ABA两亲性嵌段共聚物在双选择性溶剂中自组装行为的Monte Carlo模拟

采用Monte Carlo模拟方法研究了ABA两亲性三嵌段共聚物在两种选择性溶剂中的自组装行为.模拟结果表明,在保证溶剂总浓度一定的情况下,改变两种选择性溶剂的体积比对于ABA两亲性嵌段共聚物自组装所形成的胶束形貌结构有很大影响.随着双选择性溶剂体积比的改变,体系中胶束形貌结构将会发生由囊泡到层状,再到环状、棒状直至球...     

Local distinguishability by projective measurement

This paper proves that a set of orthogonal pure states are indistinguishable by restricted local projective measurement and classical communication if the sum of their Schmidt ranks is larger than the dimension of their joint Hilbert space. This result is useful in determining the local distinguishability of quantum states and is stronger in some respects than that of Hayashi et al [Phys. Rev. Lett. 96, 040501]. In addition, it presents a new method to determine the local distinguishability of orthogonal states by projecting measurement operators into their subspaces.     

单板机在气轨实验中的应用

本文研究了如何利用TP－801单板机来改进气垫导轨实验，使数据的采集、存储和打印能够一次完成，并给出了相应的电路图。     

金属材料内部缺陷精确工业CT测量方法

利用图像点扩散函数(PSF)近似计算法建立线阵探测器工业CT金属材料X射线衰减测量模型,并利用该测量模型对垂直于X射线平面边界灰度幅值进行数值计算,获得当前PSF曲线。在此基础上,建立基于近似PSF曲线的缺陷检测理论模型,并对缺陷进行定量检测分析。采用高能6 MeV工业CT线阵探测器系统,对含有人工缺陷的不锈钢试块进行缺陷检测试验。结果表明：相比于传统半高宽缺陷测量方法,本实验方法在缺陷定量检测精度上有较大提高,从而为提升金属材料内部缺陷的定量检测水平提供新的方法和技术途径。     

Study of the near-field modulation property of microwaviness on a KH2PO4 crystal surface

The KH 2 PO 4 crystal is a key component in optical systems of inertial confinement fusion (ICF).The microwaviness on a KH 2 PO 4 crystal surface is strongly related to its damage threshold which is a key parameter for application.To study the laser induced damage mechanism caused by microwaviness,in this paper the near-field modulation properties of microwaviness to the incident wave are discussed by the Fourier modal method.Research results indicate that the microwaviness on the machined surface will distort the incident wave and thus lead to non-uniform distribution of the light intensity inside the crystal;in a common range of microwaviness amplitude,the light intensity modulation degree increases about 0.03 whenever the microwaviness amplitude increases 10 nm;1 order diffraction efficiencies are the key factors responsible for light intensity modulation inside the crystal;the light intensity modulation is just around the microwaviness in the form of an evanescent wave,not inside the crystal when the microwaviness period is below 0.712 μm;light intensity modulation degree has two extreme points in microwaviness periods of 1.064 μm and 1.6 μm,remains unchanged between periods of 3 μm and 150 μm,and descends above the period of 150 μm to 920 μm.     

Internal energy and specific heat in a ferromagnetic- antiferromagnetic double layers

The internal energy and specific heat of a Heisenberg ferro- antiferromagnetic double-layer system are studied by using spin-wave theory and the retarded Green function method at low temperatures. Numerical results show that the antiferromagnetic intralayer coupling $J_2 $ has an important influence on internal energy and specific heat for a four-sublattice system with antiferromagnetic (or ferrimagnetic) interlayer couplings.     

7种白藜芦醇及其多羟基位衍生物的清除自由基活性机理的理论预测分析

白藜芦醇是一种具有广泛抗氧化活性的多酚类天然化合物,能有效阻断自由基链式反应。为研究白藜芦醇及其相关衍生物的清除自由基的活性机理及性质,本实验设计7种白藜芦醇及其多羟基衍生物结构并构建分子模型,使用Gaussian 09软件通过密度泛函法DFT对7种分子进行量子化学计算。分析发现原子电荷分布图和前线分子轨道图能直观阐述白藜芦醇及其多羟基衍生物的活性基团;羟基位OH电荷差值和前线分子轨道π电子云密度能很好表征各羟基位活性顺序;根据前线分子轨道能级差△E及能隙Egap对照表征预测了白藜芦醇及其多羟基衍生物的活性大小以及各羟基位的活性顺序,其中各羟基的活性顺序4、4’位羟基>3、3’位羟基>5、5’位羟基,且4、4’位羟基位是主要的活性位点,其相应量化参数能作为推测分子抗氧化活性的主要指标。最终预测3,3’,4,4’,5,5’-六羟基反二苯代乙烯是7种白藜芦醇及其多羟基衍生物中抗氧化活性最高的分子结构。通过量子化学计算研究所得结果对高抗氧化活性的白藜芦醇相关衍生物结构的筛选和设计具有理论指导意义。 更多还原     

Effects of anisotropy on quantum fluctuation of a three-layer system with mutisublattice

The quantum fluctuations of a three-layer Heisenberg model with six sublattices are studied by the retarded Green’s function method and the spin-wave theory.The effects of anisotropy on the quantum fluctuations at zero temperature are discussed.The results show that the interlayer anisotropy plays an important role in balancing the quantum competitions.     

Lattice stabilities,mechanical and thermodynamic properties of Al_3Tm and Al_3Lu intermetallics under high pressure from first-principles calculations

The effects of high pressure on lattice stability, mechanical and thermodynamic properties of L1_2 structure Al_3Tm and Al_3Lu are studied by first-principles calculations within the VASP code. The phonon dispersion curves and density of phonon states are calculated by using the PHONONPY code. Our results agree well with the available experimental and theoretical values. The vibrational properties indicate that Al_3Tm and A_3Lu keep their dynamical stabilities in L1_2 structure up to 100 GPa. The elastic properties and Debye temperatures for Al_3Tm and Al_3 Lu increase with the increase of pressure. The mechanical anisotropic properties are discussed by using anisotropic indices AG, AU, AZ, and the threedimensional(3D) curved surface of Young's modulus. The calculated results show that Al_3Tm and Al_3Lu are both isotropic at 0 GPa and anisotropic under high pressure. In the present work, the sound velocities in different directions for Al_3Tm and Al_3Lu are also predicted under high pressure. We also calculate the thermodynamic properties and provide the relationships between thermal parameters and temperature/pressure. These results can provide theoretical support for further experimental work and industrial applications.     

KDP晶体微纳米加工表层缺陷对其激光损伤阈值的影响

使用有限元方法分析了在激光辐照条件下,KDP晶体已加工表面存在的残余内应力、微裂纹及微孔等多种微纳米加工表层缺陷对晶体激光损伤阈值的影响。通过分析发现：KDP晶体微纳米加工表层缺陷的存在,会影响晶体表面的温度场及热应力场的分布,使入射激光的能量积聚在缺陷附近的很小范围内,造成晶体缺陷处产生局部熔融现象,从而使KDP晶体产生损伤,降低KDP晶体的激光损伤阈值。针对微纳米表层的微裂纹进行了损伤阈值测试实验,结果表明微裂纹的存在会降低KDP晶体的激光损伤阈值（约降低3 J/cm2）,实验结果与仿真结果符合得很好。