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91.
Brad M. Rosen Virgil Percec 《Journal of polymer science. Part A, Polymer chemistry》2007,45(21):4950-4964
Atom transfer radical polymerization (ATRP) and single electron‐transfer living radical polymerization (SET‐LRP) both utilize copper complexes of various oxidation states with N‐ligands to perform their respective activation and deactivation steps. Herein, we utilize DFT (B3YLP) methods to determine the preferred ligand‐binding geometries for Cu/N‐ligand complexes related to ATRP and SET‐LRP. We find that those ligands capable of achieving tetrahedral complexes with CuI and trigonal bipyramidal with axial halide complexes with [CuIIX]+ have higher energies of stabilization. We were able to correlate calculated preferential stabilization of [CuIIX]+ with those ligands that perform best in SET‐LRP. A crude calculation of energy of disproportionation revealed that the same preferential binding of [CuIIX]+ results in increased propensity for disproportionation. Finally, by examining the relative energies of the basic steps of ATRP and SET‐LRP, we were able to rationalize the transition from the ATRP mechanism to the SET‐LRP mechanism as we transition from typical nonpolar ATRP solvents to polar SET‐LRP solvents. © 2007 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 45: 4950–4964, 2007 相似文献
92.
Summary The relative X-ray fluorescence (XRF) intensities for annular source and various annular specimen are measured with a Ge-Li
detection system and calculated by the Monte Carlo numerical techniques (MCNT).Kα X-ray intensities of annular specimens with different radii prepared from a pure-molybdenum foil are measured and it is
seen that the measured values are in good agreement with the values calculated by MCNT. The variation of the fluorescence
intensity due to the collimator radius is also studied. The differences between the MCNT and experimental results are discussed
in terms of the possible sources of errors. 相似文献
93.
研究了在美国BNL/AGS上能量10.7AGeV的197Au离子诱发核作用,报告了EMU–01国际合作实验关于射弹核碎裂和产生粒子密度等最新实验结果. 相似文献
94.
The phenomenological amplitude for the reaction πN→ππN fixed by fittings to the experimental data in the energy region 0.300 ≤P
Lab≤ 500 MeV/c is used for modelling the Chew–Low extrapolation and Olsson–Turner threshold approach. It is shown that the uncritical
application of the former results in enermous theoretical errors, the extracted values being in fact random numbers. The results
of the Olsson–Turner method are characterized by significant systematic errors coming from unknown details of the isobar physics.
Received: 10 December 1997 相似文献
95.
Summary A microwave coherent backscattering experiment has been carried out on Mirabelle, a weakly ionised plasma device, with the
objective of measuring the electron density fluctuation level. The experiment is a preliminary step in order to prepare the
detection system for a microwave stimulated backscattering experiment. The incident electromagnetic wave is focused in front
of a plane grid which excites ion acoustic or electron Bernstein waves inducing fluctuations in the plasma. The backscattering
signal is collected by the launching circuit and detected by homodyne mixing. The typical ratio of the scattered power to
the incident power is about 10−12 and the relative density fluctuations are of the order of δn
e/n
e=10−3 against a background electron density ofn
e=1–5·109 cm−3. The backscattering measurement is compared with Langmuir probe measurements. The spectral width of the backscattered signal
has also been studied, by taking into account effects due to the incident wave focusing and plasma wave damping.
The authors of this paper have agreed to not receive the proofs for correction 相似文献
96.
Interplay of charge, spin, orbital and lattice correlations in colossal magnetoresistance manganites
A. Weiße H. Fehske 《The European Physical Journal B - Condensed Matter and Complex Systems》2002,30(4):487-494
We derive a realistic microscopic model for doped colossal magnetoresistance manganites, which includes the dynamics of charge,
spin, orbital and lattice degrees of freedom on a quantum mechanical level. The model respects the SU(2) spin symmetry and the full multiplet structure of the manganese ions within the cubic lattice. Concentrating on the hole
doped domain ( 0≤x≤0.5) we study the influence of the electron-lattice interaction on spin and orbital correlations by means of exact diagonalisation
techniques. We find that the lattice can cause a considerable suppression of the coupling between spin and orbital degrees
of freedom and show how changes in the magnetic correlations are reflected in dynamic phonon correlations. In addition, our
calculation gives detailed insights into orbital correlations and demonstrates the possibility of complex orbital states.
Received 4 September 2002 / Received in final form 8 November 2002 Published online 31 December 2002 相似文献
97.
Field equations of the S2 sigma model (“the A3 model”) with spontaneously broken Z(2) symmetry are presented for (D+1)-dimensional space–time. The A3 model is an extension of the sine-Gordon equation (SGE) and supports kink-like U(1) charged solitons which are a generalization of neutral solitons of the SGE. The natural question arises — is the A3 model completely integrable in (1+1)-dimensional space–time? The Lorentz-invariant scalar A3 field can be viewed as a promising alternative to the Higgs field. 相似文献
98.
99.
本文用数字散斑相关方法测量了五种不同幂硬化指数韧性金属材料(铝和铜),双边裂纹尖端细观区域内应变场.对所得结果用韧性损伤模型进行了分析.在此法中以金属自然表面结构为散斑场,不同加载状态的散斑场进行比较,得到相对变形与应变.图象之间相关性 C 是变形参数或是位移及其导数的泛函.使其相关性 C 取最大值的试凑变形即为其真实变形场.这一方法在细观测量中应用得到满意的结果. 相似文献
100.
An investigation of finite-size scaling for systems with long-range interaction: The spherical model
A method is suggested for the derivation of finite-size corrections in the thermodynamic functions of systems with pair interaction potential decaying at large distancesr asr
–d –
, whered is the space dimensionality and>0. It allows for a unified treatment of short-range (=2) and long-range (<2) interaction. The asymptotic analysis is illustrated by the mean spherical model of general geometryL
d–d×
d
subject to periodic boundary conditions. The Fisher-Privman equation of state is generalized to arbitrary real values ofd, 0d. It is shown that the-expansion may be used to study the breakdown of standard finite-size scaling at the borderline dimensionalities. 相似文献