The procedure was designed to optimize three speech-processing strategies. These comprise noise reduction, spectral enhancement, and spectral lift. The search is based on a paired-comparison paradigm, in which subjects evaluated the listening comfort of speech-in-noise fragments. The procedural and nonprocedural factors that influence the reliability and convergence of the procedure are studied using various test conditions. The test conditions combine different tests, initial settings, background noise types, and step size configurations. Seven normal hearing subjects participated in this study. The results indicate that the reliability of the optimization strategy may benefit from the use of an adaptive step size. Decreasing the step size increases accuracy, while increasing the step size can be beneficial to create clear perceptual differences in the comparisons. The reliability also depends on starting point, stop criterion, step size constraints, background noise, algorithms used, as well as the presence of drifting cues and suboptimal settings. There appears to be a trade-off between reliability and convergence, i.e., when the step size is enlarged the reliability improves, but the convergence deteriorates.     

Enhancement of the superconducting transition temperature of MgB2 by a strain-induced bond-stretching mode softening

We report a systematic increase of the superconducting transition temperature T(c) with a biaxial tensile strain in MgB2 films to well beyond the bulk value. The tensile strain increases with the MgB2 film thickness, caused primarily by the coalescence of initially nucleated discrete islands (the Volmer-Weber growth mode.) The T(c) increase was observed in epitaxial films on SiC and sapphire substrates, although the T(c) values were different for the two substrates due to different lattice parameters and thermal expansion coefficients. We identified, by first-principles calculations, the underlying mechanism for the T(c) increase to be the softening of the bond-stretching E(2g) phonon mode, and we confirmed this conclusion by Raman scattering measurements. The result suggests that the E(2g) phonon softening is a possible avenue to achieve even higher T(c) in MgB2-related material systems.     

Sorption isotherm measurements by NMR

An experimental setup is described for the automated recording of sorption isotherms by NMR experiments at precisely defined levels of relative humidity (RH). Implementation is demonstrated for a cotton fabric; Bloch decays. T1 and T2* relaxation times were measured at predefined steps of increasing and decreasing relative humidities (RHs) so that a complete isotherm of NMR properties was obtained. Bloch decays were analyzed by fitting to relaxation functions consisting or a slow- and a fast-relaxing component. The fraction of slow-relaxing component was greater than the fraction of sorbed moisture determined from gravimetric sorption data. The excess slow-relaxing component was attributed to plasticized segments of the formerly rigid cellulose matrix. T1 and T2* sorption isotherms exhibit hysteresis similar to gravimetric sorption isotherms. However, correlating RH to moisture content (MC) reveals that both relaxation constants depend only on MC, and not on the history of moisture exposure.     

Enantioselective transport by a steroidal guanidinium receptor

The cationic steroidal receptors 9 and 11 have been synthesized from cholic acid 3. Receptor 9 extracts N-acetyl-alpha-amino acids from aqueous media into chloroform with enantioselectivities (L:D) of 7-10:1. The lipophilic variant 11 has been employed for the enantioselective transport of N-acetylphenylalanine, a) through dichloromethane (DCM) and dichloroethane (DCE) bulk liquid membranes (U-tube apparatus), and b) through 2.5% (v/v) octanol/hexane via hollow fibre membrane contactors. Significant enantioselectivities and multiple turnovers were observed for both types of apparatus.     

Wie lange gibt es noch Erdöl und Erdgas? – Reserven,Ressourcen und Reichweiten

Knowledge about the future availability of crude oil and other energy resources is crucial for politics, industry an even the consumer in the face of the drastically increased worldwide oil consumption up to more than 3, 8 Bill. t in 2004. Using oil as an example, reserves and resources, its dynamic, and the influence of non‐conventional oils (tar sands, extra heavy oil) are discussed with respect to future availability.     

Modeling of jointed structures using zero thickness interface elements

An important contribution to global damping of mechanical devices is structural damping due tomicroslip effects with friction in joint interfaces. In order to investigate the mechanical behaviour in these contact interfaces numerically, a contact element in the context of Finite Element Method (FEM) is presented. The suggested element is an isoparametric zero thickness element which is well suited for the present problem because the contact area is known and only small relative displacements occur. Arbitrary linear or nonlinear constitutive contact models for normal and tangential contact behaviour can be implemented. Using a proper parametrisation of the contact area, it is possible to apply the element in contact interfaces lying arbitrarily in space and in interfaces discretized with distorted elements. This method is described before a numerical example is compared with experimental results. (© 2008 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim)     

Taylor-model-based enclosure of invariant manifolds for planar diffeomorphisms and applications

Fundamental questions in the study of interesting dynamics of planar diffeomorphisms like the Hénon map involve homoclinic phenomena, topological entropy and strange attractors. Inherently, answering these questions requires knowledge about the stable and unstable manifolds, which in the typical case in the plane are smooth curves. We present a method to find highly accurate Taylor Model enclosures of the invariant curves near hyperbolic fixed points. Successive iteration of these local enclosures yields similarly accurate enclosures of pieces of the global manifold tangle. Applications presented include the automatic computation of rigorous enclosures of all homoclinic points up to finite iterates. This allows to find symbolic dynamics in the original system and consequently compute rigorous lower bounds for its topological entropy. (© 2008 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim)     

OptiDose: Computing the Individualized Optimal Drug Dosing Regimen Using Optimal Control

Journal of Optimization Theory and Applications - Providing the optimal dosing strategy of a drug for an individual patient is an important task in pharmaceutical sciences and daily clinical...