Magnetic properties of Nd0.5Pb0.5—xSrxMnO3 materials

The structure and magnetic properties of Nd_{0.5}Pb_{0.5-x}Sr_xMnO_3 (0≤x≤0.4) manganites were systematically investigated. Significant changes in Curie temperature and metal-insulator (MI) transition temperature of the samples were observed. All samples exhibited a transition from paramagnetic semiconducting to ferromagnetic metallic state. Curie temperature T_C and the MI transition temperature T_p increased with increasing Sr content. We attributed these behaviours to the enhancing of both the double exchange mechanism and the Jahn－Teller electron－phonon coupling.     

La0.5>RE0.3Sr0.2FeO3－δ (RE = Nd、Ce、Sm)体系双稀土阴极材料的制备与电性能

采用甘氨酸-硝酸盐法(GNP)合成了La0.5RE0.3Sr0.2FeO3－δ(RE=Nd、Ce、Sm)系列复合氧化物粉体. 用X射线衍射(XRD)和TG-DSC分析了样品钙钛矿物相的形成过程, 用Archimedes排水法测量体积密度并计算烧结样品的相对密度, 用四端子技术测量电导率. 结果显示, 掺Nd的样品1200 ℃烧结2 h成为单一立方钙钛矿结构, 掺Ce样品有明显的CeO2立方相析出, 掺Sm样品主相为钙钛矿结构伴有微弱的杂峰. 1250 ℃烧结2 h的La0.5Nd0.3Sr0.2FeO3－δ在600 ℃时电导率高达100 S•cm-1以上, 明显高于La0.5Ce0.3Sr0.2FeO3－δ及La0.5Sm0.3Sr0.2FeO3－δ样品的电导率, 预示着La0.5Nd0.3Sr0.2FeO3－δ可能是一种良好的中温固体氧化物燃料电池(SOFC)阴极材料.     

预测[Si, C, S]＋和[Si, C, S]－体系的稳定异构体

采用DFT, QCISD及CCSD(T)方法分别对二重态的[Si, C, S]＋和[Si, C, S]－体系势能面进行理论计算, 用QCISD/6-311＋G(d)方法, 在[Si, C, S]＋和[Si, C, S]－体系中, 我们分别得到了2个过渡态连接的3个稳定体和2个过渡态连接的4个稳定体, 经热力学及动力学分析发现, [Si, C, S]＋体系只有二重态线性的离子[Si—C—S]＋可能稳定存在, 而[Si, C, S]－体系有二重态线性的离子[Si—C—S]－和三元环c-[SiCS]－可能稳定存在.     

Probabilistic teleportation of an unknown atomic state

We propose two schemes for teleporting an unknown state. In our schemes, a three-particle Greenberger－Horne－Zeilinger state is used as a quantum channel. We show that the probabilistic teleportation of an unknown quantum state can be realized.     

Invariant theory and exact solutions of the time-dependent supersymmetric two-level multiphoton Jaynes－Cummings model

On the basis of the fact that the two-level multiphoton Jaynes－Cummings (TLMJC) model possesses a supersymmetric structure, an invariant is constructed in terms of the supersymmetric generators by working in the sub-Hilbert-space corresponding to a particular eigenvalue of the conserved supersymmetric generators (the time-independent invariant). In this paper, we investigate the invariant-related unitary transformation approach to exact solutions of the time-dependent TLMJC model.     

A connection theory for a nonlinear differential constrained system

An Ehresmann connection on a constrained state bundle defined by nonlinear differential constraints is constructed for nonlinear nonholonomic systems. A set of differential constraints is integrable if and only if the curvature of the Ehresmann connection vanishes. Based on a geometric interpretation of d－δ commutation relations in constrained dynamics given in this paper, the complete integrability conditions for the differential constraints are proven to be equivalent to the three requirements upon the conditional variation in mechanics: (1) the variations belong to the constrained manifold; (2) the time derivative commutes with variational operator; (3) the variations satisfy the Chetaev's conditions.     

Dependence of in—tube doping on the radius and helicity of single—wall carbon nanotubes

Using the Lennard－Jones interaction potential between the impurity atom and carbon atom, we have studied the dependence of in-tube impurity doping on the radius of a single-wall carbon nanotube (SWNT), as well as its helicity. The obtained results show that the radius of the most stably doped SWNT is different for different kinds of impurity atoms. This is useful for producing the required doped SWNT. In addition, it is found that the helicity of tube has a strong effect on the potential energy of the atoms doped in the SWNT.     

Fokker-planck study of tokamak electron cyclotron resonance heating

A Fokker－Planck study is carried out for tokamak electron cyclotron resonance heating by writing the quasi-linear diffusion operator into a form adaptive to the collision operator and considering the wave absorption characteristics of both the O-mode and the X-mode in different magnetic surfaces. Though the Fokker－Planck code is non-relativistic in nature, however, if the relativistic resonance condition for the nearly perpendicularly propagating waves is treated suitably, we can obtain correct results. The energy loss mechanism through anomalous transport is also modelled using a suitable loss term. In the heating phase, the electron distribution deviates from the Maxwellian distribution substantially, which leads to non-linear absorption characteristics. The wave damping rate is non-linear and changes with time. The electron pressure is usually anisotropic under different conditions: p_{e⊥}/p_{e‖}>2 for different D_0 and τ_e.     

黄金规则用于N-3＋N3体系电子转移的研究

基于B3P86/6 311＋G优化的N3与N－3分子几何,确定了N3＋N－3基态电子转移体系 的六种不同的耦合机理,及各种形式耦合络合物的几何性质、活化能、稳定化能、耦合矩阵 元和态密度,并利用黄金规则计算了电子转移速率,讨论了各耦合方式对电子转移速率的影响 .     

Optical vibration modes and electron－phonon interaction in ternary mixed crystals of polar semiconductors

Optical vibrations of the lattice and the electron－phonon interaction in polar ternary mixed crystals are studied in the framework of the continuum model of Born and Huang and the random-element-isodisplacement model. A normal-coordinate system to describe the optical vibration in ternary mixed crystals is correctly adopted to derive a new Fr?hlich-like Hamiltonian for the electron－phonon interaction including the unit-cell volume variation influence. The numerical results for the phonon modes, the electron－phonon coupling constants and the polaronic energies for several typical materials are obtained. It is verified that the nonlinearity of the electron－phonon coupling effects with the composition is essential and the unit-cell volume effects cannot be neglected for most ternary mixed crystals.