一维链状1,8-萘二酸四核锌配位聚合物[Zn4(1,8-nap)4(4,4''-bipy)2·0.5en·H2O]n的合成、结构、热稳定性及发光性质

羧酸配位聚合物是金属离子与有机羧酸构造块通过配位键或其他分子间弱作用力经自组装而成的一维、二维、三维的聚合物.由于这些配位聚合物具有新颖的拓扑结构以及在功能材料方面的潜在应用,同时又由于羧酸配合物比较稳定,所以设计和调控特殊配位聚合物成了当前的研究热点[1～4].     

双嵌段共聚物薄膜介观结构的耗散粒子动力学模拟

采用耗散粒子动力学(Dissipative Particle Dynamics, DPD)方法模拟两平行平板间的双嵌段共聚物体系的介观结构. 模拟结果表明, 随板间距的增大, 体系分层数量的增加是不连续的, 在分层数量的增加过程中, 出现不规则结构的过渡区；聚合物链末端距随板间距的增大呈周期性振荡, 振荡幅度逐渐减小. 对模拟结果的分析表明：层状结构转变点与分层数量之间存在近似线性关系；层状结构转变点近似与共聚物链长的2/3次方成正比.     

凝胶渗透色谱法测定聚丙烯腈共聚物分子量中宽分布校正法的应用

应用宽分布校正法对凝胶渗透色谱(GPC)进行了校正，将校正曲线用于聚丙烯腈(PAN)共聚物分子量的计算。对扣除色谱峰扩展效应前后的测试结果与乌氏粘度法测得的数据进行比较。结果表明，应用宽分布校正法时，必须扣除色谱峰扩展效应，才能得到较为准确的测试结果。     

配合物Cu(C15H12N2O3)(C5H5N)的合成和晶体结构

The title coordination compound with N-substituted-salicyl Schiff ligand, Cu(C₁₅H₁₂N₂O₃)(C₅H₅N), has been synthesized. The coordination compound crystallizes in orthorhombic system, space group Pbca with a=2.037 62(7) nm, b=0.698 45(2)nm, c=2.508 76(9)nm, V=3.570 4(2) nm³, Z=8, F(000)=1 688, D_c=1.529 g·cm^-3, M_r=410.91, μ=1.250 mm^-1, R=0.031 3 and wR=0.077 0. In the coordination compound, one phenolate oxygen, one carbonyl oxygen and one hydrazine nitrogen atom from the dianionic ligand N-salicylaldehyde-N′-(4-methoxybenzoyl) hydrazone and one pyridine nitrogen atom coordinate to Cu(Ⅱ) ion, forming a distorted square plane. CCDC: 218182.     

Synthesis and mesomorphic properties of n-butyl-4- [4-((4-n-alkoxyl-tetrafluorophenyl)ethynyl)benzyloxy]benzoates

A homologous series of n-butyl-4-[4-((4-n-alkoxyl-tetrafluorophenyl)ethynyl)benzyloxy]benzoates have been synthesized.Their phase transition temperatures have also measured by polarizing textural observation and confirmed by DSC.     

微过氧化物酶-8与Eu3+相互作用的机理

用紫外-可见(UV-Vis)吸收光谱和电化学方法研究Eu3+与微过氧化物酶-8(MP-8)相互作用的机理,发现Eu3+优先与MP-8中血红素基团的2个丙酸基的羧基氧发生强的配位作用,导致MP-8分子中血红素基团的非平面性、暴露程度和电化学可逆性的增加.过剩的Eu3+与MP-8分子中肽链上的含氧基团发生弱的相互作用,对血红素基团结构的影响较小.     

Studies on the Molecular Chain Conformation Stability of Aminated Konjac Glucomannan

Konjac glucomannan （KGM） was aminated by 2-chloroethyl-amine （CEA） as reagent so as to study the influence of concentration of CEA （based on the amount of KGM）, concentration of NaOH, reaction time and temperature on the extent of amination. And the molecular simulation technology was adopted to analyze the conformation stability of aminate （AKGM）. The results indicate that when the amount of CEA is higher, the extent of amination is higher. The optimum concentration of NaOH, reaction time and temperature are 10% NaOH, 70 ℃ and 45 rain, respectively. IR shows KGM is successfully aminated. The conformation of AKGM is in a random clew-like shape.     

Bayesian Estimation and Statistical Analysis of Risk Measurements

The Bayesian model are established for the VaR and related risk measurements. The relationship between VaR and other risk measurements including expect shortfall, tail condition expectation and conditional value at risk are discussed. Furthermore, the Bayesian estimates and Bayesian predictors of these risk measurement are derived. Thirdly, the consistency and asymptotic normality in the exponential risk model are proved. Finally, the numerical simulation method is used to verify the convergence rate under different sample sizes.     

聚合风险模型下Esscher风险度量的估计及其大样本性质

Esscher度量是一种重要的风险度量,在金融风险管理、保险精算中有广泛的应用,然而大部分关于Esscher风险度量的文献均在个体风险模型下考虑的.本文建立了聚合风险模型下Esscher度量的估计模型,得到了相应的非参数估计,并证明了估计的强相合性和渐近正态性,最后,通过数值模拟的方法验证了估计的大样本性质.     

基于Geant4的卢瑟福散射计算机模拟

利用Geant4对卢瑟福散射实验进行仿真模拟,改变模拟过程中的相关参数以达到不同实验条件的要求。对模拟过程中收集的数据进行分析得到的结果符合卢瑟福散射关系式。这说明利用计算机模拟卢瑟福散射实验是可行的。本文中的实验对大学物理实验教学的开展有很大的意义。