脱水KFI沸石中钾离子分布的模拟退火研究

基于四个固定的参量设值：阳离子位能差E_M2-E_M1=25.50 kJ/mol、 E_M3-E_M1=-10.73 kJ/mol和最近邻阳离子对互作用能W₁₂=45.6 kJ/mol、 W₁₄=0.56 kJ/mol以及一个温度依赖的参量E_M4-E<     

Fast quantitative detection of cocaine in beverages using nanoextractive electrospray ionization tandem mass spectrometry

Without any sample pretreatment, effervescent beverage fluids were manually sprayed into the primary ion plume created by using a nanoelectrospray ionization source for direct ionization, and the analyte ions of interest were guided into an ion trap mass spectrometer for tandem mass analysis. Functional ingredients (e.g., vitamins, taurine, and caffeine, etc.) and spiked impurity (e.g., cocaine) in various beverages, such as Red Bull energy drink, Coco-cola, and Pepsi samples were rapidly identified within 1.5 s. The limit of detection was found to be 7 ∼ 15 fg (S/N = 3) for cocaine in different samples using the characteristic fragment (m/z 150) observed in the MS³ experiments. Typical relative standard deviation and recovery of this method were 6.9% ∼ 8.6% and 104% ∼ 108% for direct analysis of three actual samples, showing that nanoextractive electrospray ionization tandem mass spectrometry is a useful technique for fast screening cocaine presence in beverages.     

表面解吸常压化学电离质谱法直接分析牙齿微区表面

采用纳升取样表面解吸常压化学电离质谱法(nano-SDAPCI-MS)结合主成分分析(PCA),建立了一种采用具有微米级针尖的金属取样针直接对龋齿不同部位取样并进行快速质谱分析的方法.数据分析结果表明,同一颗龋齿不同部位的质谱指纹谱图之间存在差异;在不需要样品预处理的前提下通过串联质谱快速测定了龋齿中的乳酸、丙酮酸、苯乙酸和丙酸等成分.采用PCA方法可较好地将龋齿病灶位置与邻近正常组织进行区分,也可对不同牙病及健康牙齿进行区分.本方法可方便地对牙齿进行直接微区分析,为鉴别牙齿疾病及观测治疗效果提供了一种快速、简单的方法,为生物体中微细部位的快速取样及直接质谱分析提供了一种可能的解决方案.     

Differences of thermal decomposition behaviors and combustion properties between CL-20-based propellants and HMX-based solid propellants

Journal of Thermal Analysis and Calorimetry - Differences of thermal decomposition characteristics and combustion properties between CL-20-based propellants and HMX-based propellants were...     

First principle study on the electronic structure of fluorine-doped SnO2

The electronic properties of fluorine-doped SnO₂ films were calculated using the plane-wave-based pseudopotential method based on the density functional theory within the local density approximation. The calculated band structure and density of states show that the band gap of SnO₂ narrows due to the presence of the F impurity energy levels in the bottom of the conduction band. The energy of the valence electrons is reduced as the optical absorption edge shifts towards a higher frequency. The charge density and effective masses of carriers of fluorine-doped SnO₂ were also calculated.     

Multichannel double-polarization bandpass optical filter utilizing evanescent wave

A multichannel double-polarization bandpass optical filter, which has the performance of variable channel interval, is theoretically proposed. The filter consists of a stack of two one-dimensional photonic crystals (1D PCs). Based on the resonant couple of evanescent waves localized at the interfaces between neighboring layers, the linear transmission properties of the filter are numerically simulated by the transfer matrix method. The simulation results show that channel number of the filter can be changed by varying the thickness of the middle layer in the centrosymmetric 1D PC structure, while the bandwidth and wavelength of the channel can be adjusted by the incident angle of light. This work may be helpful in designing multichannel double-polarization bandpass optical filter in optical communication systems.     

单片机在牙齿光学检测中的应用

本文论述了8031单片机在牙齿光学检测系统中所起的作用。并描述了牙齿活力和脱钙的检测方法。这种方法,是通过对牙齿表面磷光或反射光的客观测量来实现的。从而,解决了以前人们曾不能解决的问题。     

牙齿磷光检测技术研究

本文分析了牙齿磷光测量技术一直不能进一步发展的原因,提出了一种新的检测技术。这种技术利用光纤传输紫外光和磷光,利用光电接收器作为传感器,解决了牙齿磷光现象一直不能定量分析的问题,使得牙齿磷光现象与牙齿疾病之间关系的研究得到了进一步的发展。