Polymerization of butadiene on nanoparticles’ surfaces and formation of metal/polymer nanocomposites

In this paper, we demonstrate that laser vaporization of metals in the presence of a small concentration of butadiene vapor leads to the polymerization of butadiene and incorporation of the metal nanoparticles within the polymer matrix. The metal nanocomposites are characterized by electron microscopy, X-ray diffraction and EDX. The results from high pressure mass spectrometry indicate that multiple additions of butadiene molecules on the metal cations Fe⁺, Ni⁺ and Pt⁺, generated by laser vaporization, take place at room temperature thus providing an efficient means of initiating further polymerization reactions. The Pt⁺ reactions show extensive fragmentations and elimination steps generating hydrocarbon ions. The laser vaporization/polymerization method provides the ability to encapsulate several different metals or metal oxides which undoubtedly will play a significant role in tuning the various properties of the polymer composites.     

Absorption and emission dynamics in concentrated optical ensembles under laser excitation

A new theoretical model describing the emission and absorption dynamics in an ensemble of molecules under intense coherent pulsed pumping is developed on the basis of the concepts of cooperative light-induced luminescence (CLIL). The CLIL development is described within the framework of formalism of the system density matrix in the space of photon wave functions. It is shown that the fast growth of CLIL relates to the development of coherent states of the quantum field in the area of efficient cooperative interactions of molecules (coherence volume). A system of equations for the calculation of CLIL energy, population of excited states, and optical absorption of the system in dependence on the laser pump energy density is solved. The theoretical results obtained are in good agreement with the experimental data.     

Reaction of 2-formyl-1,3-cyclohexanediones with cyanoacetamide

Chemistry of Heterocyclic Compounds -     

Complex dynamics of a simple distributed self-oscillatory model system with delay

A simple model for a distributed self-oscillatory system with cubic nonlinearity and delay is presented. Conditions for oscillation self-excitation and stationary oscillation conditions, as well as the stability of the oscillations, are analyzed. Nonstationary self-modulation regimes (including conditions of complex dynamics and chaos) are simulated numerically over a wide range of control parameters. As the factor of nonequilibrium grows, regular and chaotic regimes alternate in a complex manner. The transitions to chaos may follow all scenarios known for finite-dimensional systems. The model suggested is somewhat akin to a number of earlier finite-dimensional models aimed at studying mode competition in resonance electron masers.     

Numerical simulation and experimental validation of heat transfer within rotating flows for three‐dimensional non‐axisymmetric,turbulent conditions

A control volume type numerical methodology for the analysis of steady three‐dimensional rotating flows with heat transfer, in both laminar and turbulent conditions, is implemented and experimentally tested. Non‐axisymmetric momentum and heat transfer phenomena are allowed for. Turbulent transport is alternatively represented through three existing versions of the k–ε model that were adjusted to take into account the turbulence anisotropy promoted by rotation, streamline curvature and thermal buoyancy. Their relative performance is evaluated by comparison of calculated local and global heat balances with those obtained through measurements in a laboratory device. A modified version of the Lam and Bremhorst, low Reynolds number model is seen to give the best results. A preliminary analysis focused on the flow structure and the transfer of heat is reported. Copyright © 2002 John Wiley & Sons, Ltd.     

Growth of K(DxH1 − x )2PO4 single crystals from solutions in the K2O-P2O5-(D, H)2O system

Based on the analysis of the K₂O-P₂O₅-D₂O solubility phase diagram, the optimum conditions of KD₂PO₄ crystallization—the compositions of mother solutions and the temperature range of crystallization—in the KH₂PO₄-D₂O system have been determined. The technique of K(D_xH_{1 ? x} )₂PO₄ growth is developed. The DKDP single crystals with deuterium concentration up to 88 wt % are grown on DKDP seeds from KH₂PO₄ solutions in D₂O by the method of temperature decrease.     

The role of water vapour on the oxidation of two Ln-Si-Al-O-N glasses (Ln=Y, La)

The oxidation behaviour of LnSiAlON (Ln=Y, La) glasses was studied at different temperatures (990-1150 °C) and under different water vapour pressures (360-2690 Pa). These results were also compared with those obtained under O₂, N₂/H₂O or O₂/H₂O mixtures. When glasses are treated under a N₂/H₂O mixture, optical and SEM observations show porous scales. Transformations of the reaction rate data and a kinetic model show that there is only one limiting process occurring during oxidation. This rate limiting step is the progress of the chemical reaction at the internal interface. Determination of the pressure law dependence and thermodynamics calculations of water vapour molecules dissociation at the investigated temperatures allow us to suggest that the mechanism of oxidation corresponds to decomposition of water molecules on the oxynitride glass surface.     

Asymptotic stability of the numerical solution for an integrodifferential reaction-diffusion system

This paper presents the study of the numerical solution of a reaction-diffusion system involving a reaction term of integral type arising from biological models. By means of a monotone approach we introduce upper and lower solutions and then we show the existence and the asymptotic behavior of nonnegative numerical solutions. To this end, we require the positivity of the numerical scheme and so we can use some properties of positive and M-matrices. Finally we give some sufficient conditions to verify the asymptotic stability of the numerical solution.