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71.
Suvi T.M. Simila 《Tetrahedron letters》2006,47(17):2933-2936
A concise synthesis of the azatricyclic core structure of FR901483, a potent immunosuppressant, has been accomplished. The key elements of the approach involve a nucleophilic addition to an acyl iminium ion, a ring closing metathesis and a lactone-lactam rearrangement to provide the tricyclic structure. 相似文献
72.
We study GaN/AlN Quantum Dot (QD) superlattices utilizing the STREL environment which allows the building of atomistic models, relaxation of the structures, the calculation of the electronic states and optical transitions and the visualization of the results. The forces are calculated using an appropriate Keating or Stillinger–Weber interatomic potential model and the electronic states and optical transitions using a tight-binding formulation which is economical and produces realistic electronic properties. The relaxed structure has strains mainly in the GaN region which are compressive and small tensile strains in the AlN region, mainly below the QD. In the calculation of the electronic states and of the optical transitions the strains are included realistically at the atomistic level. The study of the wavefunctions close to the fundamental gap show how these strains influence the form and spatial extent of the wavefunction. Very close to the fundamental gap the valence and some conduction states are confined in the QD and have considerable oscillator strength. 相似文献
73.
Arne Barinka Stephan Dahlke Wolfgang Dahmen 《Advances in Computational Mathematics》2006,24(1-4):5-34
Recently adaptive wavelet methods have been developed which can be shown to exhibit an asymptotically optimal accuracy/work
balance for a wide class of variational problems including classical elliptic boundary value problems, boundary integral equations
as well as certain classes of noncoercive problems such as saddle point problems. A core ingredient of these schemes is the
approximate application of the involved operators in standard wavelet representation. Optimal computational complexity could
be shown under the assumption that the entries in properly compressed standard representations are known or computable in
average at unit cost. In this paper we propose concrete computational strategies and show under which circumstances this assumption
is justified in the context of elliptic boundary value problems.
Dedicated to Charles A. Micchelli on the occasion of his 60th birthday
Mathematics subject classifications (2000) 41A25, 41A46, 65F99, 65N12, 65N55.
This work has been supported in part by the Deutsche Forschungsgemeinschaft SFB 401, the first and third author are supported
in part by the European Community's Human Potential Programme under contract HPRN-CT-202-00286 (BREAKING COMPLEXITY). The
second author acknowledges the financial support provided through the European Union's Human Potential Programme, under contract
HPRN-CT-2002-00285 (HASSIP) and through DFG grant DA 360/4–1. 相似文献
74.
载能离子穿过固体界面引起界面原子迁移使界面原子混合和物质成分变化,从而导致界面发生材料相变。简要介绍了载能离子辐照引起金属/绝缘体界面混合效应及相变现象的主要实验研究进展、低能离子和高能离子辐照引起金属/绝缘体界面现象差异,并对离子辐照引起界面混合及相变的机制进行了初步探讨。When penetrating an interface between two kind of solids, energetic ions can induce atomic diffusion at both sides of the interface and then result in intermixing, atom re-distribution or composition change, as well as phase transformation. Main progress on the study of intermixing and phase change at metal/insulator interface induced by energetic ion irradiations, the difference of phenomena occurred at metal/insulator interfaces induced by high-and low-energy ions were briefly reviewed. Furthermore, the possible mechanisms related to intermixing and phase change at metal/insulator interface produced by energetic ion irradiations were also discussed in short words. 相似文献
75.
Asha K. Nadipuram 《Tetrahedron letters》2006,47(3):353-356
The thermolysis of 1,2-dialkynylimidazoles in benzene solution affords high yields of 7-phenyl-5H-cyclopentapyrazines, which presumably form by solvent trapping of cyclopentapyrazine carbene intermediates. In cases where dialkynylimidazole contains side chains that can participate in intramolecular carbene C-H insertion or olefin addition, these processes compete with solvent addition to afford novel tri- and tetracyclic pyrazines, which can be obtained in good yield when the thermolysis is carried out in hexafluorobenzene. 相似文献
76.
Wei‐Ling Wang Jian‐Wei Xu Yee‐Hing Lai 《Journal of polymer science. Part A, Polymer chemistry》2006,44(13):4154-4164
Bipyridinophane–fluorene conjugated copolymers have been synthesized via Suzuki and Heck coupling reactions from 5,8‐dibromo‐2,11‐dithia[3]paracyclo[3](4,4′)‐2,2′‐bipyridinophane and suitable fluorene precursors. Poly[2,7‐(9,9‐dihexylfluorene)‐co‐alt‐5,8‐(2,11‐dithia[3]paracyclo[3](4,4′)‐2,2′‐bipyridinophane)] ( P7 ) exhibits large absorption and emission redshifts of 20 and 34 nm, respectively, with respect to its planar reference polymer Poly[2,7‐(9,9‐dihexylfluorene)‐co‐alt‐1,4‐(2,5‐dimethylbenzene)] ( P11 ), which bears the same polymer backbone as P7 . These spectral shifts originate from intramolecular aromatic C? H/π interactions, which are evidenced by ultraviolet–visible and 1H NMR spectra as well as X‐ray single‐crystal structural analysis. However, the effect of the intramolecular aromatic C? H/π interactions on the spectral shift in poly[9,9‐dihexylfluorene‐2,7‐yleneethynylene‐co‐alt‐5,8‐(2,11‐dithia[3]paracyclo[3](4,4′)‐2,2′‐bipyridinophane)] ( P10 ) is much weaker. Most interestingly, the quenching behaviors of these two conjugated polymers are largely dependent on the polymer backbone. For example, the fluorescence of P7 is efficiently quenched by Cu2+, Co2+, Ni2+, Zn2+, Mn2+, and Ag+ ions. In contrast, only Cu2+, Co2+, and Ni2+ ions can partially quench the fluorescence of P10 , but much less efficiently than the fluorescence of P7 . The static Stern–Volmer quenching constants of Cu2+, Co2+, and Ni2+ ions toward P7 are of the order of 106 M?1, being 1300, 2500, and 37,300 times larger than those of P10 , respectively. © 2006 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 44: 4154–4164, 2006 相似文献
77.
78.
Extension of a combined analytical/numerical initial value problem solver for unsteady periodic flow
Here we describe analytical and numerical modifications that extend the Differential Reduced Ejector/ mixer Analysis (DREA), a combined analytical/numerical, multiple species ejector/mixing code developed for preliminary design applications, to apply to periodic unsteady flow. An unsteady periodic flow modelling capability opens a range of pertinent simulation problems including pulse detonation engines (PDE), internal combustion engine ICE applications, mixing enhancement and more fundamental fluid dynamic unsteadiness, e.g. fan instability/vortex shedding problems. Although mapping between steady and periodic forms for a scalar equation is a classical problem in applied mathematics, we will show that extension to systems of equations and, moreover, problems with complex initial conditions are more challenging. Additionally, the inherent large gradient initial condition singularities that are characteristic of mixing flows and that have greatly influenced the DREA code formulation, place considerable limitations on the use of numerical solution methods. Fortunately, using the combined analytical–numerical form of the DREA formulation, a successful formulation is developed and described. Comparison of this method with experimental measurements for jet flows with excitation shows reasonable agreement with the simulation. Other flow fields are presented to demonstrate the capabilities of the model. As such, we demonstrate that unsteady periodic effects can be included within the simple, efficient, coarse grid DREA implementation that has been the original intent of the DREA development effort, namely, to provide a viable tool where more complex and expensive models are inappropriate. Copyright © 2002 John Wiley & Sons, Ltd. 相似文献
79.
Bin Han 《Advances in Computational Mathematics》2006,24(1-4):375-403
In this paper, we present a necessary and sufficient condition for the existence of solutions in a Sobolev space Wpk(ℝs) (1≤p≤∞) to a vector refinement equation with a general dilation matrix. The criterion is constructive and can be implemented.
Rate of convergence of vector cascade algorithms in a Sobolev space Wpk(ℝs) will be investigated. When the dilation matrix is isotropic, a characterization will be given for the Lp (1≤p≤∞) critical smoothness exponent of a refinable function vector without the assumption of stability on the refinable function
vector. As a consequence, we show that if a compactly supported function vector φ∈Lp(ℝs) (φ∈C(ℝs) when p=∞) satisfies a refinement equation with a finitely supported matrix mask, then all the components of φ must belong to a Lipschitz
space Lip(ν,Lp(ℝs)) for some ν>0. This paper generalizes the results in R.Q. Jia, K.S. Lau and D.X. Zhou (J. Fourier Anal. Appl. 7 (2001) 143–167)
in the univariate setting to the multivariate setting.
Dedicated to Professor Charles A. Micchelli on the occasion of his 60th birthday
Mathematics subject classifications (2000) 42C20, 41A25, 39B12.
Research was supported in part by the Natural Sciences and Engineering Research Council of Canada (NSERC Canada) under Grant
G121210654. 相似文献
80.
This paper is based on the M. Sc. thesis written by the third author under the supervision of the first two authors. It was submitted to the University of Baghdad in 1986. 相似文献