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991.
The high-pressure phase transition from ambient pressure α-LiBH4 to high-pressure β-LiBH4 was observed by Raman spectroscopy and X-ray diffraction between 0.8 and 1.1 GPa. The phase boundary between these two phases was mapped over a large range of temperatures using thermal conductivity studies and differential thermal analysis. The structure of the high-pressure phase could not be identified due to small number of experimentally observed reflections, but it was shown that it is different from previously reported theoretical predictions. 相似文献
992.
硅钨杂多酸与牛血红蛋白相互作用的研究 总被引:4,自引:0,他引:4
多金属氧酸盐作为抗艾滋病病毒、抗流感病毒和抗肿瘤的药物,引起了人们对多金属氧酸与蛋白质之间相互作用的极大关注。蛋白质空间结构的任何变化引起的构象变化都意味着蛋白质分子的活性改变,因此,蛋白质与内源性化合物及许多药物分子之间相互作用的研究一直受到人们关注[1 ̄3]。血红蛋白是动物及人体内执行输氧任务的蛋白质,是生命机体进行各种生理活动的主要承担者。血红蛋白分子中每条α链和β链含有的色氨酸(Trp)残基分别为α-14Trp、β-15Trp、β-37Trp。Alpert[4]等认为位于疏水腔内的β-37Trp是血红蛋白内源荧光的主要来源,同时β… 相似文献
993.
The adsorption of neutral glycine onto amorphous silica was investigated both theoretically and experimentally. DFT calculations were performed at the BLYP-631++G** level using a cluster approach. Several possible configurations involving the formation of H bonds between glycine and one, two, or three silanol groups (SiOH) were considered. The most favorable bonding of glycine with one silanol group (45 kJ mol(-1)) occurs through the COOH moiety, thus forming a cycle in which the CO group is an H-bond acceptor whereas the acidic OH group is an H-bond donor. With two or three silanol groups, additional H bonds are formed between the amine moiety and the silanol groups, which leads to an increased adsorption energy (70 and 80 kJ mol(-1) for two and three silanol groups, respectively). Calculated nu(CO), delta(HNH), and delta(HCH) values are sensitive to the adsorption mode. A bathochromic shift of nu(CO) as compared to the nu(CO) of free glycine (calculated in the 1755-1790 cm(-1) range) is found for glycine in interaction with silanol(s). The more H bonds are formed between the COOH moiety and silanol groups, the higher the bathochromic shift. For delta(HNH), no shift is found for glycine adsorbed on one and two silanol groups (where the amine is either not bound or an H-bond donor), whereas a bathochromic shift is calculated with three silanols when the amine moiety is an H-bond acceptor. Experimental FTIR spectra performed at room temperature for glycine adsorbed at 160 degrees C on Aerosil amorphous silica exhibit bands at 1371, 1423, 1630, and 1699 cm(-1). The experimental/calculated frequencies have their best correspondence for glycine adsorbed on two silanol groups. It is important to note that the forms giving the best correspondence to experimental frequencies are the most stable ones. 相似文献
994.
紫外分光光度法测定高山红景天根及其浸膏的有效成分 总被引:3,自引:0,他引:3
使用紫外分光光度法测定了高山红景天根不同部位及其浸膏中主要有效成分的含量.红景天甙、酪醇对照品溶液和供试品溶液在276nm处具有最大吸收峰,红景天甙对照品溶液的线性回归方程为A=0.00529c+0.00189,r=0.99997(n=8),线性范围为7.97~71.71mg/L,平均回收率为98.08%,RSD为2.60%(n=5).测得高山红景天原药材内层部分、外皮层部分和总体混合物部分主要有效成分(红景天甙和酪醇)的含量(以红景天甙计)分别为2.789%,2.385%和2.617%,其浸膏中主要有效成分的质量分数分别为6.384%,13.80%和6.700%.并用HPLC法验证了该法的准确性,结果表明,该法可用于红景天属植物原药材及其浸膏中主要有效成分的定量分析. 相似文献
995.
Klaus van Benthem Stephan Krämer Wilfried Sigle Manfred Rühle 《Mikrochimica acta》2002,138(3-4):181-193
An understanding of the correlation between microstructures and properties of materials require the characterization of the
material on many different length scales. Often the properties depend primarily on the atomistics of defects, such as dislocations
and interfaces. The different techniques of transmission electron microscopy allow the characterization of the structure and
of the chemical composition of materials with high spatial resolution to the atomic level: high resolution transmission electron
microscopy allows the determination of the position of the columns of atoms (ions) with high accuracy. The accuracy which
can be achieved in these measurements depends not only on the instrumentation but also on the quality of the transmitted specimen
and on the scattering power of the atoms (ions) present in the analyzed column.
The chemical composition can be revealed from investigations by analytical microscopy which includes energy dispersive X-ray
spectroscopy, mainly quantitatively applied for heavy elements, and electron energy-loss spectroscopy. Furthermore, the energy-loss
near-edge structure of EELS data results in information on the local band structure of unoccupied states of the excited atoms
and, therefore, on bonding. A quantitative evaluation of convergent beam electron diffraction results in information on the
electron charge density distribution of the bulk (defect-free) material.
The different techniques are described and applied to different problems in materials science. It will be shown that nearly
atomic resolution can be achieved in high resolution electron microscopy and in analytical electron microscopy. Recent developments
in electron microscopy instrumentation will result in atomic resolution in the foreseeable future. 相似文献
996.
Duncan?P.?FaggEmail author Vladislav?V.?Kharton Jorge?R.?Frade 《Journal of Solid State Electrochemistry》2004,8(9):618-625
Small (2 mol%) cobalt oxide additions to ceria-gadolinia (CGO) materials considerably improve sinterability, making it possible to obtain ceramics with 95–99% density and sub-micrometre grain sizes at 1,170–1,370 K. The addition of Co causes a significant shift of the electrolytic domain to lower pO2. This modification to the minor electronic conductivity of the electrolyte material has influence on the cathodic oxygen reduction reaction. The impedance technique is shown to provide information not only about polarisation resistance, but also about the active electrode area from analysis of the current constriction resistance. It is demonstrated that this current constriction resistance can be related to the minor electronic contributions to total conductivity in these materials. A simple imbedded grid approach gives control of the contact area allowing the properties of the electrolyte materials to be studied. A much lower polarisation resistance for the Co-containing CGO electrolyte is observed, which can be clearly attributed to an increased three-phase reaction area in the Co-containing material, as a consequence of elevated p-type conductivity. 相似文献
997.
Kuroda S 《Advances in colloid and interface science》2004,111(3):181-209
Langmuir-Blodgett (LB) films are constructed by successively transferring monomolecular layers formed at the air-water interface onto solid substrates. One of the advantages of the LB technique in fabricating molecular aggregates lies in the fact that it can employ various kinds of molecules by mixing them at the air-water interface. The mixed system may exhibit new properties that are not observed for individual components. This method would be useful, for example, in the studies of the formation and control of the J-aggregates of functional dyes that attract attention both in science and technology. In this paper, I review this subject mainly based on our recent results in merocyanines. LB films of merocyanine dyes, mixed with arachidic acid (C(20)), exhibit J-aggregate formation and have been serving as typical systems in revealing the physical and structural aspects of nanosized molecular aggregates constructed as monolayers. In the case of LB films of a merocyanine dye having benzothiazole as donor nucleus (abbreviated as DS), electron spin resonance (ESR) spectroscopy has been successful in determining the characteristic in-plane orientation of dye molecules with respect to the dipping direction, which led to the discovery of the flow orientation effect during the dipping process of LB films as the origin of optical dichroism often observed in LB films. In this article, after an introduction of ESR spectroscopy, three major topics on the merocyanine J-aggregation and its characterization in mixed films are discussed. The first topic is the observation and control of the size of J-aggregates in the dilution limit of dyes in arachidic acid matrix for a methyl-substituted DS (6-Me-DS). Dependence of atomic force microscopy (AFM) patterns on the molar ratio allows the identification of dye domains. J-band optical peak analysis based on the Kuhn's extended dipole model, supplemented by a novel application of femtosecond pump-probe optical spectroscopy, yields the size of the J-aggregates of 10(3). The second topic is the control of the J-band peak wavelengths by mixing two different kinds of dye molecules. The first case is the mixture of a J-forming 6-Me-DS and non-J-forming merocyanine analog, DO with benzo-oxazole instead of benzothiazole of DS. The second case is the mixture of both J-forming dyes but with different J-band peak positions, 6-Me-DS and another analog of 5-Cl-DS. The optical peak shifts depending on the molar mixing ratio will be presented. The last topic is related to the elucidation of electronic states of dye molecules in the J-aggregates. Light-induced ESR (LESR) of DS films with stable isotope ((15)N or (13)C)-substituted dyes provide clear evidence for the photoinduced charge transfer by the detection of hyperfine structures. Moreover, infrared (IR) spectroscopy of (13)C-enriched dye identifies the IR absorption peak of the relevant carbon in the chromophore. The results give evidence for the enhanced intramolecular charge transfer of dyes in the J-aggregates compared with an isolated merocyanine composed of donor and acceptor moiety. Lastly, the Cl attachment in 5-Cl-DS leads to a significant enhancement of the nitrogen hyperfine coupling in the LESR spectra. These examples and others demonstrate the potential of LB films of merocyanines in the studies of the nanosized molecular aggregates in monolayer assemblies. 相似文献
998.
LaCoO3 perovskite was prepared at 700°C using citrate precursors. The product was then characterized with X-ray diffraction (XRD) and X-ray absorption spectroscopy (XAS). The powder XRD pattern indicates rhombohedral or its monoclinic I2/a subgroup symmetry. The electronic configuration and the short-range atomic structure of the LaCoO3 perovskite at room temperature were investigated using synchrotron near-edge X-ray absorption spectroscopy (XANES) and extended X-ray absorption spectroscopy (EXAFS). From the XANES region of the XAS we conclude that Co(III) is at least partly in its intermediate- or high-spin state, which is in accordance with most of the published literature on LaCoO3 perovskite. The EXAFS region of the LaCoO3 perovskite spectrum, which up to now was almost not investigated, was simulated satisfactorily for the first two radial structure peaks in terms of the dominant scattering contributions generated with the FEFF8 code and the structural information available from crystallographic data. The best simulation results were obtained with I2/a symmetry. The obtained amplitude reduction factor, zero-energy shift and Debye-Waller factors are useful reference values for data analyses of similar compounds like partly substituted LaCoO3 perovskite, such as La1−xCaxCoO3 or La1−xSrxCoO3, which are materials of technical interest in catalyst and other applications. 相似文献
999.
Woo-Jin Lee Su-Il Pyun Tae-Hyun Yang Joong-Do Kim Young-Ho Baek Han-Gyu Kim 《Journal of Solid State Electrochemistry》1997,1(2):120-125
Hydrogen transport through a Pd-Ni alloy electrodeposited on a Pd substrate (Pd-Ni/Pd bilayer symmetric electrode) has been
investigated using cyclic voltammetry and a.c. impedance spectroscopy combined with the electrochemical hydrogen permeation
method. The permeation build-up current transients and the measured impedance spectra were analyzed using the time-lag method
for the bilayer electrode and a complex non-linear least squares data-fitting method based upon the derived Faradaic admittance
for the hydrogen absorption into and diffusion through the bilayer electrode under the permeable boundary condition, respectively.
The value of the hydrogen diffusivity in the Pd-Ni layer was lower than that in the Pd layer. Furthermore, the values of the
charge transfer resistance and equilibrium absorption constant for the Pd-Ni/Pd bilayer electrode were higher than those for
the Pd single layer electrode. From the experimental results, the role of the thin Ni(OH)2 film formed on the Pd-Ni layer surface in the hydrogen transport through the Pd-Ni/Pd bilayer electrode is discussed in terms
of its passivating effect and extremely large hydrogen solubility.
Received: 22 January 1997 / Accepted: 15 April 1997 相似文献
1000.
《Arabian Journal of Chemistry》2022,15(10):104116
The misuses of veterinary drugs can result in the accumulation of residues in food of animal origin that can make its way to the final consumer. Herein we describe a simple method for the accurate determination of beta-lactams, quinolones, sulphonamides, and tetracyclines in fish, poultry, and red meat. No extraction cartridges were used; instead, the extraction process consisted of the addition of an organic solvents, shaking, centrifugation, and dilution. An extensive validation process demonstrated an excellent linearity (R2 ≥ 0.99) for 23-drug residues. The recovery of drugs in different matrices at two concentration levels (n = 6) was in the range of 82–119%. The method was proved to be repeatable and reproducible with intra/inter-day measurements (RSDs lower than 20%). The quantification limits of drug residues were in the range of 0.8 to 45.3 ug/kg, which is well below the maximum residue limits set by most regulatory authorities. This method was successfully applied to the routine analysis of 20 fish, poultry, and red meat samples (n = 60). 相似文献