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1.
Lyu  Pin  Vong  Seakweng 《Numerical Algorithms》2021,87(1):381-408
Numerical Algorithms - In this paper, we study a fast linearized numerical method for solving nonlinear time-fractional diffusion equations. A new weighted method is proposed to construct...  相似文献   
2.
The mechanisms of CO2 coupling with the propargylic alcohol using alkali carbonates M2CO3 (M = Li, Na, K, Cs) have been investigated by means of density functional theory calculations. The calculations reveal that the target product tetronic acid (TA) is yielded through two stages: (a) the formation of the α-alkylidene cyclic carbonate (αACC) intermediate via Cs2CO3-mediated carboxylative cyclization of the propargylic alcohol with CO2, and (b) the conversion of the αACC intermediate with Cs2CO3 to produce the cesium salt of the TA. Since the overall kinetic barriers for the two stages are comparable and affordable, the excellent chemoselectivity to the TA should be primarily originated from the high thermodynamic stability of the cesium salt of the TA. Moreover, relative to the TA, the possibility to yield the by-product acyclic carbonate can be excluded due to the both kinetics and thermodynamic inferiority. This result is different from the organic base-mediated reaction. Alternatively, our calculations predict that CsHCO3 together generated with the cesium salt of the TA might also be an available mediating reagent for the incorporation of CO2 with the propargylic alcohol. Compared to other alkali carbonates M2CO3 (M = Li, Na, K), the stronger basicity of Cs2CO3 and the lower ionic potential of cesium ion can raise the effective concentration of the αACC intermediate, and thus the conversion of the αACC intermediate into the cesium salt of the TA can be achieved with high yield.  相似文献   
3.
Paul阱内的压缩效应与量子跃迁   总被引:1,自引:1,他引:0  
处理一个一维Paul阱系统中的压缩现象与量子跃迁现象,对于阱内的最强压缩态和共振跃迁(一种极不稳定状态)之间的关系作了阐述,并对利用压缩性质在阱内进行精密测量的可能性作了讨论  相似文献   
4.
This paper is to investigate the approximate confidence limits of the reliability performances (such as failure rate, reliability function and average life) for a cold standby series system. The Bayesian approximate upper confidence limit of failure rate is obtained firstly, and next Bayesian approximate lower confidence limits for reliability function and average life are presented. The expressions for calculating Bayesian lower confidence limits of the reliability function and average life are also obtained, and an illustrative example is examined numerically by means of the Monte-Carlo simulation. Finally, the accuracy of confidence limits is discussed.  相似文献   
5.
一类拟线性大系统的稳定性   总被引:1,自引:0,他引:1  
本文应用大系统的分解方法和一个推广的不等式,研究了一类拟线性大系统的稳定性问题,所得结果简洁、易于验证,且推导过程不复杂,最后给出了应用实例。  相似文献   
6.
Hyperfine Interactions - Perovskite-related phases of the type LaFe1?x Co x O3 (x=0 and 0.5) have been synthesised by milling techniques. The materials are of smaller particle size and more...  相似文献   
7.
In this study, the viscoelastic phase separation process was studied further by time‐resolved light scattering, differential scanning calorimetry, and scanning electron microscopy in the system of poly(ether imide)‐modified bisphenol‐A dicyanate. It was observed that the evolution time of phase structure and relaxation time of diffusion flow of the bisphenol‐A dicyanate were similar with the phase diagram of curing conversion versus content of PEI. The results suggested that the viscoelastic phase separation was affected by the curing conversion of the system at the onset point of phase separation. © 2005 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys 44: 517–523, 2006  相似文献   
8.
本文报道综合利用长叶烯(1)催化异构化为异长叶烯(2)及合成系列香料的方法;通过氧化反应合成不同香型烯醇酯类等;Prins反应合成系列化合物。鉴定了10种香料化合物的香型。  相似文献   
9.
A series of symmetrical and asymmetrical microfluidic T-sensors with different inlet angles were fabricated to study the mixing characteristics of a T-type microstructure for generating concentration gradient. Computational fluid dynamics (CFD) simulations showed that the concentration gradient, transition zone and diffusion length were different for various configurations and inlet angles. Quick mix and sharp concentration gradient occurred in the asymmetrical structure with large inlet angle. The observed concentration gradients in the fabricated microchannel were consistent with the theoretical prediction. In this microstructure, stagnant zone and z-direction diffusion also affected the concentration gradient. Based on the simulation results, the microfluidic structure was optimized to generate desired concentration gradient for a cell-based study.  相似文献   
10.
An intramolecular 1,3-dipolar cycloaddition of azomethine ylide, generated in situ via the reaction of C12-glycinate derivative of macrolide with formaldehyde, provided a novel tricyclic macrolide. The high stereoselectivity of this [2+3] reaction was achieved by introducing a suitable directing group at C-6 position of macrolide.  相似文献   
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