溶液自由基ESR谱的计算机模拟

根据溶液自由基电子自旋共振(ESR)原理,用高级BASIC语言编写了溶液自由基谱的模拟程序。自由基的ESR能级用一级近似求解,谱线的线型采用洛仑兹和高斯型的混合线型函数,程序规定体系中核自旋量子数可从1/2到7/2,不等性核的数目最多可达10组,每组中等性核的数目原则上不受限制。通过二萘嵌苯阳离子自由基和硝基苯负离子自由基谱模拟二个例子加以说明,模拟结果是满意的。     

Structure and switching of single-stranded DNA tethered to a charged nanoparticle surface

Using a molecular theory, we investigate the temperature-dependent self-assembly of single-stranded DNA(ss DNA)tethered to a charged nanoparticle surface. Here the size, conformations, and charge properties of ss DNA are taken into account. The main results are as follows: i) when the temperature is lower than the critical switching temperature, the ss DNA will collapse due to the existence of electrostatic interaction between ss DNA and charged nanoparticle surface; ii)for the short ss DNA chains with the number of bases less than 10, the switching of ss DNA cannot happen, and the critical temperature does not exist; iii) when the temperature increases, the electrostatic attractive interaction between ss DNA and charged nanoparticle surface becomes weak dramatically, and ss DNA chains will stretch if the electrostatic attractive interaction is insufficient to overcome the elastic energy of ss DNA and the electrostatic repulsion energy. These findings accord well with the experimental observations. It is predicted that the switching of ss DNA will not happen if the grafting densities are too high.     

分辨率对大气中痕量污染气体的DOAS测量性能影响研究

在差分吸收光谱(DOAS)测量过程中,光谱分辨率的选择直接决定了污染气体浓度的测量准确度.主要研究了光谱分辨率对污染气体被榆测到的特征吸收结构形状的影响,以及差分吸收截面随分辨率的变化趋势,从而确定了光谱分辨率对污染气体最低可检测浓度的影响,通过研究分辨率与光强的关系,确定了分辨率与信噪比(S/N)的函数关系式,得出了DOAS测量NO2,O3,和SO2的最佳信噪比范围,对多种污染物标准气体进行了同时监测,计算出标准气体在不同光谱分辨率下的测量误差,确定了对NO2,O3和SO2监测的最适用的分辨率范围.在此分辨率范围既能够实现对痕量气体的准确定性定量测量,又能达到测量所需要的高灵敏度,强选择性和适用的时间分辨率.通过在北京丰台区的实际监测得到了与点式仪器测量结果很好的一致性.     

Transverse Zeeman background correction method for air mercury measurement

By utilizing a natural mercury lamp, the transverse Zeeman background correction method, which is used for trace mercury measurement in air, is studied. In this paper, a natural mercury lamp is used as a light source, and is placed in a 1.78-T magnetic field. The lamp emits two linearly polarized light beams σ± and π of 253.65-nm resonance line, which are used as bias light and absorbing light, respectively. A polarization modulation system is used to allow σ± and π light beams to pass through alternately with a certain frequency. A multipath optical cell with 12-m optical path is used to increase optical distance. Based on the system described above, the influence caused by UV absorbing gases, such as NO2, SO2, acetone, benzene, and O3, is analyzed. The results show that it may reduce the detection limit when the concentrations of these gases exceed 83.4 ppm, 20.3 ppm, 142.3 ppm, 0.85 ppm, and 0.55 ppm, respectively. The detection limit of the system is calculated and can achieve up to 1.44 ng/m3 in 10 minutes. Measurements on mercury sample gas and air are carded out, and the measured data are compared with the data of RA-915 mercury analyzer （Russia）. The result shows that the correlation coefficient reaches up to 0.967. The experimental results indicate that the transverse Zeeman background correction method can be used to quantify trace mercury in air with high-precision.     

旋转孔径散斑照相法用于动态三维位移场的研测

采用两套旋转孔径散斑照相系统对动态三维位移场进行了研测。一次实验可把缓慢连续变形体的动态三维位移场的整个变化过程记录于两张散斑图上．对散斑图进行全场滤波可摄取所有各时刻的三个位移分量的信息。     

云层对卫星遥感大气CO的影响与修正方法研究

研究云层对卫星遥感大气CO精度的影响,并以SCIAMACHY观测为例,详细论述一种云层影响的修正方法。修正过程中,采用朗伯云模型,全面考虑云层覆盖率、云顶高度和地面反射率的影响。将云层影响修正前后的卫星CO反演结果与地基FTIR测量值进行对比,发现修正云层影响后,两者的测量相关性明显提高。实验结果表明,提出的云层影响修正方法可明显提高卫星遥感大气CO的精度。     

研测动态热形变的旋转孔径白光散斑照相法

本文首次提出利用转孔法进行白光散斑照相,研测动态热形变.全部动态过程可记录在一张散斑图上,且在全场滤波分析时可连续地再现出来.     

高温条件下材料固体桥力的测量

本文搭建了高温条件下材料固体桥力的测量系统,该系统最高温度可达1600℃,可测量材料在不同温度、压力及接触时间下的固体桥力。本文中采用玻璃为固体材料,对其熔点附近温度范围内的固体桥力进行了测量。实验结果显示,材料抗拉强度及脖颈抗拉强度均随着温度的升高而减小;通过与常温石蜡材料所获得的固体桥力计算公式进行对比,二者在数量级上相符合,绝对值偏差不超过38%,且明显优于传统的固体桥力估算方法。     

蒸汽活化提高脱硫剂钙利用率的实验研究

本文用小型热态流化床实验台对以ＣａＯ为主要成分的钙基脱硫剂石灰乏吸收剂在１５０～６００℃的温度范围内进行了蒸汽活化处理,进而实验研究了这种处理对提高脱硫剂钙利用率的效果。结合化学成分分析和Ｘ射线衍射的结果初步探讨了蒸汽活化的机理。研究表明,脱硫剂对水蒸汽的物理吸附明显受活化温度的影响,蒸汽活化后的钙利用率提高显著,可能存在一个最佳活化时间。     

重方法，求效益：活用函数与方程思想

函数与方程思想是四大数学思想之一,也是高考中的重要考点之一.在解决一些非函数与方程问题时,借助函数或方程的转化,将不等式、数列、三角函数、平面向量、解析几何与立体几何等相关问题转化为对应的函数或方程问题,实现化归与转化,进而利用函数或方程来分析与求解,引领并指导复习备考.