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101.
Chao‐Han Cheng Dr. Ruei‐Ding Hung Wen‐Zhen Wang Dr. Shie‐Ming Peng Prof. I‐Chia Chen Prof. 《Chemphyschem》2010,11(2):466-473
Transient absorption spectroscopy is used to study the excited‐state dynamics of Co3(dpa)4(NCS)2, where dpa is the ligand di(2‐pyridyl)amido. The ππ*, charge‐transfer, and d–d transition states are excited upon irradiation at wavelengths of 330, 400 and 600 nm, respectively. Similar transient spectra are observed under the experimental temporal resolution and the transient species show weak absorption. We thus propose that a low‐lying metal‐centered d–d state is accessed immediately after excitation. Analyses of the experimental kinetic traces reveal rapid conversion from the ligand‐centered ππ* and the charge‐transfer states to this metal‐centered d‐d state within 100 fs. The excited molecule then crosses to a second d–d state within the ligand‐field manifold, with a time coefficient of 0.6–1.4 ps. Because the ground‐state bleaching band recovers with a time coefficient of 10–23 ps, we propose that an excited molecule crosses from the low‐lying d–d state either directly within the same spin system or with spin crossing via the state 2B to the ground state 2A2 (symmetry group C4). In this trimetal string complex, relaxation to the ground electronic surface after excitation is thus rapid. 相似文献
102.
时间分辨拉曼光谱研究一氧化氮与肌红蛋白的结合过程 总被引:1,自引:0,他引:1
纳秒瞬态拉曼光谱技术是研究分子结构变化超快动态过程的重要实验手段之一.而肌红蛋白(Mb)与小分子配体的结合过程一直是人们研究的焦点.本文旨在利用纳秒瞬态拉曼光谱技术研究小分子配体NO与肌红蛋白结合的动力学过程.通过考察MbNO光解后产物脱氧肌红蛋白(DeoxyMb)与反应物MbNO的ν4特征振动峰的强度比值随激光激发功率的变化,阐述了利用纳秒瞬态拉曼光谱技术研究MbNO体系中NO与DeoxyMb结合过程的可行性.利用纳秒瞬态拉曼光谱技术,获得了与皮秒时间分辨拉曼和皮秒时间分辨吸收相一致的结合动力学实验结果.为研究其它复杂体系的超快结合动力学过程提供了一种新的思路. 相似文献
103.
H. Qi D.L. Wang L.M. Ruan 《Journal of Quantitative Spectroscopy & Radiative Transfer》2011,112(15):2507-2519
Particle Swarm Optimization (PSO) algorithms, including standard PSO, Stochastic PSO, and Multi-Phase PSO, are applied to solve the time-domain inverse transient radiation problems in the present research. Time-resolved transmittance and reflectance signals of four different measuring models serve as the measurement data, which estimate absorption, scattering coefficients, and geometric position within one-dimensional non-homogeneous media by inverse simulation. To check retrieval performances and accuracies of PSO-based approaches, four different inverse transient radiation cases are investigated to deal with one homogeneous layer, two-layer, three-layer, and continuous non-homogenous media. The influences of different searching ranges, swarm sizes, and maximum fly velocities on the fitness function of PSO are discussed. Meanwhile, the effects of measurement errors on the reconstruction accuracy are also investigated. All the results confirm that radiative parameters could be estimated accurately with measurement noise using PSO-based approaches. 相似文献
104.
为提高传统光滑粒子动力学(smoothed particle hydrodynamics, SPH)方法模拟瞬态热传导问题的精度和稳定性,本文提出了一种一阶对称光滑粒子动力学(first order symmetric SPH, FO-SSPH)方法.该方法将具有二阶热传导方程分解成两个一阶偏微分方程,然后基于梯度离散和Taylor级数展开思想,对一阶核梯度形式进行修正,并将得到的局部矩阵对称化.数值结果表明:与传统SPH方法相比,FO-SSPH方法精度高、数值稳定性好; 该方法能较准确地直接施加混合边值
关键词:
瞬态热传导
光滑粒子动力学
非线性 相似文献
105.
106.
107.
The early transient responses of multi-span stepped single walled carbon nanotubes (SWCNTs) under impact loadings are studied by the method of reverberation ray matrix (MRRM). The dynamics model of the carbon nanotubes is established in the Fourier phase space on the basis of the nonlocal Timoshenko beam model. The wave solutions of SWCNTs with arbitrary boundary conditions are obtained by the wave method. The reverberation ray matrix of the multi-span stepped SWCNTs is the product of scattering, phase and permutation matrices, which can be determined by the impact loadings, continuous conditions and boundary conditions. The early transient responses can be calculated by the inverse Fourier transform of the sum of initial ray groups. It can be found that the early transient displacement response in the very short time subjected to the impact loading is very small, while the transient transverse shear strain becomes large in the very short time. The influences of nanotubes span number, nanotubes type and boundary conditions on the early transient responses of multi-span stepped SWCNTs are investigated. 相似文献
108.
Ying‐Hui Wang Li‐Jing Gong Wen‐Yue Dong Ping Lu Zhi‐Hui Kang Tian‐Hao Huang Yu‐Guang Ma Han‐Zhuang Zhang 《Journal of Polymer Science.Polymer Physics》2013,51(12):992-997
The photoexcitation processes of two donor–acceptor‐type copolymers PCFBT with different ratios between the donor and the acceptor ( PCFBT0.5 and PCFBT0.1 ) in the solution system are systematically studied. If the number of the donor is equal to that of the acceptor in one repeat unit (such as PCFBT0.5 ), intrachain charge transfer (ICT) can occur and participate in the relaxation of the excited state after photoexcitation. When the number of donors is much larger than that of acceptors (such as PCFBT0.1 ) in one repeat unit, the ICT character can disappear, and the localized exciton decay process is dominant in the relaxation of the copolymer, which also involves an excitation intensity‐independent vibrational thermal relaxation process at the initial time. The results further the understanding of the basic structure‐property relationship. © 2013 Wiley Periodicals, Inc. J. Polym. Sci., Part B: Polym. Phys. 2013 , 51, 992–996 相似文献
109.
110.
碰撞过程的瞬态数字测量 总被引:3,自引:0,他引:3
提出了一种对碰撞过程进行瞬态数字测量的方法和仪器装置。它可以用来显示冲击力的时间过程,计算出碰撞过程的冲量从而可以在气轨实验中验证的动量定理。 相似文献