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1.
Wacker oxidation is an industry-adopted process to transform olefins into value-added epoxides and carbonyls. However, traditional Wacker oxidation involves the use of homogeneous palladium and copper catalysts for the olefin addition and reductive elimination. Here, we demonstrated an ultrahigh loading Cu single atom catalyst(14% Cu, mass fraction) for the palladium-free Wacker oxidation of 4-vinylanisole into the corresponding ketone with N-methylhydroxylamine hydrochloride as an additive under mild conditions. Mechanistic studies by 18O and deuterium isotope labelling revealed a hydrogen shift mechanism in this palladium-free process using N-methylhydroxylamine hydrochloride as the oxygen source. The reaction scope can be further extended to Kucherov oxidation. Our study paves the way to replace noble metal catalysts in the traditional homogeneous processes with single atom catalysts. 相似文献
2.
利用分子动力学方法模拟计算了单晶铜中纳米孔洞在沿〈111〉晶向冲击加载下增长的早期过程.测量发现不同加载强度下等效孔洞半径随时间近似成线性变化.观测到单孔洞增长的两种位错生长机理:加载强度较低时,只在沿着冲击加载方向的孔洞顶点附近区域有位错的成核和运动;而随着加载强度超过一定阈值,在沿冲击加载和其垂直方向的孔洞顶点区域都观察到位错的成核和运动.在前一种机理作用下,孔洞只沿加载方向增长;在后一种机理作用下,孔洞同时沿加载和垂直于加载方向增长.分析孔洞表面原子的位移历史,发现沿加载及与其垂直方向的孔洞顶点沿径向的速度基本恒定,由此提出了一个孔洞生长模型,可以解释孔洞增长的线性生长规律.
关键词:
纳米孔洞
分子动力学
冲击加载
位错 相似文献
3.
4.
Kurt Majewski 《Queueing Systems》2005,50(2-3):199-230
We consider multiclass feedforward queueing networks under first in first out and priority service disciplines driven by long-range dependent arrival and service time processes. We show that in critical loading the normalized workload, queue length and sojourn time processes can converge to a multi-dimensional reflected fractional Brownian motion. This weak heavy traffic approximation is deduced from a deterministic pathwise approximation of the network behavior close to constant critical load in terms of the solution of a Skorokhod problem. Since we model the doubly infinite time interval, our results directly cover the stationary case.AMS subject classification: primary 90B15, secondary 60K25, 68M20 相似文献
5.
In this paper we describe the design and manufacture of an axial-torsion test specimen, and provide relationships needed when
conducting stress-strain characterization experiments with the specimen. The specimen is a short hollow cylinder of rubber
bonded between two steel mounting rings, in which simultaneous axial and shear strains are produced via independently controlled
axial and twist displacements. We present calculations for the strain-displacement and stress-load relationships, and strain
energy density. These relationships have been established and validated via a combination of analytical and experimental techniques,
and finite element analysis. We have investigated the extent and effects of strain and stress field non-uniformity in the
test specimen. The specimen design is sufficiently simple that a closed-form expression for the strain-displacement relationship
has been successfully developed. 相似文献
6.
New Exact Solutions to the Combined KdV and mKdV Equation 总被引:2,自引:0,他引:2
Yan-ze Peng 《International Journal of Theoretical Physics》2003,42(4):863-868
The modified mapping method is developed to obtain new exact solutions to the combined KdV and mKdV equation. The method is applicable to a large variety of nonlinear evolution equations, as long as odd- and even-order derivative terms do not coexist in the equation under consideration. 相似文献
7.
应用电磁线路中涨落耗散理论,推导了不同温度均匀二半空间接触后产生辐射场密度的公式。将此公式近似展开后,即得Grover和Urtiew所获得的表示式,不过多了一松弛项,该项如用非富里叶热传导理论推导,也是存在的。该结果和实验结果一致,不过这里的松驰时间可以应用介质性质进行计算。 相似文献
8.
应用等效原理,通过引入口面上等效磁流将含腔导电目标电磁散射简化为腔内、外两个等效 问题. 腔内问题分段求解并应用级联法获得口面等效导纳矩阵;腔内外的耦合关系应用近似 边界元方法描述并由此获得口面等效磁流;最后,这一具有混合源的腔体内外一体化散射问 题则应用所提出的广义混合场积分方程方法建立电磁模型,并用多层快速多极子方法实现高 效数值求解. 实例计算结果与测试结果具有很好的一致性.
关键词:
含腔目标
电磁散射
混合场积分方程
数值分析 相似文献
9.
10.
Parking Capacity and Pricing in Park'n Ride Trips: A Continuous Equilibrium Network Design Problem 总被引:2,自引:0,他引:2
In this paper we consider the problem of designing parking facilities for park'n ride trips. We present a new continuous equilibrium network design problem to decide the capacity and fare of these parking lots at a tactical level. We assume that the parking facilities have already been located and other topological decisions have already been taken.The modeling approach proposed is mathematical programming with equilibrium constraints. In the outer optimization problem, a central Authority evaluates the performance of the transport network for each network design decision. In the inner problem a multimodal traffic assignment with combined modes, formulated as a variational inequality problem, generates the share demand for modes of transportation, and for parking facilities as a function of the design variables of the parking lots. The objective is to make optimal parking investment and pricing decisions in order to minimize the total travel cost in a subnetwork of the multimodal transportation system.We present a new development in model formulation based on the use of generalized parking link cost as a design variable.The bilevel model is solved by a simulated annealing algorithm applied to the continuous and non-negative design decision variables. Numerical tests are reported in order to illustrate the use of the model, and the ability of the approach to solve applications of moderate size. 相似文献