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.     

基于Internet的远程教育系统模型研究

随着计算机网络技术的发展，远程教学系统的结构发生了重大的变化，逐步由原来的客户机／服务器(C／S)结构转变为基于Internet的浏览器／服务器(B／S)结构。本文提出了基于CORBA技术的B／S结构系统模型。分析了其运行过程，并与传统的结构进行了比较，指明了其优越性。在本文的结尾。指出了使用这种技术的一个具体例子。     

汽车计算平台工程国外相关标准概述

结合我国汽车计算平台工程,分析了国外相关的标准现状和基本框架,并为今后工作的开展提出了建议.     

Efficient multicast search under delay and bandwidth constraints

The issue of a multicast search for a group of users is discussed in this study. Given the condition that the search is over only after all the users in the group are found, this problem is called the Conference Call Search (CCS) problem. The goal is to design efficient CCS strategies under delay and bandwidth constraints. While the problem of tracking a single user has been addressed by many studies, to the best of our knowledge, this study is one of the first attempts to reduce the search cost for multiple users. Moreover, as oppose to the single user tracking, for which one can always reduce the expected search delay by increasing the expected search cost, for a multicast search the dependency between the delay and the search cost is more complicated, as demonstrated in this study. We identify the key factors affecting the search efficiency, and the dependency between them and the search delay. Our analysis shows that under tight bandwidth constraints, the CCS problem is NP-hard. We therefore propose a search method that is not optimal, but has a low computational complexity. In addition, the proposed strategy yields a low search delay as well as a low search cost. The performance of the proposed search strategy is superior to the implementation of an optimal single user search on a group of users. Amotz Bar-Noy received the B.Sc. degree in 1981 in Mathematics and Computer Science and the Ph.D. degree in 1987 in Computer Science, both from the Hebrew University, Israel. From October 1987 to September 1989 he was a post-doc fellow in Stanford University, California. From October 1989 to August 1996 he was a Research Staff Member with IBM T. J. Watson Research Center, New York. From February 1995 to September 2001 he was an associate Professor with the Electrical Engineering-Systems department of Tel Aviv University, Israel. From September 1999 to December 2001 he was with AT research labs in New Jersey. Since February 2002 he is a Professor with the Computer and Information Science Department of Brooklyn College - CUNY, Brooklyn New York. Zohar Naor received the Ph.D. degree in Computer Science from Tel Aviv University, Tel Aviv, Israel, in 2000. Since 2003 he is with the University of Haifa, Israel. His areas of interests include wireless networks, resource management of computer networks, mobility, search strategies, and multiple access protocols.     

The 4D Klein-Gordon, Dirac and Quantization Equations from 5D Null Paths

Results from 5D induced-matter and membrane theory with null paths are extended to show that a particle obeys the 4D Klein-Gordon equation but with a variable mass. The Dirac equation also follows, but raises concerns about 4D quantization in the two natural 5D gauges, and reopens the question of a Regge-like trajectory for the spin angular momenta and squared masses of gravitationally-dominated systems.     

基于模式理论光栅椭偏参数反演的数值模拟

将一种广泛用于求解系统优化问题的方法——正单纯形法，求解光栅的椭偏方程。首先，利用求解光栅的傅立叶模式理论对TE和TM波的复反射系数进行求解。然后计算出其相应的椭偏参数(△，Ψ)，并在该值的基础上加入不同偏差的随机高斯噪声，将加入噪声后的值(△m，Ψm)作为模拟测量值。最后使用优化算法进行反演。通过对几种常用面形光栅椭偏参数的数值模拟，一方面表明傅立叶模式理论计算光栅的椭偏参数不仅精度高。而且速度快；另一方面表明利用正单纯形法得到的光栅参数值很接近于正演时假设的参数值，从而从理论上证明了利用椭偏法测量光栅各种光学参数的可行性。     

The mechanism of ethylene polymerization by nickel salicylaldiminato catalysts - Agostic interactions and their kinetic isotope effects

The ethylene polymerization reaction of a neutral nickel catalyst was studied by DFT calculations at the Becke3LYP/6-31G(d) level of theory. As in related cases a β-agostic bond stabilizes the nickel alkyl ground states. Transition states for the insertion of the olefin show a distinct α-agostic interaction, which has not been observed for late metal polymerization catalysts before. An ethylene-alkyl complex was identified as the resting state of the reaction. The overall barrier height of the reaction amounts to 17.54 kcal/mol, which slightly increases to 17.60 kcal/mol for the polymerization of deuterated ethylene. Therefore, a small positive kinetic isotope effect (k_H/k_D = 1.09) can be calculated, which is caused by the α-agostic interaction in the transition state. A comparison to other late metal based polymerization systems reveals that the ethylene coordination step of highly active catalysts is significantly lower in energy compared to catalysts which are only moderately active.     

不等波纹函数低通原型的理论及应用

本文提出不等波纹函数低通原型，并对其理论进行初步探讨。切比雪夫函数及最平坦型巴特活兹函数皆为其特例。文中给出不等波纹函数的几个性质，最后给出两个应用实例，消除耦合环自感部分的影响；抑制高次模的微带圆盘腔带通滤波器。     

铁分子Fe2的自旋极化效应

采用密度泛函方法(B3P86)对 Fe_2分子结构进行了优化.计算结果中未观察到自旋污染,基态波函数与高态波函数并未混杂,结果表明,Fe_2中有8个未配对电子,这些电子空间分布不同和自旋平行产生的自旋极化效应,使 Fe_2能量最低.计算结果表明,Fe_2分子的基态是~9∑_g~ ,并非~7Δ_u,进而表明 Fe_2的自旋平行效应比电子自旋配对效应要强.计算得到该分子基态的二阶、三阶和四阶力常数分别为1.4115×10~(-2)aJ/nm~2、-37.1751×10~3aJ/nm~3和 98.7596×10~4aJ/nm~4；光谱数据ω_eχ_e、B_e、α_e分别为0.3522、0.0345、 0.4963×10~(-4)cm~(-1)；离解能为3.5522eV,平衡键长为0.2137nm,振动频率为292.914cm~(-1)；并得到了 Murrel-Sorbie 函数.     

人体中的伯努利方程

本文从设计实验入手,形象诠释伯努利原理,并从物理学角度出发,根据人体体液流动的实际情况,运用伯努利原理及经典的伯努利方程,从人体血液循环、房水循环的压力形成和改变方面,把物理学的基本理论运用于分析人体体液压力的变化。