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.     

Vapour and plasma ignition thresholds for visible pulsed-laser ablation of metallic targets

The coupling of visible nanosecond laser pulses to metallic targets irradiated in vacuum is studied. The expressions of the vapour and plasma ignition times are obtained. Two cases for vapour breakdown in the plasma ignition process are considered. The first case is that 40 generations of new electrons are born in vapour generation time before plasma formation as assumed in the literature. The second case is that 10 generations of new electrons are born in vapour generation time. Molybdenum (Mo), niobium (Nb) and aluminium (Al) targets are considered for illustrations of our results. The expression of the plasma ignition time for the Al target is substantially different from that reported in the literature. The vapour and plasma ignition threshold laser intensities are calculated and compared with those reported in the literature. Reasons for disagreement are discussed. The plasma ignition threshold estimated in the second case is noted to be in good agreement with the reported experimental result.     

The (1+1) Dimensional Dirac Equation With Pseudoscalar Potentials: Path Integral Treatment

The supersymetric path integrals in solving the problem of relativistic spinning particle interacting with pseudoscalar potentials is examined. The relative propagator is presented by means of path integral, where the spin degrees of freedom are described by odd Grassmannian variables and the gauge invariant part of the effective action has a form similar to the standard pseudoclassical action given by Berezin and Marinov. After integrating over fermionic variables (Grassmannian variables), the problem is reduced to a nonrelativistic one with an effective supersymetric potential. Some explicit examples are considered, where we have extracted the energy spectrum of the electron and the wave functions. PACS numbers: 03.65. Ca-Formalism, 03.65. Db-Functional analytical methods, 03.65. Pm-Relativistic wave equations.     

Conditional distributions of record values and characterizations of distributions

We consider some regression relations for record values X(n), n > 0, generated by a sequence of independent random variables X₁, X₂, X₃,... with a common continuous cumulative distribution function F(x). New characterizations of distributions based on regression properties of record values are obtained. Bibliography: 7 titles. __________ Translated from Zapiski Nauchnykh Seminarov POMI, Vol. 339, 2006, pp. 5–14.     

The solution existence of general variational inclusion problems

We propose general variational inclusion problems which are slightly different from corresponding problems considered in several recent papers in the literature and show that they are advantageous. Sufficient conditions for the solution existence are established. As applications we derive consequences for several special cases of variational inclusion problems, quasioptimization problems, equilibrium problems and implicit variational inequalities and show that they improve the results of some recent existing papers.     

On the properties of solutions to the Goursat-Darboux problem with boundary and distributed controls

We consider a control system described by the Goursat-Darboux equation. The system is controlled by distributed and boundary controls. The controls are subject to the constraints given as multivalued mappings with closed, possibly nonconvex, values depending on the phase variable. Alongside the initial constraints, we consider the convexified constraints and the constraints whose values are the extreme points of the convexified constraints. We study the questions of existence of solutions and establish connections between the solutions under various constraints.     

On a certain nonlocal problem for a hyperbolic equation

The author proves the existence and uniqueness of a generalized solution of a nonlocal problem with an integral condition for a hyperbolic equation with n spatial variables. This work is a continuation of the studies started in [3–5], where the solvability problem of nonlocal problems with an integral condition was studied for hyperbolic equations on the plane. __________ Translated from Sovremennaya Matematika i Ee Prilozheniya (Contemporary Mathematics and Its Applications), Vol. 33, Suzdal Conference-2004, Part 1, 2005.