锡苯和铅苯二聚反应的理论研究

采用密度泛函理论B3LYP方法,研究了锡苯和铅苯的[2+2],[4+2]及[4+4]二聚反应的微观机理和势能剖面,考察了Sn(Pb)原子上的2,4,6-三甲基苯基(Mes)取代基对反应势能剖面的影响.研究结果表明,所有反应均为协同过程,且大多数情况下,2个C—Sn(Pb)键同步形成.[2+2]和[4+2]反应在热力学和动力学上均比相应的[4+4]反应容易进行,而[4+2]反应在动力学上比相应的[2+2]反应有利.Sn(Pb)原子上的Mes取代基在热力学和动力学上均不利于反应的进行.铅苯的动力学稳定性与锡苯相当,但其热力学稳定性高于锡苯.     

New ESR-Electrochemical Cell Designs for Coaxial Microwave Cavity

本文报道了一种适用于同轴微波腔的新型ＥＳＲ—电化学池的设计。工作电极的长度可调节，部分屏蔽微波辐射的功能由上下两个屏蔽套承担。除了传统的螺线管，工作电极还可由打孔的金属筒、金属网、甚至复合材料制成。对电极可根据需要置于共振腔的外面或里面。总之，新设计灵活实用，适合更多的研究场合。本文列举了一些应用实例。     

一类生化反应数学模型的分析

本文讨论了生化反应中一类可逆两分子饱和反应,它的数学模型可近似表达为应用常微分方程定性和稳定性的方法分析了参数的所有情况,得到了正初值的正半轨线的有界性、正平衡点的稳定性及极限环的存在唯一性等结论。     

Nuclear Shadowing Effect on the K Factor in Au—Au Collisions

We investigate the nuclear shadowing effect on the K factor in the Drell-Yan process by introducing a Shadowing factor into the corresponding quantum chromodynamical αs order corrections.K factors for Au-Au collisions are calculated at the centre-of-mass system energies √s=60,130 and 200 GeV while the nuclear shadowing factor is taken into account.The numerical results indicate that the nuclear shadowing factor obviously raises the K value in the small x region,and for the same nucleon the K valus becomes smaller as the energy increases.The nuclear shadowing effect could be one reason for creating the non-constancy of the K factor.     

对一个力学碰撞问题的讨论

对普通物理力学中有关碰撞的一个问题,从恢复系数e的取值角度出发,进行了详细求解和讨论,得到了更完整的结果.     

Isospin Effect of Charged Particle Multiplicity in Intermediate Energy Heavy Ion Collisions

The dependences of He and intermediate mass fragments (IMF) production rates in the reactions 55 MeV/u ^40Ar ^58,64 Ni on the isospin, impact parameter and primary excitation energy of the reaction nuclear system were studied by using the 4π charged particle multi-detector array system (MUDAL). For the mentioned two reaction systems, the measured He particle contribution in the total charged particle multiplicity increases with increasing the total charged particle multiplicity but for the contribution of IMFs in the total charged particle multiplicity increases with increasing the total charged particle multiplicity at lower total charged particle multiplicities, and latter on it drops down with further increasing of the total charged particle multiplicities (see Fig.l). The experimental results of these two reaction systems with the same nuclear charge indicate that the contribution of He and IMFs in the total charged particle multiplicities are obviously isospin dependent.     

矩阵法拟定化学反应机理软件

本软件是根据Happel和Sellers提出的矩阵法编制的。用户只需输入基元反应方程式及其系数矩阵,即可得出全部动力学上有意义的反应路线。本软件不但可用于单一总反应的物系,也可用于多个总反应的物系,既适于均相反应,也适于非均相反应。它是拟定化学反应机理的有力工具。本软件用BASIC语言编写,由DOS3.3以上版本支持,可在APPLE-Ⅱ及其兼容机上运行,使用十分方便。     

Dependence of Isospin Fractionation on Beam Energy in Heavy Ion Collisions at Intermediate Energies

We investigated the dependence of isospin fractionation degree (N/Z)n/ (N/Z)Nfrag on the beam energy by using the isospin dependent quantum molecular dynamics model (IQMD). The (N/Z)n and (N/Z)Nfrag are the neutron proton ratio of nucleon emission (gas phase) and that of fragment emission (liquid phase) respectively. The calculated results show that (N/Z)n / (N/Z)Nfrag enhances with increasing the beam energy due to the increase of excitation energy of colliding system. But above properties is only occurred in the definiteenergy region.     

4，4′—二偶氮苯重氮氨基偶氮苯与Ag（I）的显色反应及其应用

本文报道了4,4′ -二偶氮苯重氮氨基偶氮苯在Triton X-100存在下与Ag(Ⅰ)的显色反应.在pH10.0的硼砂-氢氧化钠缓冲溶液中,试剂与Ag(Ⅰ)形成1∶1的红色配合物,其最大吸收波长为540nm,表观摩尔吸光系数为7.55×104L*mol-1*cm-1,Ag(Ⅰ)的浓度在0-0.28mg/L范围内符合比耳定律.应用于显影废液和钮扣电池液中Ag的测定,结果令人满意.     

钌(Ⅱ)卟啉催化顺式二苯乙烯类化合物的选择性合成

由芳醛制得的腙盐在钌(Ⅱ)卟啉催化下发生自身偶合，以较高收率合成了二苯乙烯类化合物(～90％的顺式选择性)。部分中间体及目标化合物的结构经^1H NMR，^13C NMR和MS表征。