STRUCTURES,PROPERTIES AND QUANTUM CHEMISTRY STUDIES OF As-S-X(X=Cl,Br,I)AND As-Y-Br(Y=S,Se,Te)GLASSES

As-S-X(X=Cl,Br,I)and As-Y-Br(Y=S,Se,Te)glasses are studied with Self-Consistent-Field Dis-crete Variational X_α(SCF-DV-X_α),one of the molecule orbital.calculating methods in quantum chemistry.The chemicalbonding is studied to discuss the relations between structuresand properties with the variations of compositions of theglasses.The calculated results show that the strength of cova-lent and ionic bonds are both in the order of As-S-Cl>As-S-Br>As-S-I as well as As-S-Br>As-Se-Br>As-Te-Br,it isconsistent with the experimental result of the glass-transitiontemperature (Tg) of the corresponding glasses.The differ-ences of chemical bond strength and Tg among As-S-X(X=Cl,Br,I)glasses are larger are larger than those among As-Y-Br(Y=S,Se,Te)glasses and the largest difference ofchemical bond strength is that of ionic bond of As-X amongAs-S-X(X=Cl,Br,I)glasses,so the variations of X(X=Cl,Br,I),the end atoms on the chains in the glasses,play themore important role to affect the struture and property of theglasse     

ON STRUCTURE,HYDRATION ACTIVITY AND CHEMICAL BOND OF ALUMINATES CA AND CA_2 OF CEMENT MINERALS

Structures and hydration activities of alumi-nates CA and CA,of cement minerals are studied by SCF-DV-X_αmethod,one of the molecular orbital calculatingmethod in quantum chemistry.The calculated results of netcharges,enerbry levels of molecular orbitals and covalent bondorders are all consistent with the experimental result that thehydration activity of CA is higher than that of CA_2.     

Web Service作为应用程序插件的研究与应用

Web Service作为应用程序插件结合了Web Service与互操作2种技术。根据业务功能创建一个应用程序,将其编译为一个DLL类库,通过Web Service将其发布。再创建一个Windows客户程序,作为Web Service的入口。利用下载到本地的DLL文件和XML副本中的数据,客户就能在无法使用网络或数据库时实现本地数据操作。     

聚合物基复合材料的导热性能研究

讨论了聚合物基高导热高绝缘纳米复合材料的导热机理与常用的导热理论模型。考虑到填充率、温度等的影响，用不同的理论模型计算了氧化铝纳米颗粒填充环氧树脂的热导率，并结合相关研究实验对不同的导热理论模型进行分析比较。     

S3C44B0X的网络通信功能开发与实现

为进行S3C44B0X的网络通信,基于uClinux操作系统,从硬件设计和软件开发两方面对其进行了开发。采用RTL8201设计完成以太网接口电路,在分析uClinux的传输控制协议/网际协议（TCP/IP）协议栈的基础上,采用Socket函数实现S3C44B0X的网络通信功能。经过测试,S3C44B0X可以作为客户端与其他网络设备进行通信,实现其网络通信功能。     

Eleetronie Structures and Bonding Properties of Ti2AlC and Ti3AlC2

The relation among electronic structure, chemical bond and property of Ti2AlC, Ti3AlC2 and doping Si into Ti2AlC was studied by density function and the discrete variation （DFT-DVM） method. After adding Si into Ti2AlC, the interaction between Si and Ti is weaker than that between Al and Ti, and the strengths of ionic and covalent bonds decrease both. The ionic and covalent bonds in Ti3AlC2, especially in Ti-Al, are stronger than those in Ti2AlC. Therefore, in synthesis of Ti2AlC, the addition of Si enhances the Ti3AlC2 content instead of Ti2AlC. The density of state （DOS） shows that there is mixed conductor characteristic in Ti2AlC and Ti3AlC2. The DOS of Ti3AlC2 is much like that of Ti2AlC. Ti2SiAl1-xC has more obvious tendency to form a semiconductor than Ti2AlC, which is seen from the obvious difference of partial DOS between Si and Al 3/7.     

Ca_3Co_4O_9的柠檬酸盐溶胶凝胶合成及其电学性能

Ca3Co4O9是一类很有前景的新型氧化物热电材料.通过柠檬酸盐溶胶凝胶法合成粉体原料,采用常压烧结方式制备所需的陶瓷体,结果表明,该种材料在化学合成时处于强酸环境,pH值小于3.把干燥后的前驱物粉末在700℃保温2 h条件下煅烧,就可以获得晶型完好的片状晶体.在100~700℃内进行电学性能测试发现,材料属于p型半导体,电阻率随温度的升高而降低,Seebeck系数随温度的升高而增加,功率因子随着温度的升高而增大,且在600℃以后递增幅度加大.     

薄壁铝合金半球壳塑性成型与基于MSC.Marc的模拟技术应用研究

薄壁件如汽车覆盖件、机翼、导弹壳体等在汽车、航空、航天、船舶、家电、机械等行业有着广泛的应用,薄壁件的制造精度和质量也是制造工艺研究的重点对象之一.计算机辅助设计制造与工艺仿真等先进的手段为薄壁件的设计制造工艺提供了有利的保障,如在国外先进工业国家,板料成型的过程与回弹分析已应用于产品设计与模具制造的前期工作,在设计阶段通过仿真手段不断修正产品设计和模具的制造,避免了传统制造周期长、试验成本高的许多缺陷,缩短了产品研制周期的同时创造了较好的经济效益.     

Ca3Co4O9 的柠檬酸盐溶胶凝胶合成及其电学性能

Ca3Co4O9是一类很有前景的新型氧化物热电材料.通过柠檬酸盐溶胶凝胶法合成粉体原料,采用常压烧结方式制备所需的陶瓷体,结果表明,该种材料在化学合成时处于强酸环境,pH值小于3.把干燥后的前驱物粉末在700℃保温2h条件下煅烧,就可以获得晶型完好的片状晶体.在100～700℃内进行电学性能测试发现,材料属于p型半导体,电阻率随温度的升高而降低,Seebeck系数随温度的升高而增加,功率因子随着温度的升高而增大,且在600℃以后递增幅度加大.