Jahn-Teller distortion motions as separatrices in PES

The topology of the pattern of intrinsic reaction coordinates and separatrices is investigated for 6-electron sigmatropic pericyclic rearrangements.It is demonstrated that the trajectories of nuclear motion involving HOMO-LUMO crossing are the separatrices of the basins of the chemical species involved. The special case of the Diels-Alder cycloaddition is analyzed.     

驱动等离子体电极电光开关脉冲发生器研究

主要介绍用电缆脉冲成形、场畸变开关控制脉冲输出的等离子体电极电光开关驱动脉冲发生器的实验．着重阐述了场畸变开关工作参数对输出脉冲的影响．以及输出脉冲破形的改善．最后给出了实验结果．     

磁质谱分析系统的研究

磁质谱分析是利用不同质荷比的离子在磁场中作不同的偏转来分析物质的,它是现代科学中用于分离或提纯物质的重要手段。文从质谱仪的基本方程出发,分析了影响质量分辨率的因素和两种主要像差产生的原因,及其校正措施,从而提高了质谱仪的测量精度。     

一种新的图象展开算法

本文提出了一种对被压缩并产生几何畸变的图象进行展开的算法,它不仅可使图象的几何畸变获得了很好的矫正,而且使图象的灰度分布得到了恢复,图象边缘细节更清晰,实践已证明了该算法的高效性能.     

钙钛矿（GaTiO3）高压相变及等温压缩

 高温高压条件下对钙钛矿（Perovstsite）多晶进行了研究，在金刚石压砧设备上压力条件最高达38 GPa，YAG莱塞加热温度近1 000 ℃以上，用红宝石荧光校压系统进行压力标定。实验结果表明静水压条件X射线就位测量，GaTiO₃(Ⅰ)由斜方晶系在10 GPa时直接向六方GaTiO₃(Ⅱ)结构相变，体积变化为1.6％；1 000 ℃加热及其非静水压条件下GaTiO₃(Ⅰ)由斜方晶系首先转变为四方晶系GaTiO₃(Ⅲ)转变压力为8.5 GPa，体积变化为0％，继续增加压力导15 GPa，GaTiO₃(Ⅲ)向GaTiO₃(Ⅱ')转化成六方晶系，体积变化亦为1.6％。三种高压相，在压力降到一个大气压时都会消失，所以是逆转化的非淬火相。等温压缩在标准静水压条件下进行，压力应小于10.4 GPa，K₀'=5.6时，K₀=(210±7)GPa，此数据是根据Birch-Murnaghan状态方程求得的体模量。     

正交表L_8的几个性质

张建方．正交表Ｌ８的几个性质．本文介绍了正交表Ｌ８的几个性质。在二位级正交表当中,这些性质很基本,内容比较丰富,对于应用和了解其它正交表有一定帮助     

金融要素扭曲、地方政府行为与创新效率缺失

基于熵值法和随机前沿模型对中国省际金融要素扭曲程度和创新效率进行测度,构建面板Tobit模型实证考察金融要素扭曲对区域创新效率的影响.研究发现:整体而言,金融要素扭曲具有创新故率抑制效应,但金融危机冲击会弱化其负向影响致果;分区域而言,金融要素担曲在中部地区的抑制效应最大,西部次之,东部最小;机制检验结果发现,企业R&D投入挤占故应与寻租激励故应是金融要素扭曲抑制区域创新故率的重要渠道;此外,引入地方政府行为变量的门槛检验发现,金融要素扭曲对区域创新故率的影响存在结构性变化,政府干预程度与政府R&D资助力度的加大,能够强化金融要素扭曲的创新效率抑制故应.因此,全面推进金融市场化改革、健全财政分权体制和政府行为内外部监管机制是降低金融要素担曲程度、优化创新环境,进而提升区域创新效率的重要路径.     

基于侧向PN结和交趾型PN结的硅基Mach-Zehnder调制器的二阶谐波失真特性

高线性度的电光调制器是构建微波光子链路的核心器件。硅光子调制器利用PN结的载流子色散效应实现微波信号对光波的调制,基于不同结构PN结的调制器有不同的非线性特性。本文采用二阶无杂散动态范围表征二阶谐波失真度,实验研究了采用侧向PN结和交趾型PN结所构成的Mach-Zehnder(MZ)调制器的二阶谐波失真特性。基于侧向PN结和交趾型PN结的MZ调制器的二阶无杂散动态范围为分别为85.11dB·Hz~(1/2)、78.44 dB·Hz~(1/2),表明基于侧向PN结的MZ调制器具有更好的线性度。     

Performance of density functional theory on the anisotropic halogen···halogen interactions and potential energy surface: Problems and possible solutions

The noncovalent halogen···halogen (X···X) interaction, which shows significant anisotropic feature, is extensively used in rationally designing supramolecular assemblies. Here, beyond the binding energy of stable geometries, the anisotropic topology of the potential energy surface (PES) is explored. We show that most functionals of DFT give remarkably unphysical angular distortion of the PES. This is unlikely to be solved unless the components that ensure correct angular dependent behavior in the halogen bonding region are contained in the functionals. We also prove that simple empirical corrections may substantially quantify this unphysical angular distortion, and further investigation is recommended. These findings constitute a step forward toward the understanding of the nature of X···X bonds, and provide some insights for the future designing of the state‐of‐art theoretical methods. © 2016 Wiley Periodicals, Inc.     

Growth Theorem and Distortion Theorem for a Sub class of Parab olic Starlike Mappings

In this article, we firstly introduce a subclass of parabolic starlike mappings writen as P S (β;ρ). Secondly, the growth theorem for P S (β;ρ) on the unit ball in complex Banach space is obtained. Finaly, as the application of the growth theorem of P S (β;ρ), the distortion theorem along a unit direction is also established.