Thermodynamic and physical properties of FeAl and Fe3Al: an atomistic study by EAM simulation

With this work we present a newly developed potential for the Fe–Al system, which is based on the analytical embedded atom method (EAM) with long range atomic interactions. The potential yields for the two most relevant phases B2-FeAl and D0₃-Fe₃Al lattice constants, elastic constants, as well as bulk and point defect formation enthalpies, which are in good agreement with experimental and other theoretical data. In addition, the phonon dispersions for B2-FeAl and D0₃-Fe₃Al show a good agreement with available experiments. The calculated lattice constants and formation enthalpy for disordered Fe–Al alloys are in good agreement with experimental data or other theoretical calculations. This indicates that the present EAM potentials of Fe–Al system is suitable for atomistic simulations of structural and kinetic properties for the Fe–Al system.     

Electronic structure and enhanced visible‐light absorption of N,B‐codoped TiO2

We present GGA+U calculations to investigate the electronic structure and visible‐light absorption of N,B‐codoped anatase TiO₂. The N_sB_i (substitutional N, interstitial B) codoped TiO₂ produces significant Ti 3d and N 2p mid‐gap states when the distance of N and B atoms is far, whereas the N_iB_i (interstitial N and B) and N_sB_s (substitutional N and B) codoped TiO₂ prefer to form localized p states at 0.3–1.2 eV above the valence band maximum. Further, the optical band edges of the three codoped systems shift slightly to the visible region, but only the far‐distance N_sB_i codoped TiO₂ clearly shows an optical transition. These results indicate that N_sB_i codoped TiO₂ has a dominant contribution to the optical absorption of N,B‐codoped TiO₂. (© 2012 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim)     

Displacement measurement based on joint fractional Fourier transform correlator

A displacement measurement technology based on joint fractional Fourier transform is firstly proposed. Contrast to conventional displacement measurement based on joint Fourier transform correlator, the position of cross correlation peak in the proposed technology could be fixed arbitrarily according to the order of fractional Fourier transform. The optical setup in the proposed technology is more flexible and easier to implement. Simulation and experiment results are given out to verify the analysis.     

一种混沌密码序列周期特性检测新方法

针对数字混沌密码序列发生器产生的二值序列局部范围内存在的周期特性评价难问题,提出一种新的周期特性分析方法——BSPD(binary sequence’s periodic detection)方法,用于评价二值序列具有的周期特性.该方法除可用于检测二值序列是否存在精确周期,或在部分时域范围内存在周期现象;还可检测出序列局部出现的周期性重叠模板,用于具体分析二值序列中周期现象的统计特征.一个基于经典Logistical映射的BSPD检验表明,该方法可以有效地定位一个类似随机混沌二值序列中蕴含的周期现象.     

油水两相流水包油流型多尺度排列熵分析

采用多尺度排列熵算法研究了垂直油水两相流水包油流型的多尺度动力学特性.首先,在内径为20 mm的垂直管道内采集了油水两相流水包油流型电导传感器波动信号,然后计算了不同流动工况下电导波动信号的多尺度排列熵值.研究发现多尺度排列熵率与均值可定量刻画水包油流型动力学复杂性;此外,提出了通过增量时间序列累积量与多尺度排列熵率联合分布识别三种不同水包油流型的新途径.     

High-order harmonic generation with a two-color laser pulse

We theoretically investigate the electron dynamics of the high-order harmonics generation process by combining a near-infrared 800 nm driving pulse with a mid-infrared 2000 nm control field.We also investigate the emission time of harmonics using time-frequency analysis to illustrate the physical mechanisms of high-order harmonic generation.We calculate the ionization rate using the Ammosov-Delone-Krainov model and interpret the variations in harmonic intensity for different control field strengths and delays.We find that the width of the harmonic plateau can be extended when the control electric field is added,and a supercontinuum from 198 to 435 eV is generated,from which an isolated 61-as pulse can be directly obtained.     

微流控制备单分散微米级SiO2微球

采用软模板法制备出了聚二甲基硅氧烷微流控装置。利用该装置讨论了正硅酸乙酯和氨水的用量分别对反应体系凝胶化时间的影响,确定了制备SiO2微球的优化反应体系,即二甲基乙酰胺、正硅酸乙酯和氨水的体积比为8∶4∶1,实验所需的反应温度为60 ℃。实验发现:在微流体通道中,分散相的流速越大,粒径越大;连续相流速越大,粒径越小。因此,通过控制微流控装置中分散相和连续相的流速制备了粒径40~220 m的单分散SiO2微球,并对其形貌进行表征。光学显微镜和粒径分析均表明所制备的SiO2微球球形度高,单分散性好。     

同步辐射标定闪烁体探测器灵敏度

利用上海同步辐射光源BL13W1光束线开展了闪烁体探测器的灵敏度标定方法的研究。对光源的高次谐波以及闪烁体探测器的工作线性动态范围进行了实验研究,在此基础上建立了一种新的同步辐射标定闪烁体探测器灵敏度的方法。通过对实验结果的理论拟合,得到与放射源方法相符合的灵敏度数据,验证了方法的准确性,提高了标定数据的精度。     

Orientation effects on the bandgap and dispersion behavior of 0.91Pb（Zn_（1/3）Nb_（2/3））O_3-0.09PbTiO_3 single crystals

0.91Pb(Zn_1/3Nb_2/3)O₃--0.09PbTiO₃ (PZN--9%PT) single crystals with different orientations are investigated by using a spectroscopic ellipsometer, and the refractive indices and the extinction coefficients are obtained. The Sellmeier dispersion equations for the refractive indices are obtained by the least square fitting, which can be used to calculate the refractive indices in a low absorption wavelength range. Average Sellmeier oscillator parameters E_o, $\lambda$_o, S_o, and E_d are calculated by fitting with the single-term oscillator equation, which are related directly to the electronic energy band structure. The optical energy bandgaps are obtained from the absorption coefficient spectra. Our results show that the optical properties of [001] and [111] poled crystals are very similar, but quite different from those of the [011] poled crystal.