Stark效应对双光子Jaynes－Cummings模型中原子的压缩效应的影响

本文研究了包括Ｓｔａｒｋ效应时任意初态的双光子Ｊａｙｎｅｓ－ＣＵｍｍｉｎｇｓ模型的一般演化规律，应用到具体问题，讨论了初始时刻有效二能级原子处于基态而光场为二项式分布时原子的压缩效应。     

两纠缠原子与相干态光场相互作用的动力学

采用时间演化算符和数值计算方法,研究了两全同二能级纠缠原子与相干态光场相互作用的动力学,结果表明:原子布居和偶极压缩特性与两原子体系纠缠度和相干态光场强度相关联.     

Justification of Dipole Approximation in the Problem of Nonlinear Wave Generation by a Submerged Sphere

Some nonlinear dipole approximation is constructed for the nonstationary problem of a solid sphere motion under a free surface. The approximation is justified in the class of analytic functions decaying at infinity.Original Russian Text Copyright © 2005 Pyatkina E. V.The author was supported by the State Maintenance Program for the Leading Scientific Schools (Grant NSh-440.2003.1) and the Russian Foundation for Basic Research (Grant 05-01-00250).__________Translated from Sibirskii Matematicheskii Zhurnal, Vol. 46, No. 4, pp. 907–927, July–August, 2005.     

永磁体等效磁矩的测量

在磁技术应用中，对永磁材料的主要磁性参数的研究及测量已成为人们关注的问题之一．本文提出通过测量磁场从而确定永磁体磁矩的一种简便方法，并就测量所涉及的有关问题作了讨论．     

Three-dimensional ab initio dipole moment surfaces and stretching vibrational band intensities of the XH3 molecules

Stretching vibrational band intensities of XH₃ (X=N, Sb) molecules are investigated employing three-dimensional dipole moment surfaces combined with the local mode Hamiltonian model.The dipole moment surfaces of NH₃ and SbH₃ are calculated with the density functional theory and at the correlated MP2 level,respectively. The calculated band intensities are in good agreement with the available experimental data. The contribution to the band intensities from the different terms in the polynomial expansion of the dipole moments of four group V hydrides (NH₃, PH₃,AsH₃ and SbH₃) are discussed. It is concluded that the breakdown of the bond dipole approximation must be considered. The intensity “borrowing” effect due to the wave function mixing among the stretching vibrational states is found to be less significant for the molecules that reach the local mode limit.     

Multispectrum fitting of line parameters for C2H2 in the 3.8-μm spectral region

Using FT spectra (Bruker IFS 120, unapodized FWHM resolution ≈ 0.001 cm⁻¹) of acetylene ¹²C₂H₂, absolute positions and intensities have been measured for about 250 lines between 2600 and 2800 cm⁻¹ in the and cold bands, and in the and hot bands. These measurements improve the accuracy of wavenumbers previously available and lead to individual line intensities for the first time in this spectral region. A multispectrum fitting procedure has been used to retrieve line parameters from five experimental spectra recorded at different pressures. The frequencies of the ν₃ band of ¹²C¹⁶O₂ allowed to perform an absolute wavenumber calibration. The accuracy of the amount of ¹²C₂H₂ in the sample has been checked using the cold band around 2100 cm⁻¹, and has been estimated to be around ±2%. The average absolute accuracy of the line parameters obtained in this work has then been estimated to be ±0.0002 cm⁻¹ for line positions, and ±5% for line intensities. For each studied band, the vibrational transition dipole moment squared value has been determined, as also empirical Herman-Wallis coefficients. A complete line list containing positions and intensities for the five strongest bands around 3.8 μm has been set up for atmospheric applications.     

Three 1‐phenylindolin‐2‐one derivatives displaying different molecular dipole moments and different crystallographic symmetries

Three 1‐phenylindolin‐2‐one derivatives, namely 1‐phenylindolin‐2‐one, C₁₄H₁₁NO, (I), 5‐bromo‐1‐phenylindolin‐2‐one, C₁₄H₁₀BrNO, (II), and 5‐iodo‐1‐phenylindolin‐2‐one, C₁₄H₁₀INO, (III), have been synthesized and their structures determined. Compounds (I) and (II) crystallized in the centrosymmetric space groups Pbca and P2₁/c, respectively, while compound (III) crystallized in the polar space group Aea2. Density functional theory (DFT) calculations show that the molecular dipole moment gradually decreases in the order (I) > (II) > (III). The relatively smaller dipole moment of (III) and the larger non‐electrostatic intermolecular interactions may be the main reasons for the noncentrosymmetric and polar structure of (III).     

Exo conformers of N‐(pyridin‐2‐yl)‐ and N‐(pyridin‐3‐yl)norbornene‐5,6‐dicarboximide crystals

Two isomeric pyridine‐substituted norbornenedicarboximide derivatives, namely N‐(pyridin‐2‐yl)‐exo‐norbornene‐5,6‐dicarboximide, (I), and N‐(pyridin‐3‐yl)‐exo‐norbornene‐5,6‐dicarboximide, (II), both C₁₄H₁₂N₂O₄, have been crystallized and their structures unequivocally determined by single‐crystal X‐ray diffraction. The molecules consist of norbornene moieties fused to a dicarboximide ring substituted at the N atom by either pyridin‐2‐yl or pyridin‐3‐yl in an anti configuration with respect to the double bond, thus affording exo isomers. In both compounds, the asymmetric unit consists of two independent molecules (Z′ = 2). In compound (I), the pyridine rings of the two independent molecules adopt different conformations, i.e. syn and anti, with respect to the methylene bridge. The intermolecular contacts of (I) are dominated by C—H...O interactions. In contrast, in compound (II), the pyridine rings of both molecules have an anti conformation and the two independent molecules are linked by carbonyl–carbonyl interactions, as well as by C—H...O and C—H...N contacts.     

位错偶极子和Ⅲ型界面裂纹的干涉效应

研究了多晶体材料中螺型位错偶极子和界面裂纹的弹性干涉作用.利用复变函数方法,得到了该问题复势函数的封闭形式解答.求出了由位错偶极子诱导的应力场和裂纹尖端应力强度应子,分析了偶极子的方向,偶臂和位置以及材料失配对应力强度因子的影响.推导了作用在螺型位错偶极子中心的像力和力偶矩,并讨论了界面裂纹几何条件和不同材料特征组合对位错偶极子平衡位置的影响规律.结果表明,裂纹尖端的螺型位错偶极子对应力强度因子会产生强烈的屏蔽或反屏蔽效应.同时,界面裂纹对螺型位错偶极子在材料中运动有很强的扰动作用.     

Ab initio spectroscopic study for the NaRb molecule in ground and excited states

A wide adiabatic study is performed for NaRb molecule, involving 15¹Σ⁺ electronic states including the ionic state Na^?Rb⁺, as well as 14³Σ⁺, 1–9^1,3Π, and 1–5^1,3Δ states. This investigation is performed using an ab initio approach which involves the effective core potential, the core polarization potential with l‐dependent cut‐off functions. The NaRb system has been treated as a two‐electron system and the full valence configuration interaction is easily achieved. The spectroscopic constants R_e, D_e, T_e, ω_e, ω_ex_e, B_e, and D₀ for all these states are derived. We have also computed the vibrational levels as well their spacing for different values of J. In addition, permanent and transition dipole moments are determined and analyzed. The Dunham coefficients have been used to perform experimental spacing to compare directly with our results. The present calculations on NaRb extend previous theoretical works to numerous electronic excited states in the various symmetries. © 2014 Wiley Periodicals, Inc.