Anharmonic effects in large-amplitude vibrations of metal clusters

Two types of extreme collective motion, large-amplitude many-phonon vibration of the ionic core and rotation of the cluster with high angular momenta, are considered. The interplay between vibration and collective motion towards fission is discussed. A new mechanism of formation and rupture of the neck is proposed which is based on the Franck-Condon principle, and accounts for the interplay between vibration and fission. Under rotation, the change of the shape of the cluster and a phase transition from axially symmetric to triaxial ellipsoid are predicted. For studying the effects, vibrational motion can be induced by laser radiation. Rotational motion may arise in collisions of clusters. Received 26 April 2001 and Received in final form 15 October 2001     

Bosonic Monocluster Expansion

We compute Green's functions of a Bosonic field theory with cutoffs by means of a “minimal” expansion which in a single move, interpolating a generalized propagator, performs the usual tasks of the cluster and Mayer expansion. In this way it allows a direct construction of the infinite volume or thermodynamic limit and it brings constructive Bosonic expansions closer to constructive Fermionic expansions and to perturbation theory. Received: 18 May 2000 / Accepted: 21 March 2001     

Multivalued differential equations on closed convex sets in Banach spaces

New derivation results for integrands and multifunctions via the Lipschitzean approximations are obtained. Applications to multivalued differential equations on closed convex sets are presented.     

Aspects of the transpiration model for aerofoil design

Transpiration is a technique in which extra non-physical normal flows are created on an aerofoil surface in order to form a new streamline pattern such that the surface streamlines no longer follow the aerofoil surface under inviscid flow. The transpiration model is an important technique adopted in aerofoil design either to avoid mesh regeneration when aerofoil profile co-ordinates are adjusted or to find shape corrections in inverse design methods. A first-order approximation (with respect to the normal streamline displacement) to the transpiration model is commonly adopted; it is shown that this can be a poor approximation especially in regions of high curvature. In this paper more accurate approximations are developed to address this problem and improve the accuracy.     

Performance and analysis of saddle point preconditioners for the discrete steady-state Navier-Stokes equations

Summary. We examine the convergence characteristics of iterative methods based on a new preconditioning operator for solving the linear systems arising from discretization and linearization of the steady-state Navier-Stokes equations. With a combination of analytic and empirical results, we study the effects of fundamental parameters on convergence. We demonstrate that the preconditioned problem has an eigenvalue distribution consisting of a tightly clustered set together with a small number of outliers. The structure of these distributions is independent of the discretization mesh size, but the cardinality of the set of outliers increases slowly as the viscosity becomes smaller. These characteristics are directly correlated with the convergence properties of iterative solvers. Received August 5, 2000 / Published online June 20, 2001     

An experimental and computational investigation of crack initiation and stable crack growth of ductile materials

Crack initiation and stable crack growth under monotonic loading in steels has been studied using an elastic-plastic finite element analysis. The fracture criterion used for crack initiation and stable crack growth was the critical strain energy density. In addition the shift core method for the analysis of crack extension was used. In the shift core modelling method, crack advance is simulated by moving the coordinates of the core region which surrounds the crack tip, to obtain the stiffness reduction. Simultaneously the core itself geometrically undergoes a simple rigid-body motion or translation during the crack extension. The analytically calculated and experimentally measured load for crack initiation and the subsequent stable crack growth agreed well.     

Distribution of melamine in polyester–melamine surface coatings cured under nonisothermal conditions

The influence of experimental cure parameters on the diffusion of reactive species in polyester–melamine thermoset coatings during curing has been investigated with X‐ray photoelectron spectroscopy and attenuated total reflectance Fourier transform infrared. The diffusion of melamine plays a vital role in the curing process and, therefore, in the ultimate properties of coatings. At a low (<20%) hexamethoxymethylmelamine (HMMM) crosslinker concentration, the matrix composition is uniform, but at high HMMM concentrations, excess HMMM rapidly segregates to the air–coating interface. The rate of migration is governed by the difference in the surface free energies of polyester and HMMM and the concentration gradient of HMMM between the bulk and the surface. An increased rate of energy absorption also increases the rate of migration of HMMM to the surface. A physical model has been proposed to explain this surface segregation phenomenon in terms of cocondensation and self‐condensation reactions. It suggests that an appropriate amount of melamine can be segregated on the surface and allowed to self‐condense to form a desired thickness of a melamine topcoat through the control of the binder composition and cure conditions. This technique can be implemented to apply a melamine topcoat during cure. © 2003 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 42: 83–91, 2004     

Influence of preparation method on SrMoO4 impurity content and magnetotransport properties of double perovskite Sr2FeMoO6 polycrystals

The magnetic and electric properties of the Sr₂FeMoO₆ compound produced under different preparation conditions were studied. Depending on the preparation condition, a strong variation in the nonmagnetic SrMoO₄ impurity content was found, which in turn determined the metallic or semiconducting behavior of the resistivity of the Sr₂FeMoO₆ compound. There was also evidence that SrMoO₄ played a crucial role in modifying the low magnetic field intergrain tunneling magnetoresistance in Sr₂FeMoO₆. In addition, we have established a simple method to prepare the single phase Sr₂FeMoO₆ polycrystals.