Contingent derivatives of set-valued maps and applications to vector optimization

In this paper we investigate contingent derivatives of set-valued maps and their lower and upper semidifferentiability properties. We provide also some calculus rules for these derivatives in infinite dimensional spaces. The concept of contingent derivatives is then applied to produce several necessary and sufficient conditions for vector optimization problems with set-valued objectives.This paper was written when the author was at the University of Erlangen-Nurnberg under a grant of the Alexander von Humboldt Foundation.On leave from the Institute of Mathematics, Hanoi, Vietnam.     

A model for crack formation during active solid pyrolysis of a char-forming solid: crack patterns; surface area generation; volatile mass efflux

A model is developed for the formation and propagation of cracks in a material sample that is heated at its top surface, pyrolyses, and then thermally degrades to form char. In this work the sample is heated uniformly over its entire top surface by a hypothetical flame (a heat source). The pyrolysis mechanism is described by a one-step overall reaction that is dependent nonlinearly on the temperature (Arrhenius form). Stresses develop in response to the thermal degradation of the material by means of a shrinkage strain caused by local mass loss during pyrolysis. When the principal stress exceeds a prescribed threshold value, the material forms a local crack. Cracks are found to generally originate at the surface in response to heating, but occasionally they form in the bulk, away from ever-changing material boundaries. The resulting cracks evolve and form patterns whose characteristics are described. Quantities examined in detail are: the crack spacing in the pyrolysis zone; the crack length evolution; the formation and nature of crack loops which are defined as individual cracks that have joined to form loops that are disconnected from the remaining material; the formation of enhanced pyrolysis area; and the impact of all of the former quantities on mass flux. It is determined that the mass flux from the sample can be greatly enhanced over its nominal (non-cracking) counterpart. The mass efflux profile qualitatively resembles those observed in Cone Calorimeter tests.     

Cohen–Macaulayness of monomial ideals and symbolic powers of Stanley–Reisner ideals

We present criteria for the Cohen–Macaulayness of a monomial ideal in terms of its primary decomposition. These criteria allow us to use tools of graph theory and of linear programming to study the Cohen–Macaulayness of monomial ideals which are intersections of prime ideal powers. We can characterize the Cohen–Macaulayness of the second symbolic power or of all symbolic powers of a Stanley–Reisner ideal in terms of the simplicial complex. These characterizations show that the simplicial complex must be very compact if some symbolic power is Cohen–Macaulay. In particular, all symbolic powers are Cohen–Macaulay if and only if the simplicial complex is a matroid complex. We also prove that the Cohen–Macaulayness can pass from a symbolic power to another symbolic powers in different ways.     

A modified integral equation method of the semilinear backward heat problem

The paper is concerned with the non-linear backward heat equation in the rectangle domain. The problem is severely ill-posed. We shall use a modified integral equation method to regularize the nonlinear problem. The error estimates of Hölder type of the regularized solutions are obtained. Numerical results are presented to illustrate the accuracy and efficiency of the method. This work is a generalization of many earlier papers, including the recent paper [D.D. Trong, N.H. Tuan, Regularization and error estimate for the nonlinear backward heat problem using a method of integral equation, Nonlinear Anal. 71 (9) (2009) 4167-4176].     

Optimality and duality in nonsmooth multiobjective fractional programming problem with constraints

In this paper, we establish some quotient calculus rules in terms of contingent derivatives for the two extended-real-valued functions defined on a Banach space and study a nonsmooth multiobjective fractional programming problem with set, generalized inequality and equality constraints. We define a new parametric problem associated with these problem and introduce some concepts for the (local) weak minimizers to such problems. Some primal and dual necessary optimality conditions in terms of contingent derivatives for the local weak minimizers are provided. Under suitable assumptions, sufficient optimality conditions for the local weak minimizers which are very close to necessary optimality conditions are obtained. An application of the result for establishing three parametric, Mond–Weir and Wolfe dual problems and several various duality theorems for the same is presented. Some examples are also given for our findings.

     

pH‐sensing nanostar probe using surface‐enhanced Raman scattering (SERS): theoretical and experimental studies

Local pH environment has been considered to be a potential biomarker for tumor diagnosis because solid tumors contain highly acidic environments. A pH‐sensing nanoprobe based on surface‐enhanced Raman scattering (SERS) using nanostars under near‐infrared excitation has been developed for potential biomedical applications. To theoretically investigate the effect of protonation state on SERS spectra of p‐mercaptobenzoic acid (pMBA), we used the density functional theory (DFT) with the B3LYP functional to calculate Raman vibrational spectra of pMBA‐Au/Ag complex in both protonated and deprotonated states. Vibrational spectral bands were assigned with DFT calculation and used to investigate SERS spectral changes observed from experiment when varying pH value between five and nine. The SERS peak position of pMBA at ~1580 cm⁻¹ was identified to be a novel pH‐sensing index, which has small but noticeable downshift with pH increase. This phenomenon is confirmed and well‐explained with theoretical simulation. The study demonstrates that SERS is a sensitive tool to monitor minor structural changes due to local pH environment, and DFT calculations can be used to investigate Raman spectra changes associated with minor differences in molecular structure. Copyright © 2013 John Wiley & Sons, Ltd.     

Conical Algorithm in Global Optimization for Optimizing over Efficient Sets

The problem of optimizing some contiuous function over the efficient set of a multiple objective programming problem can be formulated as a nonconvex global optimization problem with special structure. Based on the conical branch and bound algorithm in global optimization, we establish an algorithm for optimizing over efficient sets and discuss about the implementation of this algorithm for some interesting special cases including the case of biobjective programming problems.     

Morrey global bounds and quasilinear Riccati type equations below the natural exponent

We obtain global bounds in Lorentz–Morrey spaces for gradients of solutions to a class of quasilinear elliptic equations with low integrability data. The results are then applied to obtain sharp existence results in the framework of Morrey spaces for Riccati type equations with a gradient source term having growths below the natural exponent of the operator involved. A special feature of our results is that they hold under a very general assumption on the nonlinear structure, and under a mild natural restriction on the boundary of the ground domain.     

Interfacial structure and electrical properties of LaAlO3 gate dielectric films on Si by metalorganic chemical vapor deposition

LaAlO₃ (LAO) gate dielectric films were deposited on Si substrates by low-pressure metalorganic chemical vapor deposition. The interfacial structure and composition distribution were investigated by high-resolution transmission electron microscopy (HRTEM), X-ray photoelectron spectroscopy (XPS), secondary-ion mass spectroscopy (SIMS), and Auger-electron spectroscopy (AES). HRTEM confirms that there exists an interfacial layer between LAO and Si in most samples. AES, SIMS, and XPS analyses indicate that the interfacial layer is compositionally graded La–Al silicate and the Al element is severely deficient close to the Si surface. Electrical properties of LAO films were evaluated. No evident difference in electrical properties between samples with and without native SiO₂ layers was observed. The electrical properties are discussed in terms of LAO growth mechanisms, in relation to the interfacial structure. PACS 73.40.Qv; 81.15.Gh; 77.55.+f; 68.35.-p     

Locally most powerful rank tests for testing randomness and symmetry

Let X _i, 1 i N, be N independent random variables (i.r.v.) with distribution functions (d.f.) F _i(x,), 1 i N, respectively, where is a real parameter. Assume furthermore that F _i(·,0) = F(·) for 1 i N. Let R = (R ₁,R _N) and R ⁺,...,R _N ⁺ be the rank vectors of X = (X ₁,X _N) and |X|=(|X ₁|,...,|X _N|), respectively, and let V = (V ₁,V _N) be the sign vector of X. The locally most powerful rank tests (LMPRT) S = S(R) and the locally most powerful signed rank tests (LMPSRT) S = S(R ⁺, V) will be found for testing = 0 against > 0 or < 0 with F being arbitrary and with F symmetric, respectively.