赤铁矿和三羟铝石吸附Cu~(2+)的红外光谱研究

应用红外光谱法,研究了不同pH值和Cu2+浓度条件下,合成赤铁矿和三羟铝石吸附Cu2+后表面羟基结构及其特征吸收峰的变化。结果表明:(1)随Cu2+浓度增加,赤铁矿表面H—O—H和OH的变形振动参与了吸附反应,Cu2+强烈地缔结在Fe—O上,形成了Fe—O—(Cu)结构。(2)酸性条件下,H+破坏了赤铁矿表面的O—H结构,NO3-促使弱峰1 131 cm-1的产生。随pH值增大,赤铁矿表面OH-逐渐由伸缩振动转变为变形振动,Fe—OH和Fe3+—O2-结构不断发生改变。(3)三羟铝石对Cu2+的吸附发生在高波位,随Cu2+浓度增大,其表面游离羟基的O—H弯曲振动、水分子的OH-伸缩振动和H—O—H弯曲振动均参与了吸附反应,Al—O基中的Al3+渐被Cu2+取代从而加强了较低波位的振动强度。(4)随pH值增加,三羟铝石Al—OH的弯曲振动和Al—O的伸缩振动逐渐发生着改变,表明吸附Cu2+后,在其表面形成了AlOCu+与AlOCuOH结构。     

基于交换作用的纳磁逻辑电路片上时钟结构研究

纳磁逻辑电路具有低功耗、非易失和可常温下制备等优点, 实现低功耗片上时钟是其集成化的必备条件. 本文提出了一种基于交换作用的纳磁逻辑电路片上时钟结构, 用载流铜导线产生的奥斯特场将铁磁体薄膜覆层进行磁化, 然后依靠铁磁体层与纳磁体界面存在的交换作用场使后者磁化方向发生翻转. 与轭式铁磁体时钟用外磁场控制纳磁体磁化方向相比, 该方案在功耗方面降低了5/6, 时钟边界杂散场强度降低了2/3, 达到降低功耗、减轻串扰的目的. 此外, 采用微磁仿真进一步验证了该时钟结构上的纳磁体逻辑阵列可以实现逻辑功能. 关键词： 纳磁逻辑 片上时钟 交换作用     

Phase and shape controlling of MnS nanocrystals in the solvothermal process

MnS nanocrystals with different phases and shapes were prepared through solvothermal synthesis. The products were characterized by X-ray diffraction (XRD), transmission electron microscope (TEM), UV–vis absorption and photoluminescence (PL) spectra. The solvent and reaction time played an important role in controlling the phase and shape of MnS nanocrystals. The possible mechanism of the shape evolution was investigated, which revealed that the crystal growth along the unique c axis of γ-MnS resulted in the rod-like MnS at the primary period, and the tetrahedral crystal seed of β-MnS with zincblende structure resulted in the interlinking of MnS rods, so the zigzag and three-branched and palm-like MnS appeared; with increasing reactive time the thermodynamically stable spherical α-MnS was favored through the Ostwald ripening process. The PL results showed that the intensity of γ-MnS was much weaker than that of α-MnS, and the trap state emissions of γ-MnS at 470 and 482 nm, respectively, disappeared, which might be ascribed to the difference of the shapes between the sphere and the rod or branch.     

诊断LiF单晶弹性变形的瞬态X射线衍射

利用瞬态X射线衍射技术对LiF单晶沿晶向[100]方向冲击加载的晶格变形进行了诊断研究。实验在神光Ⅱ装置的球形靶上进行,北四路激光驱动Cu靶获得的类He线作为X射线背光源,第九路为加载光源,对大小为7mm×7mm、厚300μm的受激光加载的LiF单晶衍射,实验获得了LiF单晶晶面(200)压缩和未压缩状态的衍射信号。实验结果表明:LiF单晶在激光沿[100]方向冲击加载下,晶格发生了弹性变形,(200)晶面间距变小,衍射线上移,晶格压缩量为11%;该瞬态X射线衍射技术可用于冲击加载下的微观动态响应特性测量。     

SANS investigation on evolution of pore morphology for varying sintering time in porous ceria

Precipitates of ceria were synthesized by homogeneous precipitation method using cerium nitrate and hexamethylenetetramine at 80°C. The precipitates were ground to fine particles of average size ∼0.7 μm. Circular disks with 10 mm diameter, 2 and 3 mm thickness were prepared from the green compacts by sintering at 1300° C for three different sintering times. Evolution of the pore structures in these specimens with sintering time was investigated by small-angle neutron scattering (SANS). The results show that the peak of the pore size distribution shifts towards the larger size with increasing sintering time although the extent of porosity decreases. This indicates that finer pores are eliminated from the system at a faster rate than the coarser ones as sintering proceeds and some of the finer pores coalesce to form bigger ones.     

2-(2-喹啉偶氮)-1,5-苯二酚分光光度法测定烟草样品中的钙

在 p H为 8.0的柠檬酸钠 -氢氧化钠缓冲介质中 ,Triton X- 10 0存在下 ,2 - (2喹啉偶氮 ) - 1,5苯二酚(QADHB)与钙反应生成 1∶ 1稳定配合物 ,λmax=5 5 5 nm,ε=4 .18× 10 4L· mol-1· cm-1。钙含量在 0 .1—2 5μg/ 2 5 m L的范围内符合比耳定律 ,方法用于烟草中钙含量的测定 ,结果令人满意。     

Structures and electronic properties of stoichiometric hydrogenatedaluminum clusters

The lowest-energy geometries and electronic-structure properties have been obtained for Al_nH_n (n=1-10) clusters within the density-functional theory using the generalized gradient approximation for the exchange correlation potential. The resulting geometries show that the hydrogen atoms tend to occupy outside positions and no hollow positions are found. The subunit Al_n of Al_nH_n (n=1-5) have little distortion, in comparison with corresponding pure Al_n cluster, whereas the subunit Al_n have large distortion from n=6. The stability has been investigated by analyzing the binding energy per atom and the second difference in energy, indicating that Al₈H₈ exhibit higher stability than others. The bonding property has been analyzed by calculating the Mulliken charges and Al–H distances. The calculated energy gap between the highest occupied molecular orbital and the lowest unoccupied molecular orbital (HOMO-LUMO), the vertical ionization potential, and the vertical electron affinity also confirm that Al₈H₈ is a stable cluster. The density of states (DOS) shows that Al_nH_n exhibit changes from molecular-like (Al₁H₁) to band-like structure (Al₁₀H₁₀) as n increases.     

Optimization of Verapamil Drug Analysis by Excitation-Emission Fluorescence in Combination with Second-order Multivariate Calibration

Excitation emission fluorescence matrices (EEMs) of Verapamil drug were obtained by direct and by derivatization fluorescence spectroscopy. The fluorescence excitation and emission wavelengths were displaced to longer wavelengths and the fluorescence intensity was enhanced upon derivation with respect to the native fluorescence of the drug. The complete EEM of the native fluorescence of the drug and of the derivatization product were rapidly acquired by using a charged-coupled device detector (CCD), which is advantageous in terms of speed in the analysis, with respect to the use of a conventional photomultiplier detector. The EEMs were analyzed by several second-order multivariate calibration methods exploiting the second order advantage. The three-dimensional decomposition methods used, based in different assumptions about the trilinearity of the three way data structure under analysis, were parallel factor analysis (PARAFAC), bilinear least squares (BLLS), parallel factor analysis 2 (PARAFAC2) and multivariate curve resolution—alternating least squares (MCR-ALS). The determination was performed by using the standard addition approach. The figures of merit of the PARAFAC and BLLS methods were calculated, obtaining a lower limit of detection with the derivatization procedure, when compared with the direct measurement of the fluorescence of the drug. In Verapamil drug the best estimations were found with the BLLS and the MCR-ALS models. In the quantification of Verapamil in a pharmaceutical formulation the best estimation, when compared with the result obtained by the US Pharmacopeia high performance liquid chromatography approach, was obtained by direct fluorescence spectroscopy with MCR-ALS and by derivatization fluorescence spectroscopy with the PARAFAC2 model.     

盒式方便收放单摆

介绍一种盒式方便收放单摆,内装卷式弹簧和摆绳,收放盒被固定在单摆支架立柱上端,前端开有缺口的摆绳悬挂板处于立柱上部,摆绳自收放盒拉出后陷入摆绳悬挂板前端的缺口中,摆球被连接于摆绳下端,它能使摆绳的收放如同使用钢卷尺一样方便自如,从而既为学生节省了大量无谓的调节时间,又使摆绳长度的测量更准确．该项目已申请国家发明专利（申请号：2006100221584）．     

Rate Constants for Reaction Between Hydroxyl Radical and Dimethyl Sulfide Under Real Atmospheric Condition

用相对速率方法分别考察了OH自由基与DMS在氮气、空气和氧气体系的反应速率常数. 发现使用HONO和CH3ONO作为OH自由基发生剂时,基态氧原子O(3P)对动力学的测定有很大的影响. H2O2为OH自由基的发生剂,室温下在氮气、空气及氧气体系下的速率常数分别为4.50×10-12,8.56×10-12和11.31×10-12 cm3/(molecule?s).在287～338 K,测得氮气和空气体系下的阿累尼乌斯表达式分别为:kair=(7.24±0.28)×10-13exp[(770.7±97.2)/T],kN2=(3.40±0.15)×10-11exp[-(590.3±165.9)/T