二维INADEQUATE谱在δ—维生素E上的应用

二维INADEQUATE谱在NMR研究中具有重要价值,本文以二维INADEQUATE谱为主,结合DEPT,同核及异核位移相关谱,指认了δ-维生素E的碳谱谱峰,并由碳氢相关谱给出了各氢的化学位移,本文对δ-维生素E碳谱某些峰和二维INADEQUATE谱做了讨论,并对文献数据做了讨论,并对文献数据做了修正.     

熊果酸的Raman光谱和红外光谱结构特征比较

本文采用HRD2型双光栅单色仪测定了熊果酸的Raman光谱，得到熊果酸的特征Raman光谱结构，采用Philips 100型双光栅单色仪测定了熊果酸的IR光谱，得到熊果酸的特征IR光谱结构；解析了熊果酸的Raman光谱和IR光谱与其结构特征的关系，确定了熊果酸的Raman光谱的结构特征和官能团的归属，给出了熊果酸的两个基本骨架特征区域（A区：1386，1370，1363cm^-1，B区：1304，1269，1237cm^-1）；对熊甲酸的Raman光谱和IR光谱作了比较研究，指出Raman光谱具有比IR光谱更为丰富的结构信息的特征，并且，IR光谱的主要特征峰在Raman光谱中均有对应的谱峰；Raman光谱的谱峰形态清晰可变，使熊果酸的主要结构和官能团得到准确的分析和指认，与IR光谱一样，Raman光谱是天然药物解析的有效手段之一。     

由半导体激光器端面输出谱确定自发辐射谱

利用射线法和平均载流子分布近似，从理论上预言了用阈值以下半导体激光器的端面输出谱来确定自发辐射谱的可能性。在此基础上，通过实验测得的阈值以下半导体激光器的端面输出谱确定了自发辐射谱，并且对自发辐射谱和增益谱进行了比较和分析。     

谱导数法在光谱研究GaInAs/InP和GaInP/AlGaInP多量子阱中的应用

在简要讨论谱导数法物理机理的基础上, 给出了其在光吸收谱和光反射谱方法研究张应变GaInAs/InP和GaInP/AlGaInP多量子阱中的成功应用实例. 比较了不同阶谱导数对测定激子跃 迁能量的影响，论及了其与双调制谱方法、曲线拟合方法的区别. 指出了谱导数法在光谱研 究GaInAs/InP和GaInP/AlGaInP多量子阱中的重要性和易行性. 关键词： 谱导数法 吸收谱 反射谱 多量子阱 激子     

拉曼除谱原位测量水溶液中蛋白质的酰胺A谱带

蛋白质的酰胺A谱带对蛋白质的酰胺氢键结构很敏感. 然而由于该谱带和水的OH伸缩振动谱带严重重叠,导致在蛋白质水溶液中原位测量酰胺A谱带依旧很困难. 我们提出了一种新的分析方法用于原位测量水溶液中的酰胺A谱带. 这个方法称为拉曼除谱法. 将蛋白质水溶液光谱除以纯水光谱即可获得拉曼除谱. 利用数值模拟从数学上肯定了使用拉曼除谱可以直接获得酰胺A谱带. 我们还通过测量溶菌酶和α-糜蛋白酶的固体和水溶液的拉曼光谱,这些光谱也证实了可以通过拉曼除谱法直接获取酰胺A谱带. 利用拉曼除谱还分析了溶菌酶的热变性过程. 这些研究表明拉曼除谱可以原位地表征水溶液中的蛋白质酰胺A谱带.     

高保偏光纤前方受激拉曼散射光谱特性的研究

系统的研究了石英系高保偏双折射光纤的受激拉曼光谱的特性,给出了七级斯托克斯谱和一级反斯托克斯谱.测试了各级拉曼谱的阈值、谱宽和拉曼增益，分析了形成各级拉曼谱的能量转移机理.     

乳腺组织形态基元共焦显微拉曼光谱的研究

利用共焦显微拉曼方法,测定了乳腺组织切片的Mapping拉曼谱,光谱采样体积达到μm尺度.通过对这些共焦拉曼谱与商业提纯肌动蛋白、胶原等生化物质做出的谱的分析比较,分离出了来自细胞质、细胞间质、脂肪以及乳腺沉积物这些组织形态基元的拉曼谱;用K阶簇分析方法,还获得了细胞核基元谱;基元谱与提纯化学物质谱的相关分析印证了组织形态基元谱的来源.还分析总结了这些组织形态基元谱的特征.这些工作为深入理解组织形态与其拉曼谱的关系以及乳腺组织形态拉曼模型的建立奠定了基础.     

一种可能的简并谱NNS分布

利用随机矩阵理论,通过对一特殊情形的简并谱展开研究,得到了简并谱一种可能的最小相邻间距NNS分布函数．研究表明,由于简并的存在,简并谱不仅可分解成随机谱和规则谱两个子谱,同时还影响其规则谱,使规则谱的能级斥力减少．     

宽谱光源光谱相干度的仿真研究

以傅里叶变换为基础 ,研究了具有任意谱形的宽谱光源的相干函数并实现了通用的宽谱光源相干特性仿真算法。计算了应用于干涉式光纤陀螺的各种宽谱光源的相干特性 ,分析了不同谱形以及光谱平滑度对光谱时间相干性的影响。对于宽谱光源 ,此法可以全面准确地仿真其相干特性。     

差频时间压缩相关器的谱分析研究

本文从实时相关扫描和谱分析的等价性出发,讨论了输出谱的分析和多普勒滤波器组的设计。主要结果如下:1.对于决定性信号,乘法器的输出谱是带宽调制的谱带列。对于拟随机信号,输出谱是幅度调制的谱带列。输出噪声谱是梳状的,谱区与信号的重叠。2.由此,导出了多谱勒滤波器组的最佳或次最佳设计。     

Integral equation methods for elliptic problems with boundary conditions of mixed type

Laplace’s equation with mixed boundary conditions, that is, Dirichlet conditions on parts of the boundary and Neumann conditions on the remaining contiguous parts, is solved on an interior planar domain using an integral equation method. Rapid execution and high accuracy is obtained by combining equations which are of Fredholm’s second kind with compact operators on almost the entire boundary with a recursive compressed inverse preconditioning technique. Then an elastic problem with mixed boundary conditions is formulated and solved in an analogous manner and with similar results. This opens up for the rapid and accurate solution of several elliptic problems of mixed type.     

Effects of vacancy and deformation on an Al atom adsorbed on graphene

First-principles calculations based on density functional theory are carried out to study the adsorption energy of monovacancy and deformation on an Al atom adsorbed on graphene. The bond length and Mulliken charge of an Al atom adsorbed on intrinsic and defected graphene systems are also analyzed. We find that an Al atom, sitting above the H site of intrinsic graphene, is in the most stable location. And the adsorption energy increases with increasing graphene coverage. In 1/32 Al/VC-gra and 1/8 Al/VC-gra Al—C covalent bonds are formed, and the Al—C ionic bonds are enhanced by the vacancy. For our calculations, vacancy and deformation both enhance the adsorption energy of an Al atom adsorbed on a graphene system, but vacancy is more effective. In a tensile system, a geometric distortion is induced in the adsorption structure when the tensile deformation is greater than 15%; in a compression system, the adsorption structure begins to distort from 5%. When the tensile and compressive deformations are greater than 10%, the compressive deformation is more effective than the tension deformation on an Al atom adsorbed on the graphene system. Especially, when the deformation is relatively small, a vacancy has a greater effect on the adsorption energy of an Al atom adsorbed on graphene.     

Discrete dislocation simulation of nanoindentation: the influence of obstacles and a limited number of dislocation sources

Nanoindentation is simulated on the computer by means of a 2D discrete dislocation model under the conditions of a constrained geometry. First, an indentation test near a grain boundary is investigated by the arrangement of only one boundary and second, an indentation test into the center of the surface of a small grain (lamella) is mimicked by the arrangement of two boundaries. The effect of a limited number of dislocation sources is studied by the simulations of an indentation test in a plastically deformable film on an ideal elastic substrate and by such tests on an ideal elastic film on a plastically deformable substrate. The discrete nature of plasticity is shown to have a significant influence on the mechanical material behavior in all our investigations.     

Employment of the scattering amplitude in solving the diffraction problems for waves in a halfspace

The problem on the diffraction of an acoustic wave by a finite-size scatterer (inclusion) located in a halfspace is considered. The method of solving this problem is based on the use of the scattering amplitude of the inclusion. A formula analogous to the Green formula is presented. It allows one to determine the scattering amplitude of the inclusion for an arbitrary incident wave (determined by the directional pattern of the source of primary waves) from the scattering amplitude corresponding to plane incident waves. The algorithm is presented for solving the problem on the operation of an acoustically opaque radiator in a halfspace whose boundary is characterized by an arbitrary reflection coefficient. As an example, the problem is solved on the generation of low-frequency oscillations by a sphere with an acoustically soft boundary near an acoustically hard or soft boundary of the halfspace.     

Augmented coupling interface method for solving eigenvalue problems with sign-changed coefficients

In this paper, we propose an augmented coupling interface method on a Cartesian grid for solving eigenvalue problems with sign-changed coefficients. The underlying idea of the method is the correct local construction near the interface which incorporates the jump conditions. The method, which is very easy to implement, is based on finite difference discretization. The main ingredients of the proposed method comprise (i) an adaptive-order strategy of using interpolating polynomials of different orders on different sides of interfaces, which avoids the singularity of the local linear system and enables us to handle complex interfaces; (ii) when the interface condition involves the eigenvalue, the original problem is reduced to a quadratic eigenvalue problem by introducing an auxiliary variable and an interfacial operator on the interface; (iii) the auxiliary variable is discretized uniformly on the interface, the rest of variables are discretized on an underlying rectangular grid, and a proper interpolation between these two grids are designed to reduce the number of stencil points. Several examples are tested to show the robustness and accuracy of the schemes.     

Effect of Comatic Aberration on the Propagation Characteristics of Laguerre--Gaussian Beams

Seidel comatic aberration is an important cause of deformation for a Laguerre--Gaussian (LG) beam. In addition, mono-axial comatic aberration, whose phase modulation depends only on one transverse coordinate, is also an important cause of beam deformation. Deformation of an LG beam by such aberrations is analyzed through numerical simulation based on the angular spectrum method. It is also shown that for holographically generated LG beams quadratic spatial variation of grating pitch can produce seidel and mono-axial comatic aberrations. An example of an experimentally generated LG beam with mono-axial comatic aberration is reported.     

Reflection of fluxons on a Josephson line cavity

A single fluxon on a semi-infinite Josephson line is reflected at a passive or an active termination. By numerical computation we find a single reflected fluxon, an antifluxon, absorption of the incident fluxon, or fission into an arbitrary number of fluxons depending on the boundary condition. For the passive termination an analytical approximation based on energy analysis is developed.     

Influence of temperature change on column buckling of multiwalled carbon nanotubes

Based on theory of thermal elasticity mechanics, an elastic multiple column model is developed for column buckling of MWNTs with large aspect ratios under axial compression coupling with temperature change. In this model, each of the nested concentric tubes is regarded as an individual column and the deflection of all the columns is coupled together through the van der Waals interactions between adjacent tubes. The thermal effect is incorporated in the formulation. Following this model, an explicit expression is derived for the critical buckling strain for a double-walled carbon nanotube. The influence of temperature change on the buckling strain is investigated. It is concluded that the effect of temperature change on the buckling strain is dependent on the temperature changes, the aspect ratios, and the buckling modes of carbon nanotubes.     

A method for measuring the thickness of transparent oil film on water surface using laser trigonometry

We present a method for measurement of thickness of transparent oil film on water surface based on laser trigonometry. With an oblique incident mode of single-point laser triangulation ranging system, laser light is incident on the upper and lower surfaces of the oil film being measured and an ellipse light spot is formed on the upper and lower surfaces of the oil film. The two light spots are imaged on an image plane CCD by an imaging lens and the image spot is formed and stored in a computer. The thickness of oil film being measured can be obtained by displacement of the image spot and the configuration parameter of the imaging system. The experiment is conducted using edible peanut oil and diesel oil. The research results show that the method presented in this paper is feasible and applicable to dynamic on-line measurement of oil film thickness of oil spill on sea surface.     

非常偏振光在单轴晶体表面的反射-透射研究

为分析非常偏振光在晶体表面的能量损耗,给出一种求解反射率和透射率的方法,即根据电磁场的边值关系以及晶体的双折射和双反射现象,求解晶体光轴在入射面内时,非常偏振光从各向同性介质入射到晶体和从晶体出射到各向同性介质两种情况的反射率和透射率的方法,并给出反射率和透射率的解析解,同时得到对于晶体光轴在入射面内的情况,光轴的取向对非常偏振光反射率的大小几乎没有影响,但对产生全反射的临界角θc影响较大的结论。实验上用LiNbO3晶体验证了非常偏振光从各向同性介质入射到晶体时的反射率公式。求解方法简单实用,所给的表达式具有一般性,可以直接使用。