A computational study into the reactivity of epichlorohydrin and epibromohydrin under basic conditions in the gas phase and solution

Ab initio molecular orbital calculations were carried out on epibromohydrin (EBH) and epichlorohydrin (ECH) in an attempt to elucidate their reactivity with respect to a hard nucleophile, hydroxide. These systems were modeled in both the gas phase and a polar solvent under basic conditions. In the gas phase, it was determined that a direct displacement mechanism (nucleophilic attack at the C1 position) was operative for EBH, while an indirect pathway (nucleophilic attack at the C3 position and subsequent intramolecular displacement) was followed for ECH. In an acetone solution, only the indirect displacement mechanism was found to occur. An electrostatic argument is advanced to account for this behavior in polar solution. Copyright © 2007 John Wiley & Sons, Ltd.     

Continuity of the Solution Map in Parametric Affine Variational Inequalities

A systematic study of the upper semicontinuity and the lower semicontinuity of the solution map in parametric affine variational inequalities is given in this paper. Several examples are constructed to analyze the results. This work was supported by Korea Research Foundation Grant (KRF 2001-015-DP0049), the APEC Postdoctoral Fellowships Program, and the KOSEF Brain Pool Program.     

第三类Painlevé方程(δ=0或γ=0)解的渐近性态

对带有一般实参数第三类Painlevé方程,已有γ<0,δ>0时,解的有界性以及振荡渐近解的表达形式的结论.在本文中,我们给出当δ=0或γ=0时其振荡渐近解的表达形式.     

Insight into chain dimensions in PEO/water solutions

Small‐Angle Neutron Scattering has been performed from poly(ethylene oxide) in deuterated water at temperature ranging from 10 to 80 °C. A simple fitting model was used to obtain a correlation length and a Porod exponent. The correlation length L characterizes the average distance between entanglements in the semidilute region and is proportional to the individual coil sizes in the dilute region. L was found to increase with temperature in the semidilute region but it decreases with temperature in the dilute region. This decrease is the precursor to the single‐chain collapse which applies to very dilute polymer solutions. © 2007 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys 45: 2196–2200, 2007     

Numerical Computation of Figure-eight Solution for 3-body Problems

The main goal of this paper is to compute the Figure-eight solutions for the planar Newtonian 3-body problem with equal masses by finding the critical points of the functional associated with the motion equations of 3-body in plane R2. The algorithm adopted here is the steepest descent method, which is simple but very valid for our problem.     

Periodic solutions for p-Laplacian neutral functional differential equation with multiple deviating arguments

By using the theory of coincidence degree, we study a kind of periodic solutions to p-Laplacian neutral functional differential equation with multiple deviating arguments, a new result on the existence of periodic solutions is obtained.     

Periodic and subharmonic solutions of a class of subquadratic second-order Hamiltonian systems

Some solvability conditions of periodic and subharmonic solutions are obtained for a class of subquadratic nonautonomous second-order Hamiltonian systems by the minimax methods in critical point theory.     

The Cauchy Problem of the Nonlinear Schr■dinger Equations in R~(1 1)

In this paper,we consider the local and global solution for the nonlinear Schrdinger equationwith data in the homogeneous and nonhomogeneous Besov space and the scattering result for small data.Thetechniques to be used are adapted from the Strichartz type estimate,Kato's smoothing effect and the maximalfunction(in time)estimate for the free Schrdinger operator.     

Bifurcations of Invariant Tori and Subharmonic Solutions of Singularly Perturbed System

This paper deals with bifurcations of subharmonic solutions and invariant tori generated from limit cycles in the fast dynamics for a nonautonomous singularly perturbed system. Based on Poincare map, a series of blow-up transformations and the theory of integral manifold, the conditions for the existence of invariant tori are obtained, and the saddle-node bifurcations of subharmonic solutions are studied.     

一类具有转向点问题的n阶近似解

用Langer变换和Olver变换求得一类具有转向点问题的n阶近似解:y(x)=v(x)ψ(x),其中ψ=λ12-14×(x2-1)14,2332=-λx∫11-τ2dτ,v(z)=A(z,λ)ξ(λ23z)+B(z,λ)'ζ(λ23z).并探讨了其特征值问题,得到λn=4n+1112,n=0,1,2….由此给出了该类问题的解的一般性结论.