连续激光辐照ZnSe/MgF2/K9滤光片的透射特性研究

分析了连续激光辐照ZnSe/MgF2/K9滤光片引起透射特性的变化。在室温条件下,用波长0.632 8μm激光作为探测光束,测量了1.06μm连续激光辐照ZnSe/MgF2/K9滤光片温升引起薄膜折射率的改变,导致探测光束通过干涉滤光片后透过率的热致非线性变化。在光斑直径0.75mm条件下,测量了不同功率激光辐照ZnSe/MgF2/K9滤光片引起温升随时间的变化。在激光功率30W,辐照时间2.52s条件下,实验观测到ZnSe/MgF2/K9滤光片薄膜破坏温度约为90℃,辐照时间10s时干涉滤光片形成的薄膜龟裂形貌。     

In vitro metabolism study of Strychnos alkaloids using high‐performance liquid chromatography combined with hybrid ion trap/time‐of‐flight mass spectrometry

In this report, the in vitro metabolism of Strychnos alkaloids was investigated using liquid chromatography/high‐resolution mass spectrometry for the first time. Strychnine and brucine were selected as model compounds to determine the universal biotransformations of the Strychnos alkaloids in rat liver microsomes. The incubation mixtures were separated by a bidentate‐C₁₈ column, and then analyzed by on‐line ion trap/time‐of‐flight mass spectrometry. With the assistance of mass defect filtering technique, full‐scan accurate mass datasets were processed for the discovery of the related metabolites. The structural elucidations of these metabolites were achieved by comparing the changes in accurate molecular masses, calculating chemical component using Formula Predictor software and defining sites of biotransformation based upon accurate MSⁿ spectral information. As a result, 31 metabolites were identified, of which 26 metabolites were reported for the first time. These biotransformations included hydroxylation, N‐oxidation, epoxidation, methylation, dehydrogenation, de‐methoxylation, O‐demethylation, as well as hydrolysis reactions. Copyright © 2013 John Wiley & Sons, Ltd.     

Some Aspects of Magnetic Filtration Theory for Removal of Fine Particles from Aqueous Suspensions

The magnetic filtration theory was evaluated to intensify the filtration of industrial fluids by magnetic filters. Effects of filtration velocity and external magnetic field intensity on filter performance were investigated and the dependence of the logarithmic efficiency coefficient on filtration velocity was questioned. It was concluded that change in the magnetic susceptibility of the dispersion particles, caused by external magnetic field, and change in the flow rate properties of the liquid alongside the filter pores are the most essential factors to be considered in the design, development, and modeling of magnetic filtration systems in various industrial areas.     

环路跟踪卡尔曼滤波算法的性能分析

基于卡尔曼滤波的环路跟踪算法多是通过一定仿真证明算法性能,没有系统性性能评估,难以较好指导工程应用。在原有算法基础上进行了优化,并系统性地对比分析、评估了基于卡尔曼环路滤波算法性能,以期为算法工程化提供指导。首先提出对跟踪环路反馈调整量进行预测,使之更符合系统实际,减小环路跟踪误差。而后基于卫星信号模拟器输出信号和自生产信号源,充分评估基于卡尔曼滤波环路跟踪算法的收敛时间和灵敏度。仿真结果表明,相比目前工程常用的二阶FFL辅助三阶PLL算法,基于卡尔曼滤波环路跟踪算法能够缩短环路所需稳定时间约90%,并能提升跟踪灵敏度约5 d B,有效改善弱信号场景中接收机输出信息的完好性和连续性。     

Design and characterization of guided mode resonance filters with the improved structure for facile fabrication

In this study, a guided mode resonance filter with the improved structure for facile fabrication is designed; the properties of the designed filters are simulated by rigorous coupled wave analysis. It is found that the resonance wavelength and spectral linewidth are slightly increased with the increasing of the grating thickness, and seldom changed with the thickness of the grating filling factor, as the parameter error of the grating thickness and the grating filling factor are deviated from the designed value by ±10%, respectively, which are very favorable for simplifying preparation process of the GMR filter.     

Metabolite identification of the antimalarial piperaquine in vivo using liquid chromatography–high‐resolution mass spectrometry in combination with multiple data‐mining tools in tandem

Artemisinin‐based combination therapy is widely used for the treatment of uncomplicated Plasmodium falciparum malaria, and piperaquine (PQ) is one of important partner drugs. The pharmacokinetics of PQ is characterized by a low clearance and a large volume of distribution; however, metabolism of PQ has not been thoroughly investigated. In this work, the metabolite profiling of PQ in human and rat was studied using liquid chromatography tandem high‐resolution LTQ‐Orbitrap mass spectrometry (HRMS). The biological samples were pretreated by solid‐phase extraction. Data processes were carried out using multiple data‐mining techniques in tandem, i.e., isotope pattern filter followed by mass defect filter. A total of six metabolites (M1–M6) were identified for PQ in human (plasma and urine) and rat (plasma, urine and bile). Three reported metabolites were also found in this study, which included N‐oxidation (M1, M2) and carboxylic products (M3). The subsequent N‐oxidation of M3 resulted in a new metabolite M4 detected in urine and bile samples. A new metabolic pathway N‐dealkylation was found for PQ in human and rat, leading to two new metabolites (M5 and M6). This study demonstrated that LC‐HRMSⁿ in combination with multiple data‐mining techniques in tandem can be a valuable analytical strategy for rapid metabolite profiling of drugs. Copyright © 2016 John Wiley & Sons, Ltd.     

Chelating 2,2′-Diaminodiethylamine Cellulose Filters and X-ray Fluorescence for Preconcentration and Trace Analysis of Natural Waters

Abstract

The 2,2′-diaminodiethylamine (DEN) functional group can be expected to have ideal properties for the chelation of transition metals and their collection from aqueous solutions, independent of the alkali and alkaline earth ions concentration. Introducing DEN into cellulose filters allows straightforward preconcentration of trace cations by a simple filtration step, and the DEN-filter constitutes a suitable target for X-ray fluorescence (XRF) analysis. The linearity between the XRF-response on the loaded DEN-filter and the trace cation concentration in the solution appears excellent, up to a total filter capacity of ca. 3 μeq.cm^?2. The detection limits are around 0.5 μg. l^?1 in most practical cases. Accuracy and precision are around 10%. The applicability of the proposed procedure is illustrated on a comparative basis by XRF-analysis of drinking water and surface water, after preconcentration by DEN-filtration and by alternative procedures.     

A tunable dual-narrowband band-pass filter using plasma quantum well structure

A tunable dual-narrowband pass-band filter is designed. A one-dimensional photonic crystal(1D PC) is comprised of alternate dielectric layer and vacuum layer. Two quantum wells(QWs) as defects can be constructed by sandwiching two plasma slabs symmetrically in the 1D PC, and a dual-narrowband pass-band filter is formed. The conventional finitedifference time-domain(FDTD) method and piecewise linear current density recursive convolution(PLCDRC)–FDTD method are applied to the dielectric and plasma, respectively. The simulation results illustrate that the dual-narrowband frequencies can be tuned by changing the plasma frequency. The pass band interval and the half-power bandwidths(-3-dB band widths) are related to the space interval between two QWs.     

UV filter 2‐ethylhexyl 4‐methoxycinnamate: a structure,energetic and UV–vis spectral analysis based on density functional theory

2‐Ethylhexyl 4‐methoxycinnamate (EHMC) is a very commonly used UVB filter that is known to isomerize from the (E) to the (Z) isomer in the presence of light. In this study, we have performed high level quantum chemical calculations using density functional theory (DFT) with the B3LYP density functional and extended basis sets to study the gas‐phase molecular structure of EHMC and its energetic stability. Calculations were also performed for related smaller molecules cinnamic acid and 4‐methoxycinnamic acid. Charge delocalization has been analyzed using natural charges and Wiberg bond indexes within the natural bond orbital analysis and using nucleus independent chemical shifts. Density functional theory calculations reveal that the (E) isomer of EHMC is more stable than the (Z) by about 20 kJ mol^?1 in both the gas and aqueous phases. The enthalpy of formation in the gas phase of (E)‐EHMC was derived from an isodesmic bond separation reaction. Long‐range corrected DFT calculations in implicit water were made in order to understand the excited state properties of the (E) and (Z) isomers of EHMC. Copyright © 2013 John Wiley & Sons, Ltd.     

地球静止轨道远程交会过程导航性能评估

远程交会是静止轨道共位卫星自主定点置入的关键途径。针对远程交会过程中大距离跨度下相对运动模型的误差信号特性,理论推导了误差的传递机理,给出了相对导航EKF算法期望及噪声特性的定量分析模型。研究表明,确定距离区间存在最优过程噪声量级及其对应的最优滤波性能,且滤波误差与交会距离正相关,可作为全局最优滤波器的定量设计依据,解决了静止轨道远程交会过程EKF导航算法性能的量化评估问题。仿真表明,分析结论正确,相对速度滤波误差全程优于0.005 m/s(1σ),满足交会任务需求。