1-碘丙烷分子的电子动量谱学研究：自旋-轨道耦合效应与分子内轨道相互作用

利用不对称不共面电子动量谱仪,在2.5 keV碰撞能量下,采用高精度的SAC-CI方法计算了1-碘丙烷分子束缚能谱,同时采用Hartree-Fock、B3LYP/aug-cc-pVTZ(C,H)6-311G^**(I)方法计算其电子动量分布. 并对电离能峰进行了标示. 结合非相对论与相对论计算方法以及自然键轨道分析,对最外层两个轨道(碘的5p孤对)的自旋-轨道耦合效应与分子内轨道相互作用进行了比较. 两种相互作用对电子动量分布的不同影响是可观的. 实验结果与相对论计算的结果一致,表明1-碘丙烷分子内自旋-轨道耦合效应占主导.     

空间低能离子探测器的紫外响应测试

在空间离子探测过程中,太阳紫外光也会进入探测器产生光污染信号。为了考察它对离子探测的影响,搭建了一套模拟太阳紫外光污染的地面测试系统,并对自主研制的空间低能离子探测器原理样机进行了紫外响应测试。实验结果表明:沿水平方向进入分析器的紫外光响应可以忽略,而以一定倾斜角进入分析器的紫外光响应计数率约为102~ 103 s−1。根据测试结果,估算出探测器对太阳紫外光的抑制率约为10−8,分析了紫外光污染对探测空间低能离子如质子和 粒子的影响。对于质子,由于其通量大,紫外光的影响不大。而对于通量较小的 粒子,紫外光的影响较大,需要进一步采取有效措施进行抑制。此外,本测试系统可以推广到其它空间粒子探测器的太阳紫外光污染的地面模拟测试。In the detection of space ions, solar ultraviolet (UV) can also enter the detector and generate a noise to the signal of ions. A testing system on the ground is built to test the UV response of detector. Experiments on a home-made principle prototype of space low-energy ion detector are carried out by using this system. The results show that the response of detector to the UV entering the electrostatic analyzer along the horizontal direction can be negligible and counts of the response to the UV along a bias direction are about 102 ~103 s−1. According to the measured results, the UV suppression ratio is estimated to be about 10−8 and the inuence of solar UV on the detection of space low-energy ions such as proton and alpha particle has been analyzed. For proton, the inuence is insigni cant due to its high ux. But for the low ux alpha particle, the inuence of solar UV is noticeable and further rejection is needed. In addition, this system can also be applied to test the UV response of other space particle detectors.     

2-氟乙醇分子外价轨道的电子动量谱学

利用不共面不对称(e,2e)谱仪测量了2-氟乙醇分子外价分子轨道的束缚能谱和电子动量分布,并用外价格林函数方法和密度泛函理论计算了分子的电离能和轨道波函数. 通过理论计算与实验结果的比较,明确标识了实验测量的电离能谱. 考虑了2-氟乙醇分子五种异构体的玻尔兹曼热力学统计权重后,理论计算的电子动量分布能够较好地解释实验测量结果.