Synthesis, Structure and Secondorder Nonlinear Optical Activities of a New Tungsten（0） Compound with Pyridine-2-thiolato Ligand, [Et4N][W（pyS）（CO）4] （pys = C5H4NS^-）

The reaction of W(CO)6 with pyOSNa (C5-H4NOSNa) and Et4NCl in MeCN affords a new tungsten(0) complex [Et4N][W(pyS)(CO)4] 1 (Mr.= 536.29).The crystal and molecular structures have been determined by X-ray single-crystal diffraction.Complex 1 crystallizes in the orthorhombic system,space group P212121 with a = 8.2429(5),b = 9.1045(4),c =26.8851(14) (A),β = 90.00°,V= 2017.66(18) (A)3,Z = 4,Dc.= 1.765 g/cm3,μ = 58.51 cm-1,F(000) =1048,the final R = 0.0204 and wR = 0.0400 for 4432 observed reflections with I ＞ 2σ(I).X-ray structure analysis revealed that the molecule is acentric and has large first-order hyperpolarizability (7.2 × 10-30 esu),so it could be an IR second-order nonlinear optical candidate material.     

长余辉发光玻璃SrAl2O4∶Dy, Eu的制备与发光性能研究

在低熔点破璃中掺杂一定量的长余辉发光粉制备了性能优良的长余辉发光玻璃。在保证发光玻璃均匀透明的基础上，发光性能随发光粉掺杂量的增加而增强，尽量降低假烧温度和减少保温时间可以保持良好的发光性能，在还原气氛制备的发光玻璃性能优于在空气中制备的。煅烧工艺对发光玻璃的微观结构有显著的影响。     

Synthesis, Crystal Structure and Electrochemical Properties of One-dimensional Chain Coordination Polymer [Co(Ⅱ)(C6H5CH=CHCOOH)2(4,4''-bipy)(H2O)5]n

A one-dimensional chain coordination polymer [Co(Ⅱ)(C6H5CH=CHCOOH)2(4,4'-bipy)(H2O)5]n has been synthesized with cinnamylic acid, 4,4'-bipy and cobaltous chloride as raw materials. Crystal data for this complex: monoclinic, space group P21/c, a - 1.1481(3), b =1.1230(2), c = 1.1759(3) nm, β = 97.054(4)°, V = 1.5046(6) nm3, Mr= 617.50, Dc = 1.363 g/cm3, Z= 2, μ(MoKα) = 0.627 mm-1, F(000) = 646, S = 1.062, R 0.0443 and wR = 0.1178. The crystal structure shows that two neighboring cobalt(Ⅱ) ions are linked together by one 4,4'-bipy, and the whole complex molecule adopts a one-dimensional chain structure. Each cobalt(Ⅱ) ion is coordinated with two nitrogen atoms from two 4,4'-bipy molecules and four oxygen atoms from four water molecules, giving a distorted octahedral coordination geometry. The electrochemical properties were analyzed by combining with the crystal structure.     

高介电常数TiO2纳米晶的表面态研究

将钛酸四丁酯和硬脂酸在熔融状态下混合均匀后置于冷水浴中,使其凝固成凝胶,通过控制烧结过程中氧气的含量,成功地制备出粒度均匀、介电性能好的纳米晶TiO2.通过采用X射线光电子能谱和表面光电压谱对纳米晶TiO2表面状态的分析发现,材料表面存在大量的氧空位缺陷,暴露在粒子表面上的主要是一些金属Ti4+.纳米材料的这种表面状态对其极化性质具有重要的影响,使其在接近静态条件下的低频介电常数远大于常规材料的介电常数.     

水相湿法改性纳米碳酸钙表面性质的研究

用特定的表面改性剂在水相中对纳米碳酸钙的悬浮液进行了湿法改性。红外光谱和热失重分析证明,改性剂与碳酸钙之间以化学键结合;沉降体积和接触角的测定结果说明改性粒子在液体石蜡中的润湿性和疏水性得到了提高;透射电子显微镜照片显示改性粒子在液体石蜡中有更好的分散性;体系粘度实验表明改性粒子与液体石蜡之间有较好的相容性。     

含吩噻嗪金属配合物的合成及非线性光学性质研究

本文报道了一种新的配体:10-乙基-3-甲酰吩噻嗪缩肼基二硫代甲酸甲酯(HL)及其金属配合物的合成。采用了元素分析、质谱、核磁共振、红外光谱对配体及其金属配合物进行了表征。此外,并应用紫外、荧光和Z-扫描技术,测定了配体及其金属配合物的荧光最佳发射波长(λ_max^em)、荧光量子产率(Φ_f)、寿命(τ)和非线性光学性质。结果表明它们在DMF溶液中都能发射出较强的橄榄色荧光,配体及其金属配合物都有双光子吸收,并且金属配合物的非线性光学效应比配体明显增强。用半经验量子化学方法(RHF/PM3)计算结果与实验值较为吻合。     

拓扑指数法研究显色剂结构与反应性能关系

本文讨论了２９个不对称色酸双偶氮膦酸型显色剂的分子联接性指数，并将其与结构选择性因子相结合，用于偶氮类剂结构与铈显色反应灵敏度的相关性研究，讨论了显色剂结构对显色反应灵敏度的影响。     

新铌酸盐Ba5NdTi3Nb7O30的合成与介电性能

The New Niobate Ba₅NdTi₃Nb₇O₃₀ was synthesized by solid state reaction at 1250℃ for 48h. The crystal structure and dielectric properties of Ba₅NdTi₃Nb₇O₃₀ were determined by X-ray powder diffraction and dielectric measurements. The results show that Ba₅NdTi₃Nb₇O₃₀ belongs to ferroelectric phase of tetragonal tungsten bronze structure at room temperature with unit cell parameters: a=1.24424(4)nm, c=0.39476(2)nm, calculated density 5.719g·cm^-3. Ba₅NdTi₃Nb₇O₃₀ belongs to relaxor ferroelectrics. The phase transition temperature (T_c) of Ba₅NdTi₃Nb₇O₃₀ from ferroelectric to paraelectric is found to shift toward higher temperature side at higher fre-quency, and T_c is 90℃ at 1kHz. At room temperature, the dielectric constant (ε_r) and dielectric loss of Ba₅NdTi₃Nb₇O₃₀ decrease with the increase of frequency, and Ba₅NdTi₃Nb₇O₃₀ ceramic have high dielectric constant 489 at 1kHz.     

雷尼镍催化剂的吸附量热研究

雷尼镍催化剂的吸附量热研究王益沈俭一（南京大学化学系，南京２１００９３）ＨａｎｓＷａｒｌｉｍｏｎｔ（ＩｎｓｔｉｔｕｔｅｆｏｒＳｏｌｉｄＳｔａｔｅａｎｄＭａｔｅｒｉａｌｓＲｅｓｅａｒｃｈ，ＤｒｅｓｄｅｎＤ０１０６９，Ｇｅｒｍａｎｙ）关键词雷尼镍...     

SA耐火材料多晶结构与性能的研究

本实验采用磨具废砂和炉皮SiC废砂生产SA耐火材料，通过XRD分析和计算机处理确定各试样中的晶相（4H－SiC，33R－SiC，3C－SiC，α－Al2O3，β-石英和Al6Si2O13）及其各相的含量。通过材料性能与结构综合分析，确定较好的配方，其含量：磨具废砂50％，炉皮砂45％，结合剂5％，外加矿化剂2％。