Atomic Interferometry in Gravitational Fields: Influence of Gravitation on the Beam Splitter

The laser induced splitting of atomic beams inthe presence of a gravitational field is analyzed. Inthe frame of a quasiclassical approximation, the motionof the atomic beam through a laser region with rectangular profile is calculated. Beside theusual beam splitting due to the atomlaser interaction,an additional splitting occurs due to the anomalouseffective interaction with the gravitational field. In a first order approximation in thegravitational acceleration, the outcome of an atominterferometry experiment is given, which includes thevarious corrections owing to the gravitationalmodification of the beam splitting process.     

低频室内声散射计算机模拟方法

近年来,声散射的模拟成为室内声场计算机模拟研究的重点。现有的方法一般是依据壁面性质(结构、粗糙度等),利用经验确定散射系数,并基于该系数来模拟室内散射声能的分布。这种方法在低频情况下的精度较差,主要原因是忽略了在低频声场中起重要作用的波动现象。为此,本文提出一种新的计算壁面散射的模型,该模型既可考虑壁面上产生的散射声能,又可计算因壁面边缘衍射而产生的散射声能。文中通过模拟和实测数据的对比,分析验证了该模型的有效性,并给出了表面散射系数的取值规则。     

Sorption and separation of CO2 via nanoscale AlO(OH) hollow spheres

The CO(2) uptake on nanoscale AlO(OH) hollow spheres (260 mg g(-1)) as a new material is comparable to that on many metal-organic frameworks although their specific surface area is much lower (530 m(2) g(?1)versus 1500-6000 m(2) g(?1)). Suited temperature-pressure cycles allow for reversible storage and separation of CO(2) while the CO(2) uptake is 4.3-times higher as compared to N(2).     

Sulfur and selenium: the role of oxidation state in protein structure and function

Sulfur and selenium occur in proteins as constituents of the amino acids cysteine, methionine, selenocysteine, and selenomethionine. Recent research underscores that these amino acids are truly exceptional. Their redox activity under physiological conditions allows an amazing variety of posttranslational protein modifications, metal free redox pathways, and unusual chalcogen redox states that increasingly attract the attention of biological chemists. Unlike any other amino acid, the "redox chameleon" cysteine can participate in several distinct redox pathways, including exchange and radical reactions, as well as atom-, electron-, and hydride-transfer reactions. It occurs in various oxidation states in the human body, each of which exhibits distinctive chemical properties (e.g. redox activity, metal binding) and biological activity. The position of selenium in the periodic table between the metals and the nonmetals makes selenoproteins ideal catalysts for many biological redox transformations. It is therefore apparent that the chalcogen amino acids cysteine, methionine, selenocysteine, and selenomethionine exhibit a unique biological chemistry that is the source of exciting research opportunities.     

Evaluation of sulfur, selenium and tellurium catalysts with antioxidant potential

Oxidative stress is implicated, either directly or indirectly, in the pathology of a range of human diseases. As a consequence, the development of efficient antioxidants for medical use has become increasingly important. We have synthesised a range of structurally related organo-sulfur, -selenium and -tellurium agents and demonstrated that a combination of electrochemical methodology, in vitro assays and cell culture tests can be used to rationalise the antioxidant activity of these catalytic agents. Based on its exceptionally low anodic oxidation potential (Epa) and high activity against the representative oxidative stressors tert-butyl hydroperoxide and peroxynitrite, 4,4'-dihydroxydiphenyltelluride is predicted to be a potent antioxidant. This compound exhibits a correspondingly high activity with a remarkably low IC50 value of 20 nM, when tested in PC12 cell culture using a bioassay indicative of the early stages of Alzheimer's disease.     

Covalent chemistry and conformational dynamics of topologically chiral amide-based molecular knots

The readily available in gram quantities tris(allyloxy)knot of the amide-type 5 (knotane) can be completely and partially deprotected with nBu(3)SnH in the presence of a palladium catalyst resulting in hydroxyknotanes 7-9. These, in turn, react with diethylchlorophosphate giving rise to knotanes equipped with between one and three phosphoryl groups. Sulfonylation of bis(allyloxy)monohydroxyknotane 8 with p-toluenesulfonyl chloride and, following removal of one or two allyl groups from the intermediate monosulfonate 13, give rise to sulfonyloxy-allyloxy-hydroxy- and sulfonyloxy-dihydroxy-knotanes 15 and 14, respectively. This provides a convenient method for the preparation of knotanes with any substitution pattern. All new knotanes have been isolated in preparative amounts and as highly pure substances with an exception of allyloxy-dihydroxyknotane 9. This compound could only be obtained as a mixture with the corresponding monohydroxy-derivative 8. The structures of all synthesized compounds were established by means of FAB and MALDI TOF mass spectrometry, (1)H and (31)P NMR spectroscopy. The triphosphorylated knotane 10 exhibits high solubility in alcohols, allowing its complete enantiomeric resolution with a commercially available chiral HPLC column. (1)H,(1)H DQF-COSY correlation spectroscopy along with H/D exchange experiments and ab initio calculations provided the first detailed (1)H NMR signal assignments of knotanes in [D(6)]DMSO solution. The combination of variable temperature (1)H and (31)P NMR spectroscopy and molecular modeling has been applied to study the conformational behavior of the new knotanes in different solvents. It has been shown that in DMSO solution at room temperature knotanes exist in a relatively rigid nonsymmetrical conformation similar to that found in the solid state while faster conformational exchange leading to the average D(3) symmetrical structure was detected in a number of other solvents.     

Die Kristallstrukturen der Monohydrate von Lithiumchlorid und Lithiumbromid

Crystal Structure of the Monohydrates of Lithium Chloride and Lithium Bromide Using single crystal analysis and powder diffraction data the crystal structures of the monohydrates of lithium chloride and lithium bromide were solved. Both compounds crystallise isotypic in the space group Cmcm (LiCl·H₂O: single crystal analysis; T = 100 K; a = 758, 35(2); b = 768, 07(2); c = 762, 35(2) pm; Z = 8; 1179 unique reflections; R₁ = 0, 0196. LiBr·H₂O: Rietveld‐refinement; T = 220 K; a = 806, 15(1); b = 799, 44(1) und c = 794, 61(1) pm; Z = 8; 157 unique reflections; R_p = 0, 0922; R_wp = 0, 0979; R_exp = 0, 0657). The structure derives from the perowskite structure according to the formula X(H₂O)Li□₂ (X = Cl, Br). The orientation of the water molecules is linked clearly to the distribution of the lithium cations and vice versa. The high level ionic conductivity in the cubic high temperature phase of LiBr·H₂O is related to the initial rotation of the water molecules during the phase transformation. This motion favours the lithium ion hopping and the melting of the lithium substructure respectively.     

Automated Raman Spectroscopy as a Tool for the High‐Throughput Characterization of Molecular Structure and Mechanical Properties of Polyethylenes

Raman spectroscopy, which does not require a time‐consuming sample preparation, is described as an analytical tool for the high‐throughput characterization of polyethylenes. The content of comonomer and the amount of methyl groups per 1 000 carbon atoms of polyethylenes can be predicted from Raman spectra using multivariate data analysis. In addition, macroscopic properties, such as density and elastic modulus as well as yield stress, can be derived from Raman spectra.

Raman spectra of selected metallocene‐catalyzed polyethylenes of different comonomer content.