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21.
22.
We employ a first-principles plane wave method with the
relativistic analytic pseudopotential of Hartwigsen, Goedecker and Hutter
(HGH) scheme in the frame of DFT to calculate
the equilibrium lattice parameters and the thermodynamic properties of
AlB2 compound with hcp structure. The obtained lattice parameters are in
good agreement with the available experimental data and those calculated by
others. Through the quasi-harmonic Debye model, obtained successfully are
the dependences of the
normalized lattice parameters a/a0 and c/c0 on pressure P, the normalized
primitive cell volume V/V0 on pressure P, the variation of the thermal
expansion α with pressure P and temperature T, as well as the Debye
temperature \ThetaD and the heat capacity CV on pressure P and
temperature T. 相似文献
23.
Gang Wang Xiulin Zhu Zhenping Cheng Jian Zhu 《Journal of polymer science. Part A, Polymer chemistry》2006,44(9):2912-2921
A series of (di)picolinic acids and their derivates are investigated as novel complexing tridentate or bidentate ligands in the iron‐mediated reverse atom transfer radical polymerization of methyl methacrylate in N,N‐dimethylformamide at 100 °C with 2,2′‐azobisisobutyrontrile as an initiator. The polymerization rates and polydispersity indices (1.32–1.8) of the resulting polymers are dependent on the structures of the ligands employed. Different iron complexes may be involved in iron‐mediated reverse atom transfer radical polymerization, depending on the type of acid used. 1H NMR spectroscopy has been used to study the structure of the resulting polymers. Chain‐extension reactions have been performed to further confirm the living nature of this catalytic system. © 2006 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 44: 2912–2921, 2006 相似文献
24.
A FUNDAMENTAL SOLUTION FOR THE LAPLACE OPERATOR ON THE QUATERNIONIC HEISENBERG GROUP 总被引:2,自引:0,他引:2
朱理 《数学物理学报(B辑英文版)》2002,22(3)
In this paper, the author studies the Laplace operator on the quaternionic Heisenberg group, construct a fundamental solution for it and use this solution to prove the Lp-boundedness and the weak (1-1) boundedness of certain singular convolution operators on the quaternionic Heisenberg group. 相似文献
25.
In this work, the natural convection in a concentric annulus between a cold outer square cylinder and a heated inner circular cylinder is simulated using the differential quadrature (DQ) method. The vorticity‐stream function formulation is used as the governing equation, and the coordinate transformation technique is introduced in the DQ computation. It is shown in this paper that the outer square boundary can be approximated by a super elliptic function. As a result, the coordinate transformation from the physical domain to the computational domain is set up by an analytical expression, and all the geometrical parameters can be computed exactly. Numerical results for Rayleigh numbers range from 104 to 106 and aspect ratios between 1.67 and 5.0 are presented, which are in a good agreement with available data in the literature. It is found that both the aspect ratio and the Rayleigh number are critical to the patterns of flow and thermal fields. The present study suggests that a critical aspect ratio may exist at high Rayleigh number to distinguish the flow and thermal patterns. Copyright © 2002 John Wiley & Sons, Ltd. 相似文献
26.
27.
It is widely accepted that next-generation networks will provide guaranteed services, in contrast to the “best effort” approach today. We study and analyze queueing policies for network switches that support the QoS (Quality of Service) feature. One realization of the QoS feature is that packets are not necessarily all equal, with some having higher priorities than the others. We model this situation by assigning an intrinsic value to each packet. In this paper we are concerned with three different queueing policies: the nonpreemptive model, the FIFO preemptive model, and the bounded delay model. We concentrate on the situation where the incoming traffic overloads the queue, resulting in packet loss. The objective is to maximize the total value of packets transmitted by the queueing policy. The difficulty lies in the unpredictable nature of the future packet arrivals. We analyze the performance of the online queueing policies via competitive analysis, providing upper and lower bounds for the competitive ratios. We develop practical yet sophisticated online algorithms (queueing policies) for the three queueing models. The algorithms in many cases have provably optimal worst-case bounds. For the nonpreemptive model, we devise an optimal online algorithm for the common 2-value model. We provide a tight logarithmic bound for the general nonpreemptive model. For the FIFO preemptive model, we improve the general lower bound to 1.414, while showing a tight bound of 1.434 for the special case of queue size 2. We prove that the bounded delay model with uniform delay 2 is equivalent to a modified FIFO preemptive model with queue size 2. We then give improved upper and lower bounds on the 2-uniform bounded delay model. We also show an improved lower bound of 1.618 for the 2-variable bounded delay model, matching the previously known upper bound. 相似文献
28.
Xuding Zhu 《Journal of Graph Theory》2005,48(3):186-209
For 1 ≤ d ≤ k, let Kk/d be the graph with vertices 0, 1, …, k ? 1, in which i ~j if d ≤ |i ? j| ≤ k ? d. The circular chromatic number χc(G) of a graph G is the minimum of those k/d for which G admits a homomorphism to Kk/d. The circular clique number ωc(G) of G is the maximum of those k/d for which Kk/d admits a homomorphism to G. A graph G is circular perfect if for every induced subgraph H of G, we have χc(H) = ωc(H). In this paper, we prove that if G is circular perfect then for every vertex x of G, NG[x] is a perfect graph. Conversely, we prove that if for every vertex x of G, NG[x] is a perfect graph and G ? N[x] is a bipartite graph with no induced P5 (the path with five vertices), then G is a circular perfect graph. In a companion paper, we apply the main result of this paper to prove an analog of Haj?os theorem for circular chromatic number for k/d ≥ 3. Namely, we shall design a few graph operations and prove that for any k/d ≥ 3, starting from the graph Kk/d, one can construct all graphs of circular chromatic number at least k/d by repeatedly applying these graph operations. © 2005 Wiley Periodicals, Inc. J Graph Theory 48: 186–209, 2005 相似文献
29.
For an arbitrary bounded closed set E in the complex plane with complement Ω of finite connectivity, we study the degree of convergence of the lemniscates in Ω. 相似文献
30.
5-Perfluorophenyl 4,5-dihydro-1H-pyrazoles were synthesized from 1,3-dipolar cycloaddition reaction of perfluorobenyl 2,4,6-triisopropylbenzenesulfonylhydrazone and α,β-unsaturated carbonyl compounds or acrylonitrile in THF or water. It was worthy to note that better results were obtained when water was employed as the solvent, which was considered as an effective, economic and environmentally friendly method to synthesize these pyrazole derivatives. 相似文献