紫外光诱导液晶相位光栅

使用紫外光诱导取向技术制作了可转换的液晶相位光栅,通过光掩模两次曝光的方法形成光栅条纹.这种光栅制作工艺较为简单,不需要上下基板精确的对准,驱动电压较低.采用He-Ne激光器和光探测器进行测试,结果表明,衍射效率具有电场调制性并出现同预测一致的衍射条纹.对液晶光栅的偏振特性进行了研究,利用琼斯矩阵和衍射理论对液晶相位光栅衍射强度进行了分析和模拟计算.     

AsS melt under pressure: one substance, three liquids

An in situ high-temperature--high-pressure study of liquid chalcogenide AsS by x-ray diffraction, resistivity measurements, and quenching from melt is presented. The obtained data provide direct evidence for the existence in the melt under compression of two transformations: one is from a moderate-viscosity molecular liquid to a high-viscosity nonmetallic polymerized liquid at P approximately 1.6-2.2 GPa; the other is from the latter to a low-viscosity metallic liquid at P approximately 4.6-4.8 GPa. Upon rapid cooling, molecular and metallic liquids crystallize to normal and high-pressure phases, respectively, while a polymerized liquid is easily quenched to a new AsS glass. General aspects of multiple phase transitions in liquid AsS, including relations to the phase diagram of the respective crystalline, are discussed.     

FTIR investigations of phase transitions in an asymmetric azomethine liquid crystal

The liquid crystalline (LC) behavior of a literature-reported asymmetric azomethine compound (4-[4-(n-butyloxy)-benzylideneimino]-chlorobenzene, Cl.O4) was investigated by using optical polarized light microscopy, differential scanning calorimetry and medium-wide angle X-ray diffraction. FTIR in attenuated total internal reflection configuration was employed to study the microstructural changes occurring during phase transitions of the azomethine. Spectral modifications, associated with molecular conformation rearrangements, allowing the change of the molecular shape from a LC organization to another, have been found. The spectral analysis gave significant evidences for the different phase transitions, thus proving the efficiency of such method for investigating LC materials.     

表面摩擦处理对全息聚合物分散液晶光栅电光特性的影响

为了提高全息聚合物分散液晶光栅的衍射效率并降低其驱动电压,改善光栅的电光特性,研究了表面平行摩擦取向对全息聚合物分散液晶光栅电光特性的影响.理论分析认为,改善相分离结构和降低液晶微滴之间的有序度差异是优化光栅电光特性的根本所在.由于进行表面取向处理后的液晶和单体之间达到扩散匹配,使得相分离的程度大幅提高,在衍射能力增强的同时驱动电压也实现了大幅下降,而且,表面取向作用也使光栅内的液晶分子均匀排列,降低了液晶微滴之间的有序度差异,从而减少了光栅的散射损失.实验结果表明:进行取向处理后的光栅其衍射效率由传统光 关键词： 全息聚合物分散液晶 衍射效率 驱动电压     

Molecular conformation and liquid structure of 2-propanol through neutron diffraction

The neutron diffraction data analysis of deuterated liquid 2-propanol at room temperature to define its molecular conformation is presented. 2-Propanol being a large molecule with twelve atomic sites, the conformation analysis is tricky and an improved method of data analysis is given. The intermolecular structural correlations, i.e., hydrogen-bonded liquid structure, can be modelled accurately to extract the nature of the average hydrogen-bonded molecular association in liquid state at room temperature. Like other alcohols these are mostly hexamer ring chain (HRC) clusters. The cluster analysis of recent X-ray data available in the literature also support the same liquid structure.     

X-ray diffraction study of liquid Cs up to 9.8 GPa

We describe an x-ray diffraction study of liquid Cs at high pressure and temperature conducted in order to characterize the structural changes associated with the complex melting curve and phase transitions observed in the solid phases. At 3.9 GPa we observe a discontinuity in the density of the liquid accompanied by a decrease in the coordination number from about 12 to 8, which marks a change to a nonsimple liquid. The specific volume of liquid Cs, combined with structural analysis of the diffraction data, strongly suggest the existence of dsp(3) electronic hybridization above 3.9 GPa, similar to that reported on compression in the crystalline phase.     

Neutron diffraction studies of liquid carbon suboxide

The structure factor S _m(Q) for liquid carbon suboxide has been determined for a Q-value range of 0·4 to 60 Å^-1 by neutron diffraction measurements using a steady-state (reactor) and a pulsed (linac) neutron source. The bond lengths of the molecule have been determined from the data and give good agreement with the results of electron diffraction measurements on the vapour phase after application of a molecular recoil correction term. The quasi-linear nature of the molecule is confirmed but the shape of the form factor indicates that large amplitude bending motion probably occurs in the liquid phase.

Oscillations in the intermolecular pair correlation function are observed to have a regular periodicity extending to 12 Å but details of orientational effects cannot be established from a single diffraction measurement.     

Single molecule diffraction

For solving the atomic structure of organic molecules such as small proteins which are difficult to crystallize, the use of a jet of doped liquid helium droplets traversing a continuous high energy electron beam is proposed as a means of obtaining electron diffraction patterns (serial crystallography). Organic molecules (such as small proteins) within the droplet (and within a vitreous ice jacket) may be aligned by use of a polarized laser beam. Iterative methods for solving the phase problem are indicated. Comparisons with a related plan for pulsed x-ray diffraction from single proteins in a molecular beam are provided.     

Influence of phase delay profile on diffraction efficiency of liquid crystal optical phased array

The hardware structure and driving voltage of liquid crystal optical phased array (LCOPA) devices determine the produced phase delay characteristics. The phase delay profile influences directly the device's diffraction efficiency. In this paper, a sawtooth-shaped phase delay model of LCOPA was proposed to analyze quantitatively the influence factors of diffraction efficiency employing Fourier optics theory. Analysis results show that flyback region size is the main factor that affects diffraction efficiency. The influence extent varies with different maximum-phase-delays and grating periods. There exists an optimized curve between maximum-phase-delay and flyback region, and between maximum-phase-delay and grating period, individually. The smaller the grating period is or the larger the flyback region is, the more evident the optimization effect becomes, and the maximum increase ratio is up to 16%. Some feasible experiments were done to test theoretical analysis, and the experimental results agreed with the analysis results.     

一种液晶相位调制特性的测量方法

提出一种基于衍射光栅的液晶相位调制特性测量方法.该方法利用液晶构建相位分别为0和φ的二值光栅,通过傅里叶光学的方法推导衍射光栅第0级衍射光斑光强和调制相位φ之间的关系,然后实测光强和液晶驱动电压之间的对应关系来得到相位和液晶驱动电压之间的对应关系,即液晶相位光栅的相位调制特性.最后利用测量相位调制特性结果构建液晶相控阵,用光束偏转误差验证调制特性测量结果,相位测量误差小于1×10~(-3)rad.     

位相调制的实时联合变换相关器

提出一种位相调制的实时联合变换相关器。它采用液晶显示屏作为输入器件，用液晶光阀记录和显示联合功率谱。利用液晶显示屏上的光栅状结构的衍射级，提高光能的利用率，并充分利用液晶光阀的有效使用面积。采用成像透镜放大各衍射级的联合频谱，适应液晶光阀较低的分辨率要求。在相关器的光路中插入两块倾斜的平行平面玻璃板，以改变各衍射级的参考图像和目标图像之间的位相差。这种方法可产生比传统的实时联合变换相关器更好的输出相关性能。实验结果证实了该系统设计及性能分析的正确性     

Effect of the chiral chain length on structural and phase properties of ferroelectric liquid crystals

Studies of structural and phase properties obtained on several ferroelectric liquid crystalline materials with 2-alkoxypropionate group used as a chiral centre and without any lateral substitution are presented. In dependence on the chiral chain length these compounds exhibit the cholesteric N* phase, the ferroelectric smectic C* and a low-temperature SmX phase. Values of the spontaneous polarization and spontaneous tilt angle have been determined within the whole range of the SmC* phase. A low-temperature SmX phase has been identified as the orthogonal hexatic SmB* phase. The molecular parameters, namely the layer spacing in the SmC* and SmB* phases and the average intermolecular distances (D) between neighbouring parallel molecules in all investigated phases have been determined using the results of the X-ray diffraction obtained on non-oriented samples. The effect of the chiral chain length on mesomorphic, structural and physical properties of the studied ferroelectric liquid crystalline materials is discussed.     

Extraordinary magnetic field effect in bent-core liquid crystals

A bent-core mesogen that forms a cybotactic nematic phase exhibits a giant magnetic field-induced shift of its nematic-isotropic and smectic-C-nematic transition temperatures: ΔT(H) = 4 K for H = 10 kOe. In contrast with molecular nematics, in cybotactic nematics the field couples with the anisotropic susceptibility of clusters containing several hundred partially ordered molecules. X-ray diffraction data corroborate a quantitative estimate of inferred cluster size (～300 molecules). The results represent an unequivocal demonstration of the cluster picture of the nematic phase of this class of nonlinear liquid crystals.     

Transient grating study of the intermolecular dynamics of liquid nitrobenzene

Femtosecond time-resolved transient grating(TG) technique is used to study the intermolecular dynamics in liquid phase. Non-resonant excitation of the sample by two crossing laser pulses results in a transient Kerr grating, and the molecular motion of liquid can be detected by monitoring the diffraction of a third time-delayed probe pulse. In liquid nitrobenzene(NB), three intermolecular processes are observed with lifetimes of 37.9±1.4 ps, 3.28±0.11 ps, and 0.44±0.03 ps, respectively. These relaxations are assigned to molecular orientational diffusion, dipole/induced dipole interaction, and libration in liquid cage, respectively. Such a result is slightly different from that obtained from OKE experiment in which the lifetime of the intermediate process is measured to be 1.9 ps. The effects of electric field on matter are different in TG and optical Kerr effect(OKE) experiments, which should be responsible for the difference between the results of these two types of experiments. The present work demonstrates that TG technique is a useful alternative in the study of intermolecular dynamics.     

气液态分子运动的Hurst指数及相图研究

本文运用分子动力学模拟方法,模拟了不同温度条件下饱和气体和液体氩分子的运动。对气液状态下分子运动在速度空间的演化相图进行了比较。根据分形理论,对实际分子的分数布朗运动特性进行了讨论。应用本文提出的约化规模法,获得了不同温度条件下分子分数布朗运动的Hurst指数和轨迹分维数。饱和液相分子运动的Hurst指数并不随温度单调上升,存在一个极小值。     

Conformational landscape of small organosilicon compounds from the combined use of gas electron diffraction,IR and Raman spectroscopies and quantum chemical calculations: diethyldichlorosilane

A conformational study of diethyldichlorosilane and the elucidation of the gas‐phase molecular structures of its four conformers have been performed using the combined approach of gas‐phase electron diffraction and computational techniques. Moreover, the Raman spectrum of the liquid and the IR spectra of the gas and liquid phases have been recorded and thoroughly analyzed on the basis of the scaled quantum‐mechanical force field methodology. The results of the vibrational assignment have given spectroscopic evidence of the presence of the different conformers in the samples. Copyright © 2009 John Wiley & Sons, Ltd.     

Induced Smectic X Phase Through Intermolecular Hydrogen-Bonded Liquid Crystals Formed Between Citric Acid and <Emphasis Type="Italic">p</Emphasis>-<Emphasis Type="Italic">n</Emphasis>-(Octyloxy)Benzoic Acid

Hydrogen-bonded liquid crystal (HBLC) is synthesized from citric acid (CA) and 4-(octyloxy)benzoic acid (8OBA) with different mole ratios. Fourier transform infrared spectroscopy (FT-IR) confirms the presence of hydrogen bond between CA and 8OBA. Nuclear magnetic resonance (NMR) spectroscopic studies validate the intermolecular complementary, cyclic type of hydrogen bond, and molecular environment in the designed HBLC complex. Powder X-ray diffraction analysis reveals the monoclinic nature of liquid crystal complex in solid phase. Liquid crystal parameters such as phase transition temperature and enthalpy values for the corresponding mesogenic phases are investigated using a polarizing optical microscope (POM) and differential scanning calorimetry (DSC). It is observed that the change in chain length and steric hindrance while increasing the mole ratio in HBLC complex induces a new smectic X (Sm X) along with higher-order smectic G (Sm G) phases by quenching of smectic C (Sm C). From the experimental observations, induced Sm X phase has been identified as a finger print texture. Also, Sm G is a multi-colored mosaic texture in 1:1, 1:2, and 1:3 mol ratios. The optical tilt angle, thermal stability factor, and enhanced thermal span width of CA + 8OBA complex are discussed.     

Solid structures of benzene at high pressures: molecular dynamics study

The structure of the experimentally-observed phase II of solid benzene at high pressures has been investigated through structural phase transitions in molecular dynamics simulations. Several structures are obtained by the pressure-induced phase transitions from the low-pressure phase I. Among them, the most possible structure is a high-pressure phase III with stacking faults, which is more stable than two structures previously proposed for the phase II by molecular packing analysis at high pressures. Furthermore, the experimental powder X-ray diffraction pattern for the phase II can be explained by the structure.     

Temperature and orientation dependence of surface relief gratings based on dye-doped polymer film with the interface of nematic liquid crystals

The formation of surface relief grating on dye-doped polymer film with the interface of nematic liquid crystals has been investigated by means of the holographic technique. The first-order diffraction efficiency of surface relief grating depends on the temperature and the orientation of molecular director in the interface of nematic liquid crystals. The diffraction efficiency is roughly independent of thermal fluctuations of molecular director in the most part of nematic temperature range and apparently drops near the transition temperature. The morphology of surface relief grating demonstrates that the surface modulation is larger for molecular director parallel to the groove direction. The experimental result also shows that the first-order diffraction efficiency is dependent on the surface modulation of surface relief grating.     

Calculations of neutron diffraction patterns obtained with a nematic liquid crystal

Recently, neutron diffraction data obtained with a fully deuterated sample of the nematic liquid crystal para-azoxyanisole (PAA) were reported. In the present paper a number of simple ideas which contribute to an understanding of these data are presented. It is shown that part of the structure of the observed diffraction patterns can be attributed to the wavelength dependence of a molecular form-factor. Further, it is found that diffuse scattering observed in PAA just below its melting point may be explained in terms of oscillations of molecules about their long axes. The temperature dependence of this diffuse scattering suggests that the melting of PAA may be driven by a soft torsional mode or modes. The explanation of the diffuse scattering from the solid and the similarities between the diffraction patterns of solid and nematic phases suggest that scattering from the nematic phase might be explicable in terms of hindered rotations of molecules about their long axes. A simple model based on this hypothesis and on the neglect of short-range orientational correlations of the molecular long axes is proposed. A comparison of results obtained from this model with the experimental data demonstrates that there is considerable short-range ordering of the long molecular axes in both the nematic and isotropic-liquid phases of PAA.