硅酸盐中Si—O~(br)键与Si—O~(ter)键相对强度的量子化学研究(英文)

用ab-initio法对硅氧烷及硅酸分子的研究指出,在硅酸盐中,由于电子的局域性,体系的总能量可以向结构单元或双中心分割:从而可以得到Si-O~(br)比Si-O~(ter)更稳定。用这些结果可以解释硅酸盐的许多性质。     

Cryptomelane（KxMn8-xO16）： Natural active octahedral molecular sieve（OMS-2）

The Xiangtan manganese deposit (XTM) used to be considered a supergene oxide manganese ore in South China. We reported a new identification of the naturally outcropping cryptomelane by examining the physical, chemical and structural features of the XTM supergene oxide manganese ore. The MnO2 content was over 90%, K2O more than 3%, and water from 2.2%-3.1% which is similar to one in zeolite. The cell parameters of the cryptomelane were given as a0 = 0.9974 nm, b0 = 0.2863 nm, c0 = 0.9693 nm and β= 91.47°. There was a larger pseduotetragonal tunnel in the natural cryptomelane that was formed by [MnO6] octahedral double chains with aperture of 0.462×0.466 nm2, filled with K cations resulting in some Mn3+ substituting for Mn4+ to balance the negative charges of structure. The finding is important not only for prospecting manganese resources in South China, but also in application of octahedral molecular sieve of natural cryptomelane as that developed in the tetragonal molecular sieve of natural zeolite o     

Combustion energies and standard molar enthalpies of formation for the complexes of the first-row transitional metal chlorides withL-α-histidine

Seven novel solid complexes of the first-row transitional metal with L-α-histidine were synthesized, and their compositions were determined. The constant-volume combustion energies of the complexes were measured by a precision rotation bomb calorimeter. The standard molar enthalpies of combustion and the standard molar enthalpies of formation were calculated. The results indicated that the plots of the standard enthalpies of formation against the atomic number of the metal show a regularity of zigzag.     

Stress corrosion cracking and its anisotropy of a PZT ferroelectric ceramics

It is known that some types of ceramics, like Al2O3 and ZrO2, undergo stress corrosion cracking (SCC) or static fatigue fracture under static loading, ever in a rela-tively mild environment, such as moist atmosphere or water at room temperature, which leads to a time-dependent fracture[1—4]. For a transmission electron microscopy specimen of YBa2Cu3O7-x ceramics superconductor, SCC induced by residual stress can occur in an atmosphere with low moisture content[5]. For a lead zirconate ti…     

房屋增层事故原因及预防措施

房屋增层是近年我国各城市为提高房屋利用所采用的一种行之有效的方法，并且已取得了很好的经济效益，文章中列举了国内的一些房屋增层所出现的事故，并对其作出分析，最后又提出了预防事故发生的措施。     

一类非线性系统的次谐波分枝问题

研究了具有周期外力的非线性系统的解产生不同的次谐波分枝的参数范围，并且指出了无穷多次谐波分枝是如何与smale马蹄型混沌解共存的．     

含苯并三氮唑的三脚架化合物及其配合物研究

合成了两个新的三脚架结构化合物；1，1，1-三（1-苯并三氮唑基甲氧甲）丙烷（A）和三[2，1-苯并三氮唑基甲氧基）乙基]胺（B），获得了它们和一些过渡金属离子形成的配合物，并用元素分析，红外光谱，摩尔电导和热分析等手段对其进行了表征。     

带有油膜轴承的裂纹轴转子系统故障特征分析

通过大量仿真计算，对于带有油膜轴承的裂纹轴转子系统的故障特征进行了较为全面的论证．这些特征是通过三维频谱、转速-振幅特性和周期分岔特性来表达的．除了分析裂纹轴转子系统的基本故障特征外，还重点分析了作为故障特征的一个重要方面的非线性行为．为诊断转子系统裂纹故障提供了理论依据．     

用自定义C函数创建中文立体上弹式菜单

通过BIOS中断调用建立一组自定义C函数，在文本方式下，以任意背、前景色显示以矩形框修饰的窗口和以任意位置、背景、前景、字体、字型显示汉字，从而建立中文立体上弹式菜单，并给出了实现的源程序．     

蒸馏水润滑下Si3N4—白口铸铁摩擦面上表面膜的分析

在环－块磨损试验机上考察了蒸馏水润滑下Ｓｉ３Ｎ４分别与白口铸铁和碳钢（作对比用）配副的摩擦磨损特性．在ＳＥＭ下观察了白口铸铁磨面表面膜的形成过程，用ＸＰＳ、ＦＴＩＲ和ＸＲＤ分析了表面膜的成分、组成与结构，并对其形成机理进行了探讨．结果表明，Ｓｉ３Ｎ４在水润滑下摩擦时磨面上发生了氧化和水解反应：当Ｓｉ３Ｎ４与白口铸铁配副时，由于铸铁中碳化物的剥落而形成剥落坑，Ｓｉ３Ｎ４磨屑嵌入剥落坑并氧化和水解，其反应产物富集于剥落坑中，脱水聚合后形成硅胶，从而在磨面形成具有一定厚度和面积的含硅胶的表面膜，表面膜的形成保护了陶瓷和铸铁磨面，使其变得很光滑，从而使摩擦系数降至０．０２，并使系统磨损率几乎接近于零；当Ｓｉ３Ｎ４与碳纲配副时，由于碳钢没有能力富集Ｓｉ３Ｎ４的氧化和水解产物，故磨面不能形成有效的表面膜，所以其摩擦系数仍然较高，且系统磨损率亦较大