物理学报2018，Vol.67Issue(1)：41-50,10.DOI:10.7498/aps.67.20171817
相对论多组态相互作用方法计算Mg+离子同位素位移
Calculationof isotope shift of Mg+ ion by using the relativistic multi-configuration interaction method
摘要
Abstract
The special mass shift coefficients and field shift factors for the atomic transitions 3s2S1/2–3s2P1/2 and 3s2S1/2–3s2P3/2 of Mg+ ion are calculated by the relativistic multi-configuration interaction method, and the isotope shifts are also ob-tained for the Mg+ isotopes with the neutron numbers 8 ≤ N ≤ 20. Our calculations are carried out by using the GRASP2 K package together with the relativistic isotope shift computation code package RIS3. In our calculations the nuclear charge distribution is described by the two-parameter Fermi model and the field shifts are calculated by the first-order perturbation. In order to generate the active configurations, a restricted double excitation mode is used here, the electron in the 3s shell (3s1) is chosen to be excited, another electron is excited from the 2s or 2p shells (2s22p6), and the two electrons in the inner 1s shell (1s2) are not excited. The active configurations are expanded from the occupied orbitals to some active sets layer by layer, each correlation layer is labeled by the principal quantum number n and contains the corresponding orbitals s, p, d … etc. The maximum principal quantum number n is 6 and the largest orbital quantum number lmax is g. According to our calculations, the normal mass shift coefficients are-586.99 GHz·amu and -588.50 GHz·amu, the special mass shift coefficients are -371.90 GHz·amu and -371.95 GHz·amu, the field shift factors are -117.10 MHz·fm-2 and -117.18 MHz·fm-2 for the 3s2S1/2-3s 2P1/2 and the 3s2S1/2-3s2P3/2 transitions of Mg+ ions, respectively. Then the isotope shifts for different Mg+ isotopes are obtained using the available data of the nuclear mass and the nuclear charge radii. Our results are coincident with other theoretical calculations and also with experimental results. The relative errors of our calculations are in a range from 0.13％to 0.28％compared with the latest measurements. Our calculations are the most consistent with the experimental measurements for the moment. The results provided here in this paper could be referred to for the experimental and theoretical study of Mg+ isotope shift, and they could be applied to the spectral measurement experiments of the short-lived Mg+ isotopes and also used for the research of the characteristics of exotic nuclei with Mg+ isotopes near the magic neutron numbers N = 8 and N = 20. The calculation method and the excitation mode used here could also be extended to other multi-electron systems with eleven orbital electrons, and the corresponding theoretical studies of the atomic spectral structures and isotope shifts could then be carried out.关键词
同位素位移/组态相互作用/轨道波函数/镁离子Key words
isotope shift/configuration interaction/orbital wave function/magnesium ion引用本文复制引用
余庚华,颜辉,高当丽,赵朋义,刘鸿,朱晓玲,杨维..相对论多组态相互作用方法计算Mg+离子同位素位移[J].物理学报,2018,67(1):41-50,10.基金项目
国家自然科学基金(批准号:11304093, 11604253)、陕西省青年科技新星项目(批准号:2015KJXX-33)、四川省教育厅科研基金(批准号:14ZB0375)和广东省量子调控工程与材料重点实验室开放基金(批准号:00201607)资助的课题.Project supported by the National Natural Science Foundations of China(Grant Nos.11304093, 11604253), the Plan Project of Youth Science and Technology New Star of Shaanxi Province, China(Grant No.2015KJXX-33), the Fund of the Scientific Research Foundation of Sichuan Provincial Department of Education, China(Grant No.14ZB0375)and the Open Fund of Guangdong Provincial Key Laboratory of Quantum Engineering and Quantum Materials, China(Grant No.00201607). （批准号:11304093, 11604253）
