一维等离子体光子晶体的带隙研究

采用时域有限差分方法(FDTD),结合等离子体计算中的分段线性电流密度卷积技术(PLJERC)对一维等离子体光子晶体(1D-PPC)进行了数值模拟,给出了微分高斯脉冲在一维等离子体光子晶体中的传播过程。计算得到的带隙结构与K-P模型方法的结果一致。计算并分析了等离子体频率、介质介电常数、等离子体-介质层的厚度比以及周期厚度对一维等离子体光子晶体带隙结构的影响。     

主客观相结合眼波面像差分析系统

利用Hartmann-Shack波面传感器对眼出瞳位置的波面像差进行测量,根据所测像差控制可变形镜对像差进行实时补偿.眼像差以Zernike多项式表示,通过对可变形镜的精确控制,可在光路中生成特定模式和幅值的像差.因此,被测者根据视觉的主观感觉,调节视标像差,直至获得最满意的视觉效果.该系统采用移动三棱镜和柱镜的方法对离焦和散光进行预补偿,弥补了波面传感器测量范围和可变形镜矫正范围受限制的缺点.该系统把快速、客观的测量及补偿和主观调整相结合,更加符合人眼工作的特性,可用于在人眼像差与视觉分辩的基础和临床研究.     

鱼藤中抗肿瘤活性化合物的追踪分离及与DNA的相互作用

采用活性追踪分离的方法, 从鱼藤中分离鉴定出了2个抗肿瘤活性化合物, 即羟基鱼藤素(1)和鱼藤酮(2). 用丽丝胺罗丹明B(SRB)法评价其抗肿瘤活性, 用紫外光谱和荧光光谱等方法探讨了化合物与DNA的相互作用. 结果发现, 羟基鱼藤素(1)与鱼藤酮(2)为鱼藤的抗肿瘤活性成分, 对人大肠癌细胞HCT8、人肝癌细胞BEL7402、人胃癌细胞BGC823、人肺癌细胞A549和人卵巢癌细胞A2780的半数抑制浓度(IC₅₀) 在0.1~90.0 μmol/L之间. 这两种化合物的紫外吸收强度随着HS-DNA的加入均呈现减色效应, 并使EB-HS-DNA复合体系荧光强度减弱, 表明化合物的抗肿瘤活性与DNA以插入方式作用有关.     

算法融合的差分吸收光谱法烟气SO2浓度在线监测研究

过去几十年中差分吸收光谱技术(differential optical absorption spectroscopy,DOAS)在大气污染物监测方面取得了成功应用.文章提出了根据差分吸光度最大值(OD'm)设定阈值的思想,将传统DOAS算法与基于卡尔曼滤波的DOAS算法相结合,利用两种算法在相同信噪比下具有不同反演精度的特点,在保证测量精度的前提下提高了DOAS系统的检测极限,较好地解决了短光程下低浓度气体的测量精度问题.在常温常压和流动状态下,对烟气中的SO2浓度测量进行了理论和实验研究.研究结果表明,改进的DOAS算法在OD'm＜0.048 1时,SO2浓度测量精度较高,测量下限可低于28.6 mg·m-3,零点漂移低于2.9 mg·m-3传统DOAS算法在0.048 1＜OD'm＜0.927 2时,SO2浓度测量精度较高;两种算法对OD'm＞0.927 2时的SO2浓度测量都存在较大的误差,必须进行线性度校正.     

Nd:Y3Al5O12单晶及纳米粉体的Raman光谱分析

测量了YAG(Y3Al5O12)/Nd:YAG单晶、Nd:YAG前驱物及其在不同温度下煅烧获得粉体的拉曼光谱,对谱峰的振动模式进行了指认,对结果进行了分析.Nd:YAG前驱物在煅烧时,有一个由非晶态向晶态的转化过程;700℃下烧结前驱物获得非晶态产物的结构中含有AlO4四面体结构;随着煅烧温度的升高,拉曼光谱的变化主要表现在两个方面:一是谱峰半高宽(FWHM)减小,谱峰强度增大;二是一些拉曼光谱谱峰发生了频移,这是纳米多晶粉体的界面组元的有序度提高所致.另外,800℃下煅烧获得的Nd:YAG纳米粉体的品格振动模式与Nd:YAG晶体的晶格振动模式存在差异,这是纳米多晶粉体的界面组元的贡献所致.     

激光入射角对干涉带通滤光片输出性能的影响

利用红外光谱分析技术,研究了激光入射角度对干涉带通滤光片输出性能的影响。激光入射角的变化对滤光片的峰值波长、峰值透过率等性能参数具有明显的影响;分析了中红外滤光片对3.8μm波段激光的透射性能,给出了滤光片的输出特性与入射激光角度的变化关系。     

Synthesis,Crystal Structure,and Biological Activity of 4-Chlorobenzaldehyde (2-trifluoromethylTrifluoromethyl-5,6,7,8-tetrahydrobenzo[4 ,5]-thieno[2,3-d]pyrimidin-4-yl)hydrazone Monohydrate

The novel title compound 4-chlorobenzaldehyde (2-trifluoromethyl-5,6,7,8- tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)hydrazone monohydrate (C18H14ClF3N4SH2O, Mr = 428.86) has been synthesized by a condensation reaction of 4-chlorobenzaldehyde with (2-trifluoromethyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)hydrazine, and its crystal structure was determined by single-crystal X-ray diffraction. The crystal belongs to monoclinic, space group P21/c with a = 7.4252(7), b = 26.344(2), c = 10.3095(9) , = 109.407(2)°, V = 1902.0(3) 3 , Z = 4, Dc = 1.498 g/cm3 , μ = 0.356 mm-1 , F(000) = 880, the final R = 0.0564 and wR = 0.1681 for 2343 observed reflections with I > 2 (I). X-ray diffraction analysis reveals that the title hydrazone molecule is nearly planar except for the cyclohexene and trifluoromethyl moieties. In the crystal packing, the molecules form stacks by a three-dimensional framework, which results from intermolecular N(3)-H(3)···O(1), O(1)-H(1B)···N(2), O(1)- H(1B)···N(4) and O(1)-H(1A)···F(1) hydrogen bonds via water molecules together with π-π stacking interactions. Molecular geometry of the title compound in the ground state optimized by B3LYP functional with 6-311G** basis sets indicates that the calculations are in agreement with the experimental data. The preliminary bioassay suggested that the title compound exhibits relatively good fungicidal activity against Fusarium oxysporium f.sp.vasinfectum and Dothiorella gregaria.     

Polar electro-optic switching in droplets of an achiral nematic liquid crystal

A polar electro-optic response is observed in droplets of an achiral nematic liquid crystal in coexistence with the isotropic phase. Between crossed polarizers each pancake-shaped droplet shows extinction brushes in the form of a centred cross aligned with the polarizer axes. An applied electric field E induces a rotation of the crosses about the field direction, with about half the droplets switching clockwise and the other half anticlockwise. The sense of rotation in each droplet changes when E is reversed. We propose that a twisted bipolar director structure is stabilized in the droplets by a relatively large splay elastic constant and tangential boundary conditions. The molecules twist along the diameter of the droplets, perpendicular to the applied field, which results in a linear rotation of the director by the inverse flexoelectric effect. Since the molecules are achiral, the handedness of the twist, and hence the sense of the switching, in any droplet is arbitrary.     

基于实际路网情境的配送车辆调度优化

在实际路网情境下结合车道数、车道宽度、路口信号灯设置等路网物理特性,构建了考虑综合交通阻抗的多车型车辆调度模型,提出了两阶段求解策略:第1阶段设计了改进A-star精确解算法用于计算客户时间距离矩阵;第2阶段针对实际路网的特征设计了混合模拟退火算法求解调度方案。以大连市某配送中心运营实例进行路网情境仿真试验,结果表明:改进A-star算法较改进Dijkstra算法具有更短的路径搜索时间;混合模拟退火算法求解结果较实际调度方案优化了13.1% 的综合成本;路网增流、区域拥堵和路段禁行三类路网情境均能对配送方案的车辆配置、路径选择、客户服务次序、作业时间和违约费用等5方面内容产生干扰,调度计划的制定需要详细考虑这些因素的变化。     

Modified two-grid method for solving coupled Navier-Stokes/Darcy model based on Newton iteration

A new decoupled two-gird algorithm with the Newton iteration is proposed for solving the coupled Navier-Stokes/Darcy model which describes a fluid flow filtrating through porous media. Moreover the err...