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91.
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Feng‐You Hao Yong‐Fang Zhao Xiao‐Gong Jing Xin‐Ying Li Feng‐Li Liu 《International journal of quantum chemistry》2007,107(6):1502-1507
Ab initio quantum chemical calculations have been performed on X2Cl? and X2Cl (X = C, Si, Ge) clusters. The geometrical structures, vibrational frequencies, electronic properties and dissociation energies are investigated at the Hartree–Fock (HF), Møller–Plesset second‐ and fourth‐order (MP2, MP4), CCSD(T) level with the 6‐311+G(d) basis set. The X2Cl (X = C, Si, Ge) and X2Cl? (X = Si, Ge) take a bent shape obtained at the ground state, while C2Cl? has a linear structure. The impact on internal electron transfer between the X2Cl and the corresponding anional clusters is studied. The three different types of electron affinities (EAs) at the CCSD(T) are reported. The most reliable adiabatic electronic affinities, obtained at the CCSD(T)/cc‐pvqz level of theory, are predicted to be 3.30, 2.62, and 1.98 eV for C2Cl, Si2Cl, and Ge2Cl, respectively. The calculated EAs of C2Cl and Ge2Cl are in good agreement with theoretical results reported. The correlation effects and basis sets effects on the geometrical structures and dissociation energies are discussed. © 2006 Wiley Periodicals, Inc. Int J Quantum Chem, 2007 相似文献
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The monodisperse, macroporous poly(glycidyl methacrylate- co-ethylene dimethacrylate) beads were synthesized by a single-step swelling and polymerization method. Based on this media, a weak cation exchange (WCX) stationary phase for HPLC was synthesized by a new chemically modified method. The prepared resin has advantages for biopolymer separation, high column efficiency, low column backpressure, high protein mass recovery, and good resolution for proteins. The measured bioactivity recovery for lysozyme was 98+/-5%. The dynamic protein loading capacity of the WCX packings was 17.3 mg g(-1). The experimental results show that the synthesized WCX resin has very weak hydrophobicity. 相似文献
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Adaptive Constrained Control of Unknown Strict Feedback Nonlinear Systems With Dead Zone Input北大核心CSCD 下载免费PDF全文
研究了具有死区输入的预设约束未知高阶严格反馈非线性系统的控制问题,提出了一种基于免疫函数的自抗扰预设漏斗约束自适应控制策略。首先,针对系统内部的未知问题,采用免疫函数与扩张状态观测器结合对系统内部未知项进行观测;其次,通过Lyapunov方法与漏斗控制相结合设计控制器,使得跟踪误差能够维持在预先设定的漏斗约束范围内;同时,利用双曲正切函数速率变化快这一特性设计自适应控制律,引入指令滤波器避免反步法中重复求导问题,分析证明了闭环系统所有信号的有界性。仿真实例表明了控制方法的有效性。 相似文献
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A highly sensitive and selective fluorescence-quenching kinetic method is proposed for the determination of trace osmium(IV), based on the catalytic effect of osmium(IV) on the salicylfluorone (ex = 510 nm, em = 535 nm)-H2O2 system at pH 9.3–9.6. Using the fixed time method, osmium(IV) in the range 0.008–0.6 ng/ml can be determined. The detection limit is 0.006 ng/ml. Over thirty anions and cations, including other platinum metal ions, do not interfere, even when present in large excess. The method has been applied successfully for the determination of osmium in a series of synthetic mixtures and refined ore with relative standard deviations of 2–6%. 相似文献
99.
Zhi-Cheng Wang Gong Yu Song-Yi Zheng Wen-An Guo 《Zeitschrift für Physik B Condensed Matter》1994,95(1):95-100
We consider an ensemble of three-level configuration atoms in an optical cavity, interacting through two-photon transitions with a cavity mode, driven by a broad-band squeezed input of finite amplitude. The atom-cavity system is coupled to reservoirs to describe the losses of the atoms and the cavity. Optical spectra in the transmitted and the reflected field are calculated and analysed in the good cavity limit, for the purely absorptive resonant case and the general case, respectively. 相似文献
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