A combining rule calculation of the ground-state van der Waals potentials of the magnesium rare-gas complexes

The potential energy curves and spectroscopic constants of the ground-state of the Mg–Rg (Rg = He, Ne, Ar, Kr, and Xe) van der Waals complexes are generated by the Tang–Toennies potential model and a set of derived combining rules. The parameters of the model are calculated from the potentials of the homonuclear magnesium and rare-gas dimers. The predicted spectroscopic constants are comparable to other available theoretical and experimental results, except in the case of Mg–He, we note that there are large differences between various determinations. Moreover, in order to reveal relative differences between species more obviously we calculated the reduced potential of these five systems. The curves are clumped closely together, but at intermediate range the Mg–He reduced potential is clearly very different from the others.     

嵌入式PC／104主板在惯性导航系统中的应用

提出了用嵌入式PC／104主板为核心的新型结构对原有系统进行改造,在提高系统性能的同时确保与原有接口的兼容,使原有系统软件以最小的代价移植到新的系统中。详细叙述了改造中的关键技术及具体实现方法,并对系统的应用技术提出展望。     

Development of an impedimetric sensor based on carbon dots and chitosan nanocomposite modified electrode for Cu(II) detection in water

Journal of Solid State Electrochemistry - The fast and sensitive detection of copper ions would be essential for water monitoring. Herein, we report a novel development of an impedimetric sensor...     

A novel and efficient method for the synthesis of α-aminonitriles by the reaction of aminals with trimethylsilyl cyanide catalyzed by iodine

Iodine, was found to be a practical and novel catalyst for the reaction of aminal and trimethylsilyl cyanide under mild and neutral reaction condition to afford the corresponding α-aminonitriles in high yields and short reaction times. Trimethylsilyl iodide derived in situ from elemental iodine and trimethylsillyl cyanide catalyzed this conversion.     

First-Principles Study on the Ferromagnetism of Mn-Doped LiZnAs Half-Heusler Compound

Physics of the Solid State - We have investigated the magnetic properties of Mn-doped LiZnAs half-Heusler compound using density functional simulations within the gradient generalized approximation...     

Investigation of density ratio effects on normally injected cold jets into a hot cross flow

In this work, hydrodynamic effects of multiple squared cross-section cold jets inclined normally into a hot cross flow were computationally simulated using large eddy simulation (LES) approach. The finite volume method and the SIMPLE algorithm on a multi-block non-uniform staggered grid were applied. The jet into cross flow velocity ratio and the jet Reynolds number were 0.5 and 4,700, respectively. Simulations were performed for three different jets into cross flow temperature ratios, namely, 2, 1, and 0.5, corresponding to density ratios of 0.5, 1, and 2. The experimental and numerical results of Ajersch et al. (J. Turbomachinery 119(2), 330–342, 1997) at unit density ratio were used for validation purposes. The density ratio effects on the flow characteristics were investigated. It was shown that the density ratio has significant effects on the hydrodynamics of the jet into cross flow problems and even though the flow Mach number may be low, its effects due to temperature differences between the jet and the cross flow cannot be easily ignored.     

Combined methane reforming over nano LaNiO<Subscript>3</Subscript> catalyst with modified active surface

In this study, nano catalyst LaNiO₃ with perovskite structure was synthesized using the citrate sol–gel method in the combined methane reforming with CO₂ and O₂ (CRM). The effects of increasing the surface area of the LaNiO₃ perovskite on the catalytic activity were investigated by changing the method of preparing and creating holes in the surface of the samples. Physical and chemical properties of the samples, before and after the reactor test, were determined through ICP, AA, XRD, TGA, TPR, BET, SEM, EDX and TEM techniques. The results of XRD, ICP, AA, SEM, EDX and TEM tests indicated that the citrate sol–gel method is a good way to prepare a homogeneous perovskite LaNiO₃ sample on a scale of nanometers. The results of the TPR test showed using etching in the citrate sol–gel method can produce samples with high stability. The BET results indicated that the surface area of the LaNiO₃ sample tripled with the method suggested in this paper. Changes in preparation method lead to induction time decreasing and temperature increasing. Use of etching in the citrate sol gel method had no significant effect in the results of activity tests versus time reaction at a temperature of 800 °C. TGA curves revealed no production of coke over the process for the produced samples.     

Facile synthesis of 2,2,2-trifluoroacetimidoyl chloride derivatives

Several 2,2,2-trifluoroacetimidoyl chlorides have been prepared in a one-pot stage from primary aromatic amines and trifluoroacetic acid. The reactions were carried out with different primary aromatic amines which they contain additional functional groups and good yield were obtained.     

Les systemes binaires AlPO4−M3PO4 (M=Li,Na, K)

The liquid-solid phase diagram of the binary systems AlPO₄?M₃PO₄(M=Li, Na, K) have been established. The additional compounds Na₃Al(PO₄)₂, Na₃Al₂(PO₄)₃ and K₃Al₂(PO₄)₃ have been found again. A new compound K₃Al(PO₄)₂ is observed. The melting point of Na₃PO₄ is 1545°C and K₃PO₄ does not melt up to 1700°C.