Fresnel diffraction of truncated Gaussian beam

We study the Fresnel diffraction of Gaussian beam truncated by one circular aperture, and give the general analytic expression of the Fresnel diffraction of truncated Gaussian beam denoted by Bessel functions. Then the characteristic of the axial diffraction fluctuation and the influence of the caliber of the circular aperture and the wave waist of Gaussian beam on the diffraction distributions are discussed, respectively. Through the numerical calculations, the characteristics of the transverse diffraction are presented and the relationship of the fluctuation of the transverse diffraction profile and the position of the axial point is shown. The physical origin of the fluctuation of Fresnel diffraction intensities of truncated Gaussian beam is expressed in terms of Fresnel half-zone theory. These phenomena and the conclusions are important for the measurement of the parameters of the beam and its applications.     

Influence of Bi underlayer on the magnetic properties of Fe<Subscript>x</Subscript>Pt<Subscript>100-x</Subscript> (<Emphasis Type="BoldItalic">x</Emphasis> =<Emphasis Type="Bold">40</Emphasis>∼<Emphasis Type="Bold">58</Emphasis>) films

We have studied the effect of a Bi underlayer on ordering and coercivity H_c of Fe_xPt_100-x thin films (atomic content of Fe x=40∼58). We found that the Bi underlayer enhances H_c remarkably. After annealing at 400 °C for 20 min, a Bi/Fe₄₉Pt₅₁ film can realize an H_c as high as 1.07×10³ kA/m and a ratio of the remnant M_r to the saturated magnetization M_s as high as 0.93. The ordering process of FePt film was promoted by the diffusion of Bi atoms. Moreover, the Bi underlayer broadens the range of x for high H_c from 49∼55 to 43∼55. Interestingly, with Bi underlayer, the high H_c is affected by x to a less extent. PACS 75.50.Ss; 75.50.Vv; 75.60.Ej     

Mass-analyzed Threshold Ionization Spectroscopy of Rotamers of p-ethoxyphenol Cations and Configuration Effect

利用双色双光子质量分辨的阈值电离光谱技术,研究了对位乙氧基苯酚顺式和反式两种构型的离子态振动特性. 测得顺式和反式精确的绝热电离势分别为61565±5和61670±5 cm^-1. 与对位甲氧基苯酚实验结果比较,顺式和反式的测得的绝热电离势分别降低了645和643 cm^-1. 从所得到的两种构型的高分辨离子态光谱中,可知顺式和反式不同构型对苯环平面的振动影响很小,而低频率的C-OC₂H₅弯曲振动在两种构型中都很活跃.     

氢在钯单晶表面的解离与在体相的扩散

氢分子在金属表面的解离吸附与氢原子在金属体相的扩散是个典型的表面过程.前者在甲烷化及合成氨等基础化工反应中起着关键作用;后者常常导致金属材料的脆化与断裂,但过渡金属及其合金是安全和优良的储氢材料.因此,研究氢分子在金属表面的解离吸附与氢原子在金属体相的扩散,是多相催化与金属物理广泛感兴趣的课题,具有重要的理论和应用价值.本文采用分子动力学方法初步探讨了二者之间的关联.分子催化动力学为从微观层次上研究上述课题提供了一种理论方法.本文采用经过我们改进的半经验LEPS方法,计算了氢分子在Pd(100)和(110)晶面的解离和氢原子在钯表面与体相扩散的相互作用位能面,并根据计算结果探讨了其微观机理.     

有机/无机复合结构光电导型器件的光激发机制

制备了PVK/ZnS有机无机复合的光电导型器件 ,器件结构分别为Glass/ITO/PVK/Al;Glass/ITO/ZnS/Al;Glass/ITO/ZnS/PVK/Al。通过研究此复合器件在外加电场作用下的稳态光电导激发谱 ,得到了基本光激发过程。把PVK/ZnS的吸收谱和器件的光电导谱进行比较 ,知道虽然两者的吸收对器件光电流都有贡献 ,但有效部分在PVK和ZnS的界面处。最大光电流对外加电场的依赖性与器件的暗电流和光电流谱为此提供了证据     

掺磷TiO_2优化TiO_2/MBA/Ag三明治结构的SERS性能

本文以磷酸为磷源,通过溶胶水热法制备磷掺杂TiO_2,利用Lee和Meisel的方法制备银溶胶,以4-巯基苯甲酸(MBA)为探针分子,通过构建TiO_2/MBA/Ag三明治结构,研究磷掺杂二氧化钛对该基底表面增强拉曼(SERS)性能的提升。通过TEM、XRD、XPS、DRS和拉曼光谱图表征二氧化钛的形貌结构、化学组成、光学和拉曼性能,结果表明,制备出的磷掺杂二氧化钛为锐钛矿型纳米颗粒,粒径范围6~12nm,XPS显示磷以P~(5+)替代了Ti~(4+),形成O-P-O键掺入TiO_2的晶格中,当磷的掺杂量在1.77%时,TiO_2/MBA/Ag三明治体系具有最佳的SERS信号,这是因为适量的磷掺杂降低了TiO_2的能带间隙,丰富TiO_2的表面态,这能促进TiO_2向MBA分子的电荷转移。     

First-Principles Study on the Electronic Structures for Y^3＋：PbWO4 Crystals

The possible defect models of Y^3＋：PbWO4 crystals are discussed by defect chemistry and the most possible substituting positions of the impurity Y^3＋ ions are studied by using the general utility lattice program （GULP）. The calculated results indicate that in the lightly doped Y^3＋ ：PWO crystal, the main compensating mechanism is [2Ypb^＋ ＋ VPb^2-], and in the heavily doped Y^3＋ ：PWO crystal, it will bring interstitial oxygen ions to compensate the positive electricity caused by YPb^＋, forming defect clusters of [2Ypb^＋ ＋Oi^2-] in the crystal. The electronic structures of Y3＋ ：PWO with different defect models are calculated using the DV-Xα method. It can be concluded from the electronic structures that, for lightly doped cases, the energy gap of the crystal would be broadened and the 420nm absorption band will be restricted; for heavily doped cases, because of the existence of interstitial oxygen ions, it can bring a new absorption band and reduce the radiation hardness of the crystal.     

Existence of nontrivial solutions for fractional Schrödinger equations with critical or supercritical growth

In this paper, we study the following fractional Schrödinger equation with critical or supercritical growth where 0 < s < 1, N > 2s, λ > 0, , , ( ? Δ)^s denotes the fractional Laplacian of order s and f is a continuous superlinear but subcritical function. Under some suitable conditions, we prove that the equation has a nontrivial solution for small λ > 0 by variational methods. Our main contribution is related to the fact that we are able to deal with the case .     

Extraction Separation of BSA in Aqueous Two-Phase Systems of Anionic and Cationic Surfactant Mixtures

Aqueous two-phase systems (ATPS) are formed in mixtures of sodium dodecylsulfate (SDS), cetyltrimethyl ammonium bromide (CTAB), and sodium bromide (NaBr). Two different kinds of ATPS appear when CTAB and SDS surfactants are in excess, respectively. Such ATPS may provide a new, useful partitioning system for separation of bovine serum albumin (BSA). The partitioning of BSA was studied in these systems. The results show that the partitioning is affected by the electrical property, the hydrophobicity and the structure of liquid crystal (LC), which exists in the top phase of the ATPS. BSA is extracted into the top phase with higher distribution coefficient when LC and BSA are oppositely charged. The hydrophobicity of LC, which can be improved by increasing the length of alkyl group, enhances the distribution coefficient. The hydrophobicity of lamellar LC and hexagonal LC is stronger than that of cubic LC, which causes extractive capability of the former is higher than the latter.     

Tunable Surface‐Enhanced Raman Scattering from High‐Density Gold Semishell Arrays with Controllable Dimensions

A convenient reproducible technique is reported for the fabrication of large‐area gold semishell arrays by mechanically pressing porous anodic alumina (PAA) stamps into gold/polymer bilayer structures that serve as robust and cost‐efficient surface‐enhanced Raman‐scattering (SERS) substrates. The surface structure can be tuned further to optimize the enhancement factor according to optional PAA fabrication parameters and imprinting pressures. Finite‐difference time‐domain calculations indicate that the structure may possess excellent SERS characteristics due to the high density and abundance of hot spots.