Extremum of second-order directional derivatives

In this paper, the extremum of second-order directional derivatives, i.e. the gradient of first-order derivatives is discussed. Given second-order directional derivatives in three nonparallel directions, or given second-order directional derivatives and mixed directional derivatives in two nonparallel directions, the formulae for the extremum of second-order directional derivatives are derived, and the directions corresponding to maximum and minimum are perpendicular to each other.

Synthesis of Imidazole Derivatives for Their Second-order Nonlinear Optics

The design and the synthesis of two conjugated donor acceptor imidazole derivatives(1, 2) were carried out for second order nonlinear optics. The thermal properties, the transparency and second order nonlinear optical properties of the molecules were investigated. The experimental results indicate that a good nonlinearity transparency thermal stability trade off is achieved for them.

Importance Analysis of a Multi-state System Based on Direct Partial Logic Derivatives and Multi-valued Decision Diagrams

Importance analysis quantifies the critical degree of individual component. Compared with the traditional binary state system,importance analysis of the multi-state system is more aligned with the practice. Because the multi-valued decision diagram( MDD) can reflect the relationship between the components and the system state bilaterally, it was introduced into the reliability calculation of the multi-state system( MSS). The building method,simplified criteria,and path search and probability algorithm of MSS structure function MDD were given,and the reliability of the system was calculated. The computing methods of importance based on MDD and direct partial logic derivatives( DPLD) were presented. The diesel engine fuel supply system was taken as an example to illustrate the proposed method. The results show that not only the probability of the system in each state can be easily obtained,but also the influence degree of each component and its state on the system reliability can be obtained,which is conducive to the condition monitoring and structure optimization of the system.

Robust Control System Design Using Proportional Plus Partial Derivative State Feedback

经由为矩阵对的概括特征值敏感问题的比例的正部分衍生物状态反馈和结果把线性系统基于为描述符建议的一般参量的 eigenstructure 赋值结果，到在开环的系统矩阵的使不安的元素的靠近环的特征值敏感的参量的表示被获得。为有在经由反馈当时是的比例的正部分衍生物状态的线性系统建议了的描述符的最小的敏感的特征值赋值的一个有效算法。算法不包含回到过程，并且允许靠近环的特征值方便地在需要的区域以内被优化。一个例子表明它的有效性和简洁。

SINE TRANSFORM PRECONDITIONERS FOR SECOND-ORDER PARTIAL DIFFERENTIAL EQUATIONS

In this paper, we are concerned with the numerical solution of second-order partial differential equations. We analyse the use of the Sine Transform precondilioners for the solution of linear systems arising from the discretization of p.d.e. via the preconditioned conjugate gradient method. For the second-order partial differential equations with Dirichlel boundary conditions, we prove that the condition number of the preconditioned system is O(1) while the condition number of the original system is O(m 2) Here m is the number of interior gridpoints in each direction. Such condition number produces a linear convergence rale.

Solution of Partial Derivative Equations of Poisson and Klein-Gordon with Neumann Conditions as a Generalized Problem of Two-Dimensional Moments

It will be shown that finding solutions from the Poisson and Klein-Gordon equations under Neumann conditions are equivalent to solving an integral equation, which can be treated as a generalized two-dimensional moment problem over a domain that is considered rectangular. The method consists to solve the integral equation numerically using the two-dimensional inverse moments problem techniques. We illustrate the different cases with examples.

<i>L</i>-Stable Block Hybrid Second Derivative Algorithm for Parabolic Partial Differential Equations

An L-stable block method based on hybrid second derivative algorithm (BHSDA) is provided by a continuous second derivative method that is defined for all values of the independent variable and applied to parabolic partial differential equations (PDEs). The use of the BHSDA to solve PDEs is facilitated by the method of lines which involves making an approximation to the space derivatives, and hence reducing the problem to that of solving a time-dependent system of first order initial value ordinary differential equations. The stability properties of the method is examined and some numerical results presented.

Two parametric approaches for eigenstructure assignment in second-order linear systems

This paper considers eigenstructure assignment in second-order linear systems via proportional plus derivative feedback. It is shown that the problem is closely related to a type of so-called second-order Sylvester matrix equations. Through establishing two general parametric solutions to this type of matrix equations, two complete parametric methods for the proposed eigenstructure assignment problem are presented. Both methods give simple complete parametric expressions for the feedback gains and the closed-loop eigenvector matrices. The first one mainly depends on a series of singular value decompositions, and is thus numerically simple and reliable; the second one utilizes the right factorization of the system, and allows the closed-loop eigenvalues to be set undetermined and sought via certain optimization procedures. An example shows the effectiveness of the proposed approaches. Keywords Second-order linear systems - Eigenstructure assignment - Proportional plus derivative feedback - Parametric solution - Singular value decompoition - Right factorization This work was supported in part by the Chinese Outstanding Youth Foundation (No.69504002).

Reconstruct the Heat Conduction Model with Memory Dependent Derivative

The classical heat conduction equation is derived from the assumption that the temperature increases immediately after heat transfer, but the increase of temperature is a slow process, so the memory-dependent heat conduction model has been reconstructed. Numerical results show that the solution of the initial boundary value problem of the new model is similar to that of the classical heat conduction equation, but its propagation speed is slower than that of the latter. In addition, the propagation speed of the former is also affected by time delay and kernel function.

A Computational Evaluation of Bond Order and Charge Distributions in Isomeric Aminotroponiminiums and Their Benzo-Fused Derivatives

This paper reports the results on the nature of bond-order and net charge distributions predicted by Ab initio Hartree- Fock procedures for 1-amino-2-iminio-, 1-amino-3-iminio- and 1-amino-4-iminiotropylium cations that incorporate, in order, the 1,7-, 1,3- and 1,5-diazapentadienium (vinamidinium) elements. There appears to be very little contribution from tropylium-type charge distribution, the positive charges residing largely in the nitrogen atoms. The partial bond fixations and charge distributions show interesting variation in the three isomers. The 1,3-isomer in which the 1,3-diazapentadienium element is preserved in the favoured zigzag conformation appears to be relatively the best stabilized. The six isomeric benzo-fused derivatives arising from the three amino-iminiotropylium cations show similar differences in patterns of behaviour. Interestingly, the isomer in which a zigzag 1,3-diazapentadienium element is conjugated with a styrene moiety receives the deepest stabilization. While showing that the element largely contributes to the relative stabilization among the systems studied, contribution from certain stereochemical destabilizing factors may not be insignificant.

A High Order Formula to Approximate the Caputo Fractional Derivative

We present here a high-order numerical formula for approximating the Caputo fractional derivative of order𝛼for 0<α<1.This new formula is on the basis of the third degree Lagrange interpolating polynomial and may be used as a powerful tool in solving some kinds of fractional ordinary/partial diff erential equations.In comparison with the previous formulae,the main superiority of the new formula is its order of accuracy which is 4−α,while the order of accuracy of the previous ones is less than 3.It must be pointed out that the proposed formula and other existing formulae have almost the same computational cost.The eff ectiveness and the applicability of the proposed formula are investigated by testing three distinct numerical examples.Moreover,an application of the new formula in solving some fractional partial diff erential equations is presented by constructing a fi nite diff erence scheme.A PDE-based image denoising approach is proposed to demonstrate the performance of the proposed scheme.

Preparation and ^（183）W NMR Investigation of Iridium－containing Dawson Derivative

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Global Optimization of Norris Derivative Filtering with Application for Near-Infrared Analysis of Serum Urea Nitrogen

Near-infrared (NIR) spectroscopy combined with chemometrics methods was applied to the rapid and reagent-free analysis of serum urea nitrogen (SUN). The mul-partitions modeling was performed to achieve parameter stability. A large-scale parameter cyclic and global optimization platform for Norris derivative filter (NDF) of three parameters (the derivative order: d, the number of smoothing points: s and the number of differential gaps: g) was developed with PLS regression. Meantime, the parameters’ adaptive analysis of NDF algorithm was also given, and achieved a significantly better modeling effect than one without spectral pre-processing. After eliminating the interference wavebands of saturated absorption, the modeling performance was further improved. In validation, the root mean square error (SEP), correlation coefficient (RP) for prediction and the ratio of performance to deviation (RPD) were 1.66 mmol?L-1, 0.966 and 4.7, respectively. The results showed that the high-precision analysis of SUN was feasibility based on NIR spectroscopy and Norris-PLS. The global optimization method of NDF is also expected to be applied to other analysis objects.

ZINDO-SOS Studies on Second-order Nonlinear Optical Properties of Thiophene S,S-Dioxide Chromophores

The second-order nonlinear optical properties of thiophene S,S -dioxides derivatives were studied by using the ZINDO-SOS method. The computed results show that the thiophene S,S -dioxide derivatives exhibit larger second-order polarizabilities than their thiophene precursors. In order to clarify the origin of the different NLO responses among these chromophores, their electron properties and frontier orbital properties were investigated as well. These thiophene S,S -dioxides derivatives are good candidates for their application in electro-optical device due to their high nonlinearities, good thermal and photo stabilities.

On Second-order Sufficient Conditions in Constrained Nonsmooth Optimization

In this paper, we establish a second-order sufficient condition for constrained optimization problems of a class of so called t-stable functions in terms of the first-order and the second-order Dini type directional derivatives. The result extends the corresponding result of [D. Bednarik and K. Pastor, Math. Program. Ser. A, 113（2008）, 283-298] to constrained optimization problems.

Effect of Substituting Group on the Calculated Nonlinear Second－Order Optical Susceptibilities of Substituted Thiophene Derivatives with Quinoidlike Conformation

alculations of the nonlinear second-order optical susceptlbilities(β_(ijk))for sub- stituted tl1iophene derivative;with quinoidlike conformation are reported.These systetems possess small dipole moment;and large differences between dipole mo- ments of ground and first-excited states.Geometry optimizations of the molecules investigated were carried out using AM 1 method.The calculations were performed using INDO/CI method comboned with a sum-over-states expression for β_(jik). The calculated results sbw that the second-order susceptibility is a function of the na- ture and location of substituents and is larger for disubstituted molecules than monosubstituted molecules. Bipolymeric thiophenemetmne with NH_2/NO_2 groups was calctilated to have a β_μof 79. 920 × 10￣(-30) esu. It was found that the NH_2 and NO_2 groups in above disubstituted molecules are pull-pull groups in ground states,but are usual push-pull groups in the first excited states.

Second-order Nonlinear Optical Properties of a Series of Benzothiazole Derivatives

The second-order nonlinear optical (NLO) properties of a series of benzothiazole derivatives were studied by use of the ZINDO-SOS method. These chromophores are formed by a donor-π-bridge-acceptor system, based on a nitro group connected with benzothiazole as the acceptor and a hydroxyl-functional amino group as the donor. For the purpose of comparison, we also designed molecules in which nitrobenzene is an acceptor. The calculation results indicate that benzothiazole derivatives exhibit larger second-order polarizabilities than nitrobenzene derivatives. In order to clarify the origin of the NLO response of these chromophores, their electron properties were investigated as well. The benzothiazole derivatives are good candidates for application in electro-optical device due to their high optical nonlinearities, good thermal and photonic stability.

Numerical Methods for Solving Space Fractional Partial Differential Equations Using Hadamard Finite-Part Integral Approach

We introduce a novel numerical method for solving two-sided space fractional partial differential equations in two-dimensional case.The approximation of the space fractional Riemann-Liouville derivative is based on the approximation of the Hadamard finite-part integral which has the convergence order O(h^3-a),where h is the space step size and α∈(1,2)is the order of Riemann-Liouville fractional derivative.Based on this scheme,we introduce a shifted finite difference method for solving space fractional partial differential equations.We obtained the error estimates with the convergence orders O(τ+h^3-a+h^β),where τ is the time step size and β>0 is a parameter which measures the smoothness of the fractional derivatives of the solution of the equation.Unlike the numerical methods for solving space fractional partial differential equations constructed using the standard shifted Griinwald-Letnikov formula or higher order Lubich's methods which require the solution of the equation to satisfy the homogeneous Dirichlet boundary condition to get the firstorder convergence,the numerical method for solving the space fractional partial differential equation constructed using the Hadamard finite-part integral approach does not require the solution of the equation to satisfy the Dirichlet homogeneous boundary condition.Numerical results show that the experimentally determined convergence order obtained using the Hadamard finite-part integral approach for solving the space fractional partial differential equation with non-homogeneous Dirichlet boundary conditions is indeed higher than the convergence order obtained using the numerical methods constructed with the standard shifted Griinwald-Letnikov formula or Lubich's higher order approximation schemes.

On the partial stability of nonlinear impulsive Caputo fractional systems

In this work,stability with respect to part of the variables of nonlinear impulsive Caputo fractional differential equations is investigated.Some effective sufficient conditions of stability,uniform stability,asymptotic uniform stability and Mittag Leffler stability.The approach presented is based on the specially introduced piecewise continuous Lyapunov functions.Furthermore,some numerical examples are given to show the effectiveness of our obtained theoretical results.

SOME RESULTS REGARDING PARTIAL DIFFERENTIAL POLYNOMIALS AND THE UNIQUENESS OF MEROMORPHIC FUNCTIONS IN SEVERAL VARIABLES

In this paper,we mainly investigate the value distribution of meromorphic functions in Cmwith its partial differential and uniqueness problem on meromorphic functions in Cmand with its k-th total derivative sharing small functions.As an application of the value distribution result,we study the defect relation of a nonconstant solution to the partial differential equation.In particular,we give a connection between the Picard type theorem of Milliox-Hayman and the characterization of entire solutions of a partial differential equation.