Anion⋅⋅⋅Anion Interactions Involving σ-Holes of Perrhenate,Pertechnetate and Permanganate Anions

In this communication experimental and theoretical results are reported affording strong evidence that interactions between electron rich atoms and the metal of tetroxide anions of group 7 elements are a new case of attractive and σ-hole interactions. Single crystal X-ray analyses, molecular electrostatic potentials, quantum theory of atoms-in-molecules, and noncovalent interaction plot analyses show that in crystalline permanganate and perrhenate salts the metal in Mn/ReO₄⁻ anion can act as electron acceptors, the oxygen of another Mn/ReO₄⁻ anion can act as the donor and supramolecular anionic dimers or polymers are formed. The name matere bond (MaB) is proposed to categorize these noncovalent interactions and to differentiate them from the classical metal-ligand coordination bond.     

A fast route for the synthesis of tetrazolyl oximes by a novel multicomponent reaction between Z-chlorooximes,isocyanides and trimethylsilyl azide

A library of twenty variously decorated 1,5-disubstituted-(1H-tetrazol-5-yl)methanone oximes was prepared in one single synthetic step exploiting the combination of (Z)-chlorooximes, isocyanides and trimethylsilyl azide. The formal [3+1] cycloaddition between isocyanides and nitrile N-oxides with respect to the [3+1] cycloaddition between isocyanides and azides prevails, while the direct attack of azide onto nitrile N-oxides remains competitive. Finally, an intramolecular cyclization of a (1H-tetrazol-5-yl)methanone oxime to a benzoisoxazole tetrazole is reported for the first time.     

The dynamical problem of an elastic plate resting on a two-parameter foundation which does not react in tension

Summary This paper analyzes the dynamic problem of an elastic plate which is unilaterally constrained by a two-parameter foundation of Pasternak of Hetényi type. It is assumed that no friction exists at the area of contact. A regularizing technique has been used both in formulating the problem and in the subsequent discussion. Some results of existence and uniqueness of the solution are given. In the application example described, a finite element approach is used to numerically analyze an axisymmetric circular plate. From the numerical results obtained, it can be observed how the solution is influenced by the principal parameters involved.

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Sommario Il lavoro esamina il problema dinamico di una piastra elastica vincolata unilatepalmente su una fondazione a due parametri del tipo Hetényi o Pasternak. Il contatto è supposto privo di attrito. Il problema viene formulato e discusso mediante una tecnica di regolarizzazione: se ne forniscono alcuni risultati relativí all'esistenza ed unicità della soluzione. In particolare si analizza dal punto di vista numerico mediante discretizzazione agli elementi finiti il caso di una piastra circolare assialsimmetrica. I risultati numerici mostrano l'influenza sulla soluzione dei principali parametri da cui essa dipende.

     

Microcavity‐Stabilized Quantum Cascade Laser

Narrow‐linewidth lasers are key elements in optical metrology and spectroscopy. Spectral purity of these lasers determines accuracy of the measurements and quality of collected data. Solid state and fiber lasers are stabilized to relatively large and complex external optical cavities or narrow atomic and molecular transitions to improve their spectral purity. While this stabilization technique is rather generic, its complexity increases tremendously moving to longer wavelenghts, to the infrared (IR) range. Inherent increase of losses of optical materials at longer wavelengths hinders realization of compact, room temperature, high finesse IR cavities suitable for laser stabilization. In this paper, we report on demonstration of quantum cascade lasers stabilized to high‐Q crystalline mid‐IR microcavities. The lasers operating at room temperature in the 4.3‐4.6 μm region have a linewidth approaching 10 kHz and are promising for on‐chip mid‐IR and IR spectrometers.

     

Orbital Tubes

A novel graphical presentation is proposed to convey information about relevant dynamic phenomena and behaviour of a rotor. The orbital tube is a three-dimensional plot in which the orbits are stacked in the third dimension at various rotating speeds. It may be conveniently used to represent and analyse data obtained from analytical, numerical and experimental means. Some illustrating examples are reported.     

Hemodynamic response (BOLD/fMRI) in focal epilepsy with reference to benzodiazepine effect

We studied a new procedure of BOLD/fMRI acquisition in epilepsy. They use the benzodiazepine effect to achieve a more reliable baseline for statistical analysis. The method works only in the MR domain without EEG correlation. It compares the EPI images during interictal epileptic discharges and the images “inactivated” by benzodiazepine.

The results in five out of eight patients show that this procedure in comparison with the EEG/fMRI method gives a net improvement of spatial definition of BOLD areas. These preliminary results seem to confirm the hypothesis that the better BOLD/fMRI procedure in epilepsy is to make use of physical features of MR that, unlike EEG, is not influenced by the distance of intercerebral sources and consequently allows a more complete and undistorted display of BOLD areas.     

The impact behavior of polyethylene: A new vista

Recent advances in the analysis of the fracture behavior of polyethylene have been reviewed specifically to establish the nature and extent of morphological changes. It has been shown that in the case of linear low-density polyethylene (LLDPE), reorganization and orientation of lamellae occur in the shear lips region, the pattern being influenced by differences in molecular structure. Crazes, on the other hand, are characterized by the presence of voiding, with no significant effect on the original morphology.     

Molecular dynamics study of thermal diffusion in a binary mixture of alkanes trapped in a slit pore

We have used direct non-equilibrium molecular dynamics computer simulations to study the influence of an aluminosilicate slit pore on thermal diffusion in equimolar methane- n -decane. We have computed the Soret coefficient S T as a function of the pore width. The S T values deviate from those in a pore-free situation only for pores narrower than 35 Å. We have then investigated the possible causes for this deviation. We have noticed that the solid behaves as a thermal short circuit for the liquid but this has no consequence on the thermal and solutal profiles in the mixture. The main influence of the confinement of the liquid lies in the 'freezing' of the layer of molecules in contact with the pore walls. Outside this layer, the thermal diffusive behaviour of the mixture does not depart from that in the bulk fluid. This finding has enabled us to compute a 'corrected' Soret coefficient where the influence of the porous medium is eliminated.     

Theory of the thermal magnetocapacitance of multicomponent silicate glasses at low temperature

An explanation is put forward for the early findings of Zeller and Pohl (, Phys. Rev. B, 4, 2029) and, in particular, Stephens (, Phys. Rev. B, 13, 852), and then for the more comprehensive recent findings of Meißner and Strehlow () for the anomalous magnetic-field-dependent behaviour of the heat capacity of some multicomponent glasses at low temperature (0.1?<?T?<?4?K) and in weak-to-moderate fields (0?<?B?<?8T). An essential new ingredient of this theory, together with the standard two-level system approach for cold glasses, is a multi-minima local potential for the quantum motion of metallic ions between near-degenerate wells, separated by relatively shallow barriers. Taking the tunneling entities as independent and assuming a novel probability distribution for the parameters of the multi-welled potential, an expression for the heat capacity C(T,B) is obtained with features that match rather well the reported unusual experimental data for the glasses. The indication coming from this theory for the data available is that the entities involved in tunnelling are nanoclusters of coherent ions.