Optical observation of ion displacement in pyroelectric BaMnF4

Two anomalous behaviors are observed in the Raman spectra of BaMnF₄ at room temperature. One is that the number of Raman lines is smaller than that expected for the orthorhombic crystal structure with C _2ν ¹² symmetry, the other is that, of the b(aa)c, a(bb)c, and b(cc)a scattering geometries giving the same A₁-symmetry spectrum, the number of Raman lines in the b(aa)c spectrum is considerably smaller than those in the other two spectra. It is suggested that rotation of MnF₆ octahedra about c-axis occurring in the orthorhombic phase is responsible for the former behavior, and Ba²⁺-ion displacement along a-axis for the latter one.     

Theoretical investigation of EPR and optical spectra of Mo(V) in [Mo6O19][N(C4H9)4]3 salt

The electron paramagnetic resonance (EPR) spectral data (the g factors and hyperfine structure constants) and d–d transition spectra for the tetragonal Mo⁵⁺ centre in [Mo₆O₁₉][N(C₄H₉)₄]₃ salt are theoretically investigated from the complete diagonalization method (CDM) for a 4d¹ ion in tetragonally compressed octahedron. The theoretical results are in good agreement with the experimental data. The dependency of the g factors of the ground state on the R_∥(MoO bond length) has been studied. It is shown that the g factors varied with the R_∥ approximately in a linear way.     

含气量对液体中空泡声波频谱特性的影响

通过压电陶瓷（PZT）水听器获取了液体中激光空泡脉动辐射的声波,并计算了激光空泡在第1次脉动过程中泡内的含气量,结合空泡含气量对空泡最大半径及脉动周期影响的分析,进而分析了含气量对空泡声波频谱特性的影响。分析结果表明：激光空泡第1次脉动过程中泡内的含气量随着作用激光能量的增加而增加,含气量的多少将直接影响空泡运动的剧烈程度;含气量越多,空泡脉动越缓慢,脉动周期越长,空泡脉动辐射声波的峰值频率有向低频移动的趋势。     

荧光产生时间与荧光峰值波长关系的研究

用激光诱导荧光(LIF)方法对芳香族化合物蒽进行了时间分辨谱研究,介绍了所用测试系统的组成和测试方法,获得了蒽的荧光强度-波长-时间三维立体图、峰值荧光时间图、等高图,并对实验结果进行了分析。研究表明,荧光产生的时间与峰值波长有关系,长波早于短波。     

紫外-可见吸收光谱法现场监测聚苯胺的电化学降解

采用紫外-可见吸收光谱法现场监测了苯胺电化学聚合时的动力学降解过程,简单、直观地显示了阳极电位、酸度和苯胺浓度对降解过程的影响,结果表明,阳极电位越正、酸度越强、苯胺浓度越大,聚苯胺的降解速度越快。该方法得到的结果与聚苯胺膜在空白溶液中采用循环伏安法研究其降解动力学时得到的结果类似。     

Singlet–triplet oscillations and far-infrared spectrum of four-minima quantum-dot molecule

We study ground states and far-infrared spectra (FIR) of two electrons in four-minima quantum-dot molecule in magnetic field by exact diagonalization. Ground states consist of altering singlet and triplet states, whose frequency, as a function of magnetic field, increases with increasing dot–dot separation. When the Zeeman energy is included, only the two first singlet states remain as ground states. In the FIR spectra, we observe discontinuities due to crossing ground states. Non-circular symmetry induces anticrossings, and also an additional mode above ω₊ in the spin-triplet spectrum. In particular, we conclude that electron–electron interactions cause only minor changes to the FIR spectra and deviations from the Kohn modes result from the low-symmetry confinement potential.     

High resolution study of the six lowest doubly excited vibrational states of PH2D

The five lowest doubly excited deformational vibrational bands ν₄ + ν₆, 2ν₆, ν₃ + ν₄, ν₃ + ν₆, and 2ν₃ of PH₂D have been recorded for the first time using a Bruker 120 HR interferometer with a resolution 0.0033 cm⁻¹ and analysed. Some transitions belonging to a very weak band 2ν₄ have been also assigned. From the fit 24 and 86, respectively, diagonal and resonance interaction parameters were obtained which reproduce 1089 upper energy levels obtained from more than 4600 assigned transitions with the rms deviation of 0.00059 cm⁻¹.     

Analysis of hydrogen bonds by the IR spectra of thymine and N<Subscript>1</Subscript>,N<Subscript>3</Subscript>-deuterothymine

Calculations of the frequencies and absolute intensities of the IR bands of plane vibrations of thymine and N₁,N₃-deuterothymine in various phase states have been carried out. It has been shown that in the polycrystalline state thymine forms hydrogen bonds C₂=O₈...HN₁ and C₂=O₈...HN₃, and in an aqueous solution the intermolecular interaction is realized by means of the hydrogen bonds O₈...HO and O...HN₁.__________Translated from Zhurnal Prikladnoi Spektroskopii, Vol. 72, No. 1, pp. 99–105, January–February, 2005.     

Self-commutators of automorphic composition operators on the Dirichlet space

Let be a conformal automorphism on the unit disk and be the composition operator on the Dirichlet space induced by . In this article we completely determine the point spectrum, spectrum, essential spectrum and essential norm of the operators and self-commutators of , which expose that the spectrum and point spectrum coincide. We also find the eigenfunctions of the operators.

     

Topological phase boundary in a generalized Kitaev model

We study the effects of the next-nearest-neighbor hopping and nearest-neighbor interactions on topological phases in a one-dimensional generalized Kitaev model. In the noninteracting case, we define a topological number and calculate exactly the phase diagram of the system. With addition of the next-nearest-neighbor hopping, the change of phase boundary between the topological and trivial regions can be described by an effective shift of the chemical potential. In the interacting case, we obtain the entanglement spectrum, the degeneracies of which correspond to the topological edge modes, by using the infinite time-evolving block decimation method. The results show that the interactions change the phase boundary as adding an effective chemical potential which can be explained by the change of the average number of particles.