On the convergence rate and optimization of a numerical method with splitting of boundary conditions for the stokes system in a spherical layer in the axisymmetric case: Modification for thick layers

The convergence rate of a fast-converging second-order accurate iterative method with splitting of boundary conditions constructed by the authors for solving an axisymmetric Dirichlet boundary value problem for the Stokes system in a spherical gap is studied numerically. For R/r exceeding about 30, where r and R are the radii of the inner and outer boundary spheres, it is established that the convergence rate of the method is lower (and considerably lower for large R/r) than the convergence rate of its differential version. For this reason, a really simpler, more slowly converging modification of the original method is constructed on the differential level and a finite-element implementation of this modification is built. Numerical experiments have revealed that this modification has the same convergence rate as its differential counterpart for R/r of up to 5 × 10³. When the multigrid method is used to solve the split and auxiliary boundary value problems arising at iterations, the modification is more efficient than the original method starting from R/r ～ 30 and is considerably more efficient for large values of R/r. It is also established that the convergence rates of both methods depend little on the stretching coefficient η of circularly rectangular mesh cells in a range of η that is well sufficient for effective use of the multigrid method for arbitrary values of R/r smaller than ～ 5 × 10³.     

一类二阶两点边值问题的单调迭代方法

通过改进经典的单调迭代方法对于一类二阶两点边值的问题的正解建立了单调迭代程序。这些迭代程序都是从常值函数开始的，因而是可行并且有效的。     

Banach空间二阶非线性脉冲微分-积分方程的极值解

通过建立一个新的比较定理研究了B anach空间二阶非线性混合型脉冲微分-积分方程初值问题的极值解,所得结果推广和改进了现有文献的主要结果.     

Modifications of the Wolfe Line Search Rules to Satisfy Second-Order Optimally Conditions in Unconstrained Optimization

The line search method incorporating the Wolfe conditions is modified to ensure that a descent algorithm terminates in a finite number of steps at an approximate stationary point where the second-order conditions of optimality are satisfied. A simple procedure based on conjugate directions is proposed to determine directions of negative curvature.     

An efficient algorithm for elasto-viscoplastic vibrations of multi-layered composite beams using second-order theory

An efficient time-domain algorithm for plane non-linear flexural vibrations of multi-layered composite beams, which are driven into the inelastic range by severe transverse loadings, is presented. The influence of an axial static preload is considered in the sense of the quasi-linear second-order theory of structures. The inelastic parts of strain are treated as additional sources of selfstress in the linear elastic background-structure, driving the elastic response into the inelastic one. The efficiency of this exact formulation lies in the fact that linear solution techniques can be used in their most powerful form: Rubin's useful formulation for the quasi-static second-order transfer-matrix of linear elastic structures is applied in combination with modal analysis. Having in mind multi-metal beams, the classical lamination theory is assumed to be valid. Beams with overhang composed of ideal elastic-plastic and viscoplastic layers are studied as example structures. The fictitious sources of selfstress are calculated from the different material laws of the layers in a numerical time-stepping procedure, where a generalized midpoint-rule in combination with Crisfield's secant-Newton procedure is used.     

Model-Free Analysis of Mixtures by NMR Using Blind Source Separation

The concept of blind source separation is described and examples of its use in 1D and 2D NMR spectroscopy are presented. The goal of this data processing method is to extract the spectra of components molecules when only mixtures are available.     

半正二阶三点边值问题的解和正解

考察了非线性二阶三点边值问题的n个解和正解的存在性,其中允许非线性项有一个负的下界并且n是一个任意的自然数．主要结论表明该问题可以具有n个解或者正解,只要非线性项在某些有界集上的“高度”是适当的．     

Second-order necessary optimality conditions for domain optimization problems of the Neumann type

In this paper, we treat a domain optimization problem in which the boundary-value problem is a Neumann problem. In the case where the domain is in a three-dimensional Euclidean space, the first-order and the second-order necessary conditions which the optimal domain must satisfy are derived under a constraint which is the generalization of the requisite of constant volume.Portions of this paper were presented at the 13th IFIP Conference on System Modelling and Optimization, Tokyo, Japan, 1987.     

On sequential procedures for the point estimation of the mean of a normal population

The sequential procedures developed by Starr (1966, Ann. Math. Statist., 37, 1173–1185) for estimating the mean of a normal population are further analyzed. Asymptotic properties of the regret and first two moments of the stopping rules are studied and second-order approximations are derived.     

Relativistic atomic natural orbital type basis sets for the alkaline and alkaline-earth atoms applied to the ground-state potentials for the corresponding dimers

New basis sets of the atomic natural orbital (ANO) type have been developed for the atoms Li–Fr and Be–Ra. The ANOs have been obtained from the average density matrix of the ground states and the lowest excited states of the atom, the positive ion, and the dimer at its equilibirium geometry. Scalar realtivisitc effects are included through the use of a Douglas–Kroll Hamiltonian. Multiconfigurational wave functions have been used with dynamic correlation included using second-order perturbation theory (CASSCF/CASPT2). The basis sets are applied in calculations of the ground-state potentials for the dimers. Computed bond energies are accurate to within 0.05 eV for the alkaline dimers and 0.02 eV for the alkaline-earth dimers (except for Be₂).Acknowledgments.ensp;B.O.R. would like to express his gratitude to Prof. Jacopo Tomasi for all the inspiration that his scientific work has given him through the years and continues to do in particular through the work on solvent effects on molecular properties. This work has been supported by a grant from the Swedish Science Research Council, VR.Contribution to the Jacopo Tomasi Honorary Issue