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71.
We demonstrate that backscatter data processed by the two-point method can provide spatial loss results in a form that allows the immediate interpretation of joint loss. Furthermore, all the joints in a typical repeater span can be compared from the same base line and a threshold level introduced for the rejection or acceptance of joints, a feature which facilitates field measurement. 相似文献
72.
We consider solutions of the scalar wave equation vanishing on the boundary of an obstacle which undergoes periodic motion. In analogy with the Lax-Phillips theory, we show that the scattering matrix, as a function of frequency, is holomorphic in a lower half-plane, and meromorphic in an upper half-plane, provided rays are not trapped. The poles of the scattering matrix correspond to certain outgoing eigenfunctions, and there is a near-field expansion of finite energy solutions in terms of these eigenfunctions. 相似文献
73.
Argent SP Adams H Riis-Johannessen T Jeffery JC Harding LP Clegg W Harrington RW Ward MD 《Dalton transactions (Cambridge, England : 2003)》2006,(42):4996-5013
The coordination chemistry of a series of di- and tri-nucleating ligands with Ag(I), Hg(I) and Hg(II) has been investigated. Most of the ligands contain two or three N,N'-bidentate chelating pyrazolyl-pyridine units pendant from a central aromatic spacer; one contains three binding sites (2 + 3 + 2-dentate) in a linear sequence. A series of thirteen complexes has been structurally characterised displaying a wide range of structural types. Bis-bidentate bridging ligands react with Ag(I) to give complexes in which Ag(I) is four-coordinate from two bidentate donors, but the complexes can take the form of one-dimensional coordination polymers, or dinuclear complexes (mesocate or helicate). A tris-bidentate triangular ligand forms a complicated two-dimensional coordination network with Ag(I) in which Ag...Ag contacts, as well as metal-ligand coordination bonds, play a significant role. Three dinuclear Hg(I) complexes were isolated which contain an {Hg2}2+ metal-metal bonded core bound to a single bis-bidentate ligand which can span both metal ions. Also characterised were a series of Hg(II) complexes comprising a simple mononuclear four-coordinate Hg(II) complex, a tetrahedral Hg(II)4 cage which incorporates a counter-ion in its central cavity, a trinuclear double helicate, and a trinuclear catenated structure in which two long ligands have spontaneously formed interlocked metallomacrocyclic rings thanks to cyclometallation of two of the Hg(II) centres. 相似文献
74.
Ludwig J Vlachos DG van Duin AC Goddard WA 《The journal of physical chemistry. B》2006,110(9):4274-4282
The dissociation of hydrogen on eight platinum surfaces, Pt(111), Pt(100), Pt(110), Pt(211), Pt(311), Pt(331), Pt(332), and Pt(533), has been studied using molecular dynamics and the reactive force field, ReaxFF. The force field, which includes the degrees of freedom of the atoms in the platinum substrate, was used unmodified with potential parameters determined from previous calculations performed on a training set exclusive of the surfaces considered in this work. The energetics of the eight surfaces in the absence of hydrogen at 0 K were first compared to previous density functional theory (DFT) calculations and found to underestimate excess surface energy. However, taking Pt(111) as a reference state, we found that the trend between surfaces was adequately predicted to justify a relative comparison between the various stepped surfaces. To assess the strengths and weaknesses of the force field, we performed detailed simulations on two stepped surfaces, Pt(533) and Pt(211), and compared our findings to published experimental and theoretical results. In general, the absolute magnitude of reaction rate predictions was low, a result of the force field's tendency to underpredict surface energy. However, when normalized, the simulations show the correct linear scaling with incident energy and angular dependence at collision energies where a direct dissociation mechanism is observed. Because ReaxFF includes all degrees of freedom in the substrate, we carried out simulations aimed at understanding surface-temperature effects on Pt(533). On the basis of the results on Pt(533)/Pt(211), we studied the reaction of hydrogen at normal incidence on all eight surfaces in a range of energies where we anticipated the force field to give reasonable qualitative trends. These results were subsequently fit to a simple linear model that predicts the enhanced reactivity of surfaces containing 111-type atomic steps versus 100-type atomic steps. This model provides a simple framework for predicting high-energy/high-temperature kinetics of complex surfaces not vicinal to Pt(111). 相似文献
75.
An efficient, enantioselective synthesis of a disubstituted bis-THF scaffold 5 is described, as well as an efficient differentiation of the 1,3-diol unit. [reaction: see text] 相似文献
76.
Fish C Green M Jeffery JC Kilby RJ Lynam JM McGrady JE Pantazis DA Russell CA Willans CE 《Chemical communications (Cambridge, England)》2006,(13):1375-1377
The cationic cages nido-[C2Bu(t)2P2E]+ (E = As, Sb), which are isolobal to the cyclopentadienyl cation, adopt square based pyramidal structures with the heavy pnictogen atom at the apex; NMR and computational methods have been used to probe the dynamic behaviour of the complexes. 相似文献
77.
Chung-Feng Jeffery Kuo Hung-Min Tu Shin-Wei Liang Wei-Lun Tsai 《Optics & Laser Technology》2010,42(6):945-955
This study used ultraviolet laser to perform the microcrystalline silicon thin film solar cell isolation scribing process, and applied the Taguchi method and an L18 orthogonal array to plan the experiment. The isolation scribing materials included ZnO:Al, AZO transparent conductive film with a thickness of 200 nm, microcrystalline silicon thin film at 38% crystallinity and of thickness of 500 nm, and the aluminum back contact layer with a thickness of 300 nm. The main objective was to ensure the success of isolation scribing. After laser scribing isolation, using the minimum scribing line width, the flattest trough bottom, and the minimum processing edge surface bumps as the quality characteristics, this study performed main effect analysis and applied the ANOVA (analysis of variance) theory of the Taguchi method to identify the single quality optimal parameter. It then employed the hierarchical structure of the AHP (analytic hierarchy process) theory to establish the positive contrast matrix. After consistency verification, global weight calculation, and priority sequencing, the optimal multi-attribute parameters were obtained. Finally, the experimental results were verified by a Taguchi confirmation experiment and confidence interval calculation. The minimum scribing line width of AZO (200 nm) was 45.6 μm, the minimum scribing line width of the microcrystalline silicon (at 38% crystallinity) was 50.63 μm and the minimum line width of the aluminum thin film (300 nm) was 30.96 μm. The confirmation experiment results were within the 95% confidence interval, verifying that using ultraviolet laser in the isolation scribing process for microcrystalline silicon thin film solar cell has high reproducibility. 相似文献
78.
Ranaweera K. R. Ranaweera Dimitra L. Capone Susan E. P. Bastian Daniel Cozzolino David W. Jeffery 《Molecules (Basel, Switzerland)》2021,26(14)
In a global context where trading of wines involves considerable economic value, the requirement to guarantee wine authenticity can never be underestimated. With the ever-increasing advancements in analytical platforms, research into spectroscopic methods is thriving as they offer a powerful tool for rapid wine authentication. In particular, spectroscopic techniques have been identified as a user-friendly and economical alternative to traditional analyses involving more complex instrumentation that may not readily be deployable in an industry setting. Chemometrics plays an indispensable role in the interpretation and modelling of spectral data and is frequently used in conjunction with spectroscopy for sample classification. Considering the variety of available techniques under the banner of spectroscopy, this review aims to provide an update on the most popular spectroscopic approaches and chemometric data analysis procedures that are applicable to wine authentication. 相似文献
79.
Xiaoshan Shayna Wang Peng‐Hsun Chase Chen J. Trae Hampton Jeffery M. Tharp Catrina A. Reed Sukant K. Das Duen‐Shian Wang Hamed S. Hayatshahi Yang Shen Jin Liu Wenshe Ray Liu 《Angewandte Chemie (Weinheim an der Bergstrasse, Germany)》2019,131(44):16051-16056
Superior to linear peptides in biological activities, cyclic peptides are considered to have great potential as therapeutic agents. To identify cyclic‐peptide ligands for therapeutic targets, phage‐displayed peptide libraries in which cyclization is achieved by the covalent conjugation of cysteines have been widely used. To resolve drawbacks related to cysteine conjugation, we have invented a phage‐display technique in which its displayed peptides are cyclized through a proximity‐driven Michael addition reaction between a cysteine and an amber‐codon‐encoded N?‐acryloyl‐lysine (AcrK). Using a randomized 6‐mer library in which peptides were cyclized at two ends through a cysteine–AcrK linker, we demonstrated the successful selection of potent ligands for TEV protease and HDAC8. All selected cyclic peptide ligands showed 4‐ to 6‐fold stronger affinity to their protein targets than their linear counterparts. We believe this approach will find broad applications in drug discovery. 相似文献
80.
The semiclassical modified nonlinear Schrödinger equation I: Modulation theory and spectral analysis
We study an integrable modification of the focusing nonlinear Schrödinger equation from the point of view of semiclassical asymptotics. In particular, (i) we establish several important consequences of the mixed-type limiting quasilinear system including the existence of maps that embed the limiting forms of both the focusing and defocusing nonlinear Schrödinger equations into the framework of a single limiting system for the modified equation, (ii) we obtain bounds for the location of the discrete spectrum for the associated spectral problem that are particularly suited to the semiclassical limit and that generalize known results for the spectrum of the nonselfadjoint Zakharov-Shabat spectral problem, and (iii) we present a multiparameter family of initial data for which we solve the associated spectral problem in terms of special functions for all values of the semiclassical scaling parameter. We view our results as part of a broader project to analyze the semiclassical limit of the modified nonlinear Schrödinger equation via the noncommutative steepest descent procedure of Deift and Zhou, and we also present a selfcontained development of a Riemann-Hilbert problem of inverse scattering that differs from those given in the literature and that is well adapted to semiclassical asymptotics. 相似文献