矩阵方程AXB+CY D=E的三对角中心对称极小范数最小二乘解

本文研究了矩阵方程AXB+CY D=E的三对角中心对称极小范数最小二乘解问题.利用矩阵的Kronecker积和Moore-Penrose广义逆方法,得到了矩阵方程AXB+CY D=E的三对角中心对称极小范数最小二乘解的表达式.     

关于一类含有Dziok-Srivastava算子的多叶解析函数的包含关系和卷积性质

该文引进和研究了一类含有Dziok-Srivastava算子的新的多叶解析函数. 得到了这一函数类中的一些有趣的性质, 如包含关系, 卷积性质等. 这些结果改进和拓展了早期的一些工作. 同时也得到了其他一些新的结果.     

Normally-Ordered Time Evolution Operator for Mass-Varying Harmonic Oscillator and Wigner Function of Squeezed Number State

For investigating dynamic evolution of a mass-varying harmonic oscillator we constitute a ket-bra integration operator in coherent state representation and then perform this integral by virtue of the technique of integration within an ordered product of operators. The normally ordered time evolution operator is thus obtained. We then derive the Wigner function of u（t）｜n,〉, where ｜n〉 is a Fock state, which exhibits a generalized squeezing, the squeezing effect is related to the varying mass with time.     

Similarity Solutions for Generalized Variable Coefficients Zakharov-Kuznetsov Equation under Some Integrability Conditions

In this paper, the symmetry method has been carried over to the generalized variable coefficients Zakharov- Kuznetsov equation. The infinitesimal symmetries and the optimal system are deduced and from this optimal system seven basic fields are determined, and for every vector field in the optimal system the admissible forms of the coefficients are found and this also leads us to transform the given equation into partial differential equations in two variables. After using some referenced transformations the mentioned partial differential equations eventually reduce to ordinary differential equations. The search for solutions to those equations has yielded many exact solutions in most cases.     

Operator Formulas Involving Generalized Stirling Number Derived by Virtue of Normal Ordering of Vacuum Projector

By virtue of the normal ordering of vacuum projector we directly derive some new complicated operator identities, regarding to the generalized Stirling number.     

Spiking Behavior in Chua's Circuit

Chua ＇s circuit with a slow-fast effect is established under certain parameter conditions. The dynamics of this slow- fast system is investigated. A spiking phenomenon can be observed in the numerical simulation. By introducing slow-fast analysis and a generalized Jacobian matrix at the non-smooth boundaries, the bifurcation mechanism for the periodic spiking solution, different from the smooth case, is discussed.     

On the Generalized Continuity Equation

A generalized continuity equation extending the ordinary continuity equation is found using quanternions to show it is compatible with Dirac, Schrǒdinger, Klein-Gordon and diffusion equations. This generalized equation is Lorentz invariant. The transport properties of electrons are found to be governed by the Schr6dinger-like equation and not by the diffusion equation.     

Singular Wave Solutions of Two Integrable Generalized KdV Equations

We present some singular wave solutions such as multi-peaked periodic waves, multi-peaked kink waves, multi-peaked peakons as well as kink-compactons, associated with singular curves of generalized KdV equation and modified KdV equation. When a trajectory intersects with the singular curve, it may be divided into segments. Different combinations of these segments may lead to different singular wave solutions, while at the intersection points, peaks on the waves can be observed.     

First-Principles Study of Electronic and Optical Properties of Y1-xCaxTiO3 （x=0, 0.25, 0.5, 0.75）

The full potential linearized augmented plane wave （FP-LAPW） method with the generalized gradient approximation （GGA） is applied to study the electronic and optical properties of perovskite-type compounds Y1-xCaxTiO3. The lattice parameters, magnetic moment, band structure, density of states and optical conductivity are obtained. The results show that the Ca ion plays an important role in the electronic properties and optical responses. Moreover, the optical properties including the dielectric function, absorption spectrum, extinction coefficient, energy-loss spectrum and refractive index are also discussed.     

电子结构计算的数值方法与理论

第一原理电子结构计算已成为探索与研究物质机理、理解与预测材料性质的重要手段和工具.虽然第一原理电子结构计算取得了巨大的成功,但是如何利用高性能计算机又快又好地计算大规模体系,如何从数学角度理解电子结构模型的合理性与计算的可靠性和有效性,依然充满各种挑战.基于密度泛函理论的第一原理电子结构计算的核心数学模型为Kohn-Sham方程或相应的Kohn-Sham能量泛函极小问题.近年来,人们分别从非线性算子特征值问题的高效离散及Kohn-Sham能量泛函极小问题的最优化方法设计两个方面对电子结构计算的高效算法设计及分析展开了诸多研究.本文重点介绍我们小组在电子结构计算的方法与理论方面的一些进展,同时简单介绍该领域存在的困难与挑战.