Crystal-lattice coupling to the vortex-melting transition in YBa(2)Cu(3)O(7-delta)

Distinct discontinuities in the thermal expansion of the crystal lattice are observed at the melting transition of the vortex lattice in a naturally untwinned reversible YBa(2)Cu3O(7-delta) single crystal using high-resolution dilatometry. This coupling between the vortex transition and the crystal lattice demonstrates that the crystal lattice is more than a mere host for the vortices, and it is attributed to a strong pressure dependence of the superconducting transition temperature and thus to the condensation energy at the vortex-melting temperature.     

纳米晶体线的晶格动力学格林函数及晶格振动

通过求解差分方程,推导了纳米晶体线的晶格动力学格林函数,分析了其晶格振动,并推导了声子数表象中的原子位移及晶格振动哈密顿公式.研究结果表明,纳米晶体线的晶格振动能带分裂为一系列的子带,格波只能沿纳米晶体线的纵向传播,沿纳米晶体线的横截面只存在驻波.     

Molecular-dynamics calculation of the thermal conductivity coefficient of the germanium single crystal

The thermal conductivity coefficient of the germanium crystal lattice has been calculated by molecular dynamics simulation. Calculations have been performed for both the perfect crystal lattice and the crystal lattice with defects such as monovacancies. For the perfect germanium single crystal, the dependence of the thermal conductivity coefficient on the lattice temperature has been obtained in the temperature range of 150–1000 K. The thermal conductivity coefficient of the germanium lattice has been calculated as a function of the monovacancy concentration.     

Resonance switching in a large sonic crystal cavity

In this work we present an experimental realization of resonance switching inside a large, relative to the lattice constant, sonic crystal (SC) cavity. The resonances arise from a temporary trapping of the acoustical energy between two sonic crystal slabs when the frequency of the wave falls within a partial band-gap region (thus, the propagation inside the sonic crystal is inhibited for normal incidence and a total reflection occurs). We show that by modifying the geometry of the sonic crystal lattice, from square to centered rectangular, it is possible to switch some resonances on and off, for a certain frequency region corresponding to the second band-gap for normal incidence. We also study the generalization of this phenomenon for the same lattice and band-gap region, as a function of the length of the cavity and the filling fraction the lattice.     

The zero-point energy in the molecular hydrogen crystal

We propose a modified Einstein approximation to describe zero-point energy vibrations in a quantum crystal. Our aim was to develop a computationally cheap tool suitable for lattice structure optimisation. As in the classical Einstein model the representative atom vibrates in an effective potential due to the surrounding atoms of the crystal; the atoms however are not strictly placed at the positions corresponding to the crystal potential energy minima but their positions are described by the quantum mechanical density distributions. The effective potential computed that way is suitable for the application in solid para-hydrogen in contrast to the normal (unmodified) Einstein approximation. We compute the cohesive energy of the para-hydrogen crystal and perform lattice structure optimisation. The hexagonal closed packed is more stable than the fcc closed packed lattice and the lattice constants obtained are in very good agreement with the experimental values.     

二维单斜点阵光子晶体的第一布里渊区及带隙计算

二维单斜点阵光子晶体在光学聚焦器件及光子晶体波导中有重要的应用价值，详细讨论了二维单斜点阵光子晶体的第一布里渊区及带隙计算，并与常规方法计算得出的二维正三角形晶格光子晶体的带隙结构进行了比较.最后讨论了临界条件下二维单斜点阵光子晶体的带隙结构，证明了本方法的有效性.     

二维三角晶格光子晶体波导的出射光集束传播

为了解决光子晶体波导出射端光场控制, 同时解决二维三角晶格光子晶体波导出射光辐射困难的问题。利用二维三角晶格光子晶体设计了一种新型光子晶体波导出射口结构。在二维三角晶格光子晶体波导出射端引入两个微腔, 通过光波与微腔发生共振, 形成类似于三个点光源干涉的出射光, 同时进一步提出波导出射端喇叭口干涉出射光定向辐射的设计。通过这种微腔喇叭口设计, 利用时域有限差分法分析结果表明光波实现很好的定向辐射, 并且辐射距离显著提高。     

约化胞与电子衍射谱的标定

对应于14种布喇菲点阵有44种约化胞,不但约化矢的选法是唯一的,而且可以根据约化矢标量积矩阵(a·a b·b c·c b·c c·a a·b)的不同形式,确定布喇菲点阵类型。在晶体点阵已知的情况下,从点阵参数计算出倒易点阵中的平面约化胞,并与试验得到的电子衍射谱对比以标定衍射斑点的指数。在晶体点阵未知的情况下,从已知转角的两个电子衍射谱中选三个接近中心的衍射斑点,相当于三个低指数倒易矢量。由它们构成倒易点阵的一个初基胞,变换成正点阵的初基胞后,经过约化得出约化胞和相应的布喇菲单胞的类型和参数,同时标定衍射斑点的指数。这些标定计算已编成电子计算机程序,可以用来直接确定晶体点阵类型和进行物相分析。     

Correlation of temperature anomalies of the hyperfine field and thermal expansion of the crystal lattice

Consideration is given to the effect of thermal expansion of crystal lattice upon the partial contributions to the magnetic hyperfine field for non-magnetic atoms in metallic ferromagnets. The existence of correlation between the temperature anomalies of a hyperfine field and the thermal expansion of the crystal lattice is shown in a simple and illustrative way.     

Analysis of two-dimensional photonic band gap structure with a rhombus lattice

The relative band gap for a rhombus lattice photonic crystal is studied by plane wave expansion method and high frequency structure simulator (HFSS) simulation. General wave vectors in the first Briliouin zone are derived. The relative band gap as a function of air-filling factor and background material is investigated, respectively, and the nature of photonic band gap for different lattice angles is analyzed by the distribution of electric energy. These results would provide theoretical instruction for designing optical integrated devices using photonic crystal with a rhombus lattice.     

Some dynamical properties of a two-dimensional Wigner crystal

Results for the static part of the ground state energy of the square and hexagonal two-dimensional Wigner lattices are given. The hexagonal lattice has the lower energy. Phonon dispersion curves and the vibrational zeropoint energy are calculated for the hexagonal lattice. The dielectric susceptibility tensor of a two-dimensional Wigner crystal χ_αβ(q) has been determined in the long wavelength limit in the presence of a static magnetic field perpendicular to the crystal, and explicit expressions have been obtained for the hexagonal lattice. Applying the analysis developed by Chiu and Quinn, the results for the susceptibility have been used to obtain the dispersion relation for the plasma oscillations in the electron crystal on the assumption that the crystal is embedded in a dielectric medium. The dispersion curves have been calculated for differing magnitudes of the applied magnetic field.     

多孔硅层晶格畸变的X射线双晶衍射研究

利用X射线双晶衍射方法,对从同一Si(111)基片上切割的两块样品,在不同电解电流密度下,腐蚀形成的多孔硅层相对于基体硅的晶格畸变进行了分析。这两块样品晶格的畸变明显不同。其中电流密度较小的样品畸变较大,其多孔硅层对于基体硅在垂直和平行于晶体表面的方向上,晶格有不同程度的膨胀,搁置一段时间后,两者晶格渐渐匹配,但存在着弯曲。两者的(111)晶面取向亦有偏差。电流密度较大时多孔硅层较厚,其双晶反射强度很低,且弥散地迭加在基体硅反射峰上。     

Measure of the closeness of crystal lattices

A numerical measure of the difference between crystal lattices is determined. The fruitfulness of the definition is demonstrated for a specific example concerning the prominence of an orientational correspondence between the body-centered crystal lattice [bcc(bct)] of α-martensite and the face-centered crystal lattice (fcc) of γ-austenite in cases where the latter is perfect and where it differs from a perfect lattice near a screw dislocation. Zh. Tekh. Fiz. 69, 60–64 (May 1999)     

蜂巢晶格光子晶体能带特性的研究

运用时域有限差分法数值模拟了蜂巢晶格光子晶体能带特性,得到了蜂巢晶格光子晶体的最大横电(TE)模、横磁(TM)模和完全带隙,研究结果为光子晶体器件的开发提供了理论依据.     

在高频区存在巨带隙的长方晶格二维光子晶体

本文利用降低光子晶体的对称性来提高绝对禁带宽度, 提出两种长方结构长方介质柱二维光子晶体, 用快速平面波展开法研究其高频区的带结构.经参数优化发现, 长方晶格包含一套介质柱时, 最大绝对禁带宽度Δω为0.1265ωe（ωe=2πc/a, a为晶格常数, c为光速）, 绝对禁带中心频率ωmid为1.9256ωe, Δω/ωmid=6.6%; 当长方晶格包含两套介质柱时, 最大绝对禁带宽度为0.203ωe, 绝对禁带中心频率为1.8597ωe, Δω/ωmid=10.9%.     

三角晶格二维光子晶体的横磁模特性

基于平面波展开法,以介电常数分别为1F/m和12F/m的物质构成三角晶格二维光子晶体,改变空气孔半径r与晶格常数a之间的大小,数值模拟得到了三角晶格二维光子晶体横磁模带隙,当r=.4α时形成三处三角晶格二维光子晶体横磁模的带隙,其中最大三角晶格二维光子晶体横磁模带隙出现在0.6766—0.8000Hz,差值为0.1234Hz。研究结论为光子晶体器件的制作提供参考。     

Pseudopotential study of lattice parameter and heat of formation for substitutional alloys

Ashcroft’s empty core pseudopotential is applied to the substitutional alloy (K-CS) to calculate the heat of formation and lattice parameter over the entire concentration range. At any concentration the defect crystal is considered to be equivalent to a perfect crystal with a modified lattice parameter and the potential parameter for the defect crystal is calculated by using some suitable interpolation formula. The calculated results agree well with the available experimental results.     

Observation of surface states in a truncated photonic crystal slab

The effect of lattice termination on the surface states in a two-dimensional truncated photonic crystal slab is experimentally studied in a high-index-contrast silicon-on-insulator system. A single-mode silicon strip waveguide that is separated from the photonic crystal by a trench of variable width is used to evanescently couple to surface states in the surrounding lattice. It is demonstrated that the dispersion of the surface states depends strongly on the specific termination of the lattice.     

稀土离子Eu3+掺杂Y2SiO5晶体的光谱和结构研究

用５１４．５ｎｍ、４８８．０ｎｍ的Ａｒ＾＋激光和４４１．６ｎｍ的Ｈｅ－Ｃｄ激光激发Ｅｕ＾２＋：Ｙ２ＳｉＯ５晶体的获得了一系列窄带荧光谱线,其中双重谱线结构源于Ｅｕ３＾＋离子发光中在该材料中占据两种不等价的非对称光学格位,测得了Ｅｕ＾３＋：Ｙ２ＳｉＯ５的Ｘ射线多晶衍射谱的面间距数据;计算了晶格常数和晶在角度,通过和非掺杂Ｙ２ＳｉＯ５晶体数据的比较,探讨了Ｅｕ＾２＋和Ｙ２ＳｉＯ５格位的相互影响。     

Dynamical theory of diffraction of plane and spherical waves by a periodic system of scatterers with isolated defects

Using the T-matrix formalism a method known from the crystal lattice dynamics is applied to the study of the diffraction of radiation by a crystal with isolated defects. The following cases are discussed: substitutional foreign atoms or vacancies without lattice deformation, lattice deformation, interstitial atoms. Plane or spherical primary incident scalar waves are considered.