Chemical Reactions and Kinetics of the Carbon Monoxide Coupling in the Presence of

The chemical reactions and kinetics of the catalytic coupling reaction of carbon monoxide to diethyl oxalate were studied in the presence of hydrogen over a supported palladium catalyst in the gaseous phase at the typical coupling reaction conditions. The experiments were performed in a continuous flow fixed-bed reactor. The results indicated that hydrogen only reacts with ethyl nitrite to form ethanol, and kinetic studies revealed that the rate-determining step is the surface reaction of adsorbed hydrogen and the ethoxy radical (EtO-). A kinetic model is proposed and a comparison of the observed and calculated conversions showed that the rate expressions are of rather high confidence.     

Epoxide networks as model networks

Summary The equilibrium mechanical behaviour of weak diepoxide-monoepoxide-diamine networks, prepared with an excess of diamine and measured in the rubbery state, was compared with theoretical predictions obtained by using the theory of branching processes. The experimental equilibrium moduli fit well the shape of theoretical curves over a broad range of crosslinking density regardless of whether the contribution by trapped entanglements is considered or not. The data fit equally well the theoretical dependence for the front factor A = 1 without entanglement contribution and forA = (f _e - 2)/f _e , (f _e is the average effective functionality of a junction) with an entanglement contribution based on the contact probability between any two units within elastically active network chains (Langley).Dedicated to Prof. Dr.G. Rehage on the occasion of his 60th birthday.With 5 figures     

Michael additions of benzoins versus Michael-Stetter additions of aldehydes

Triethylamine catalyzed Michael additions of benzoins to chalcone can prevail over the expected Michael-Stetter additions when certain thiazolium ion conjugate bases - prepared $\text{in situ}$ from the pertinent thiazolium salts and triethylamine- are used as catalysts.     

Quark-diagram estimates ofCP violation in two-body baryonicB_d^0 - \bar B_d^0 decays

CP violation in partial-decay-rate asymmetries are examined for some two-body baryonic decays of \(B_d^0 - \bar B_d^0 \) system. We discuss two feasible experimental circumstances: the symmetrice ⁺ e ^? collisions (i) on theZ ⁰ resonance to produce incoherent \(B_d^0 \bar B_d^0 \) states, and (ii) just above the ?(4S) resonance to produceC=even \(B_d^0 \bar B_d^0 \) states. Using the quark-diagram scheme, we estimate the branching ratios of those decays, and the numbers ofb \(\bar b\) pairs needed for testing theCP-violating effects for 3σ signature. We find that the promising channels may beB _d ⁰ , \(\bar B_d^0 \to p\bar p\) , \(\Delta ^ + \bar \Delta ^ - \) , \(p\bar \Delta ^ - \) , \(\Delta ^ + \bar p\) , \(n\bar n\) , \(\Delta ^0 \bar \Delta ^0 \) , \(n\bar \Delta ^0 \) , \(\Delta ^0 \bar n\) , \(\Sigma _c^ + \bar \Sigma _c^ - \) , \(\Lambda _c^ + \bar \Lambda _c^ - \) , \(\Sigma _c^ + \bar \Lambda _c^ - \) , \(\Lambda _c^ + \bar \Sigma _c^ - \) , \(\Sigma _c^0 \bar \Sigma _c^0 \) , \(\Xi _c^0 \bar \Xi _c^0 \) , which should be interesting for experimental observation.     

Two singular integrals containing a partial wave of the two-body coulomb T-matrix

The operatorsT _C,l E+i0)[–G ₀(E+i0)]^1–i andT _C,l(E+i)G ₀[–iG ₀(E+i)]ⁱ acting on spaces of Hölder continuous, differentiable and analytic functions are investigated. The results of their action are expressed in terms of explicit singular factors and terms and Hölder (differentiable, analytic) functions. The most singular part of these operators is shown to be determined by a simple functional.     

Highly regioselective construction of spirocycles via phosphine-catalyzed [3 + 2]-cycloaddition

A direct entry to spirocycles with low to moderate regioselectivity was achieved by triphenylphosphine-catalyzed [3 + 2]-cycloaddition of active exo-methylenecycles (1) and ethyl 2,3-butadienoate (2). The regioselectivity of the reaction was greatly improved by using the bulky tert-butyl ester of the 2,3-butadienoate (5). The regioselectivity of the reaction was further enhanced by using the tert-butyl 2-butynoate as the substrate. This protocol provided an efficient entry to the skeleton of spirocarbocycles, especially spiro[4.n]alkanes.     

Analytic expressions for the partial waves of the off-shell two body coulomb T-matrix

Closed form expressions for all partial waves of the pure Coulomb off-shell T-matrix p¦ T_c,l.(k ²) ¦p are obtained. All singularities appear through simple special functions, which makes it possible to study the analytic properties of p¦ T_c,l(k²) ¦p as a function not only of one of the momentap, p but even of both of them. With use of the renormalization procedure found by Zorbas the transition to half-and on-shell values is performed reproducing known expressions. By the same method simple expressions for the partial waves of the Coulomb wave function in the momentum representation are found.     

微区X射线荧光光谱成像法分析历史文物建筑混凝土材料成分及工艺

历史文物建筑修复与保护的首要步骤是对建材构件进行成分解析。但成型的混凝土构件成分复杂,传统技术难以直接分析。微区X射线荧光光谱具有速度快、无需前处理、可获得大面积高分辨的元素成像等优势,可用于此类混合物的原位分析。本文采用束斑为20μm的微区X射线荧光光谱仪,扫描成型混凝土构件以获得混合成分的元素分布图,结合基本参数定量法,对上海地区典型历史建筑混泥土构件进行元素定量。分析结果有效地解析了混凝土构建中骨料和凝胶材料的成分和含量,鉴别了涂层成分,解析了拌混工艺,鉴别了局部污染元素和致劣元素并分析致劣原因,为历史建筑修复材料选配、拌混工艺选择、除污及保护性预防劣化提供了科学的数据支撑。     

KEADA: Identifying Key Classes in Software Systems Using Dynamic Analysis and Entropy-Based Metrics

Software maintenance is indispensable in the software development process. Developers need to spend a lot of time and energy to understand the software when maintaining the software, which increases the difficulty of software maintenance. It is a feasible method to understand the software through the key classes of the software. Identifying the key classes of the software can help developers understand the software more quickly. Existing techniques on key class identification mainly use static analysis techniques to extract software structure information. Such structure information may contain redundant relationships that may not exist when the software runs and ignores the actual interaction times between classes. In this paper, we propose an approach based on dynamic analysis and entropy-based metrics to identify key classes in the Java GUI software system, called KEADA (identifying KEy clAsses based on Dynamic Analysis and entropy-based metrics). First, KEADA extracts software structure information by recording the calling relationship between classes during the software running process; such structure information takes into account the actual interaction of classes. Second, KEADA represents the structure information as a weighted directed network and further calculates the importance of each node using an entropy-based metric OSE (One-order Structural Entropy). Third, KEADA ranks classes in descending order according to their OSE values and selects a small number of classes as the key class candidates. In order to verify the effectiveness of our approach, we conducted experiments on three Java GUI software systems and compared them with seven state-of-the-art approaches. We used the Friedman test to evaluate all approaches, and the results demonstrate that our approach performs best in all software systems.