Fiber-optic reflex sensor for in-line production measurement

The paper describes experiments concerning distance measurement with fiber-optic sensor and improvement of the measurement principle. The sensor probe was well-designed with a small structure and multi-function. The novel optical fiber probe arrangement as well as the possibilities of use for complex measurement problems are explained using the measurement of an internal screw thread as an example. The experimental results show that the measurement uncertainty of the thread minor diameter can reach ±10 μm, and the stability of the measurement system is better than 0.07%.     

Phonon–replica transitions in InGaN/GaN quantum well structures

A side-bump feature in a photoluminescence (PL) spectrum of an InGaN compound was widely observed. With reasonable fitting to PL spectra with three Gaussian distributions, the temperature variations of the peak positions, integrated PL intensities, and peak widths of the main and first side peaks of three InGaN/GaN multiple quantum well samples with different nominal indium contents are shown and interpreted. The existence of the side peaks is attributed to phonon–replica transitions. The variations of the peak position separations and the decreasing trends of the first side peak widths beyond certain temperatures in those samples were explained with the requirement of phonon momentum condition for phonon–replica transitions. In the sample with 25% nominal indium content, the phonon–replica transition could become stronger than the direct transition of localized states.     

模拟退火法在吸收薄膜的椭偏反演算法中的应用

将一种广泛用于求解复杂系统优化问题的技术－－模拟退火法－－用来求解椭偏反演方程。首先假设一个薄膜模型，计算出其相应的椭偏参数（Ψ，Δ）的值，在这个计算值的基础上加入不同标准偏差的高斯噪声；然后将加入噪声后的值（Ψm,Δm)作为模拟的测量数据，采用模拟退火算法进行求解，验证得知这种方法求得的薄膜参数很接近于假设的薄膜模型参数的真值，与其他文献的报道结果一致，而且在扩大搜寻范围时，仍然可以得到准确解，从而证明了该方法的可行性以及有效性。     

离子注入诱导量子阱界面混合效应的光致荧光谱研究

采用多元芯片方法获得了一系列不同离子注入剂量的GaAsAlGaAs非对称耦合量子阱单元,通过光致荧光谱测量,研究了单纯的离子注入导致的界面混合效应.荧光光谱行为与有效质量理论计算研究表明,Al原子在异质结界面的扩散在离子注入过程中已基本完成,而热退火作用主要是去除无辐射复合中心. 关键词： 量子阱 离子注入 光致荧光谱 界面混合     

1,2,4,6—四苯基—2—羟基—8—氮杂双环[3、2、1]辛烷的核磁共振研究

用多种核磁共振实验方法并结合其它结构信息,确定1,2,4,6-四苯基-2-羟基8-氮杂双环[3、2、1]辛烷的化学结构,并指定该化合物的核磁共振归属。     

Assessment of dispersion corrections in DFT calculations on large biological systems

The performance of empirical dispersion corrections in DFT calculations has been assessed for several large, genuine biological systems that include MbAB, H64L(AB), and V68N(AB) (AB?=?CO, O₂), where Mb stands for a wild-type myoglobin, H64L is the (histidine64?→?leucine) mutated myoglobin, and V68N is the (valine68?→?asparagine) mutated myoglobin. The effects of the local protein environment are accounted for by including the five nearest surrounding residues in the calculated systems and they are examined by comparing the binding energies of AB to the myoglobin and to the porphyrin (Por) without residues. Three versions of Grimme's dispersion correction methods, labeled as DFT-D1, DFT-D2, and DFT-D3, were all tested. In the first version (-D1), the dispersion correction (E_disp) is calculated only for noncovalent interactions between molecular fragments and E_disp within a covalent molecule is not calculated. For the DFT functionals, for which the calculated Por–AB binding energies are already too large, only further overestimation occurs when a dispersion correction is made. The geometry optimizations show that the DFT-D2 and DFT-D3 approaches give too short distances between the residues and the heme moiety in the myoglobins and their calculated relative binding energies ΔE_bind(myoglobin-AB/Por–AB) are in poor agreement with experiment in most cases. DFT-D1 performs very well, ensuring structural and energetic features in close agreement with experiment.     

Magnetic transition and large reversible magnetocaloric effect in EuCu1.75P2 compound

The magnetocaloric effect(MCE) in EuCu1.75P2 compound is studied by the magnetization and heat capacity measurements.Magnetization and modified Arrott plots indicate that the compound undergoes a second-order phase transition at TC ～ 51 K.A large reversible MCE is observed around TC.The values of maximum magnetic entropy change(-△SxMma) reach 5.6 J·kg-1·K-1 and 13.3 J·kg-1·K-1 for the field change of 2 T and 7 T,respectively,with no obvious hysteresis loss in the vicinity of Curie temperature.The corresponding maximum adiabatic temperature changes(△Tadmax) are evaluated to be 2.1 K and 5.0 K.The magnetic transition and the origin of large MCE in EuCu1.75P2 are also discussed.     

高质量等曲率物参光像面数字全息显微系统

对等曲率物参光像面数字全息显微成像系统进行研究,分析了光路配置方法,推导了系统的点扩散函数,并由此指出了决定系统成像分辨率的因素及系统的成像特点,最后讨论了再现像光场一次位相畸变校正的方法.结果表明,等曲率物参光像面数字全息具有最大的信息容量;该系统的成像分辨率取决于显微物镜的数值孔径和CCD的像元大小,与CCD的光敏面尺寸无关;物体各点中通过显微物镜的所有频率成分均能被系统完全记录与再现,样品被照亮区域的大小对记录条件和再现像质没有影响;等曲率物参光像面数字全息系统是一种优化的全息记录与再现系统,利用该系统可以实现高质量成像.实验结果验证了理论分析的正确性.     

潘宁源放电的全三维电磁粒子模拟/蒙特卡罗碰撞数值算法研究

深入研究潘宁放电的物理机制, 研制了全三维高品质算法粒子模拟软件(PIC), 设计并添加了相应物理情景的蒙特卡罗碰撞模块(MCC), 并对电子、氢分子离子(H₂⁺)、氢正离子(H⁺)、氢三正离子(H₃⁺)同时进行了跟踪, 成功研制了全三维电磁PIC/MCC数值算法. 结合国内研究较热的潘宁放电模型, 对该算法进行模拟验证. 模拟结果显示: 采用有效的滤波算法能抑制电磁数值噪声, 电子能量呈麦克斯韦分布, 由于电子的径向漂移和加速导致离子源顶端H₂⁺产量较大. 关键词： 潘宁离子源 高品质算法 粒子模拟/蒙特卡罗