Theoretical Study on the Long-lived Complexes for the Na＋I2 Collision System

For the Na I2 collision system, theoretical study is performed on the QCISD(T) level by using ab initio method. The ab initio potential energy surfaces are got and on them the long-lived complexes are found and optimized. These results verify the crossed molecule beam experimental phenomenon and the detailed geometry structures are given for the first time. The role of the complexes in the reaction path is also described in detail.     

Regioselective Synthesis of Multi-substituted Phenylselenomethyl Isoxazolines

A mild, regioselective 1, 3-dipolar cycloaddition protocol for the preparation ofphenylselenomethyl isoxazolines through substituted allyl phenyl selenides and nitrile oxides wasreported.     

Synthesis of New 13-O-Acylavermectin Bl Aglycones

Six new 13-O-acylavermectin Bl aglycones(3-8) were synthesized from avermectin B1 aglycone and their bioactivities were evaluated against Spodoptera exigua, Spodoptera eridania, Tetranychus urticae and Aphis fabae.     

Direct Observation of Non-covalent Complexes for Phosphorylated Flavonoid-protein Interaction by ESI

Diethyl flavon-7-yl phosphate was synthesized by modified Atheron-Todd reaction. The result of ESI shows that the phosphated flavonoids possess stronger binding affinities toward proteins such as myoglobin, insulin and lysozyme and are easier to form the non-covalent complexes with them.     

Study on the covalence of Cu and chemical bonding in an inorganic fullerene-like molecule, [CuCl]_(20)[Cp~*FeP_5]_(12)[Cu-(CH_3CN)_2~+Cl~-]_5, by a density functional approach

The titled inorganic fullerene-like molecule (hereafter abbreviated as IFM) was recently synthe-sized by Bai et al.[1], which attracts a lot of interests from inorganic and organometallic chemists, and questions are raised for this smart molecule: (ⅰ) Why CuCl can react with Cp*FeP5 in solvent CH3CN to form IFM? (ⅱ) What is the nature of chemical bond-ing? (ⅲ) What is the covalence of Cu in this mole-cule? In this paper we intend to answer these questions in terms of the soft-hard …     

一类二阶椭圆型微分方程振动性的判定

利用积分平均和完全平方技巧，给出了一类二阶椭圆型微分方程所有解在R^n的一个外区域Ω上均振动的新的充分条件。     

完全正矩阵的整数分解

n阶矩阵A称为完全正的,如果A有分解:A=BB^T,其中B为元素非负矩阵,B的最小可能列数称为A的分解指数.本文考察低阶双非负矩阵在整数环上的完全正分解及其分解指数.     

蒸汽活化对钙基脱硫剂孔结构及固硫能力影响的实验研究

本文用实验方法研究了在电站锅炉排烟温度条件下，水蒸汽对钙基脱硫剂的活化作用．实验结果表明，蒸汽活化使得脱硫剂孔结构发生了显著变化并明显改善了脱硫剂的固硫能力．这为进一步了解活化机理及开发省水，经济的排烟脱硫技术提供了依据．     

合浦珠母贝(Pinctada martensii,Dunker)珍珠囊体外预培育的初步研究

０．３％胰蛋白酶液（２５℃）消化外套膜组织的第５～１５ｍｉｎ时间段所收获的细胞产物中，表皮细胞具有最高的纯度和贴壁活性；细胞悬液的体外短期培养过程中小牛血清和珠母贝组织提取物对于细胞在体外的生长和在珠核表面的贴附具有促进作用．     

一种可实时化的多光谱图像融合系统

在多光谱摄影和光电成像技术基础上，本文提出了一种可实时化的多光谱图像融合系统。与多光谱摄影相比，不仅可实现多光谱实时化摄像，而且光谱响应进一步向近红外延伸，并引入图像处理技术。实验表明：这种技术对于增加系统的识别能力具有明显的作用，可进一步构成不同用途的新型多光谱图像融合系统。