The influence of pseudo states on the single-electron capture processes in low-energy collisions of N5+ with He

被引:6
|
作者
Wang, K. [1 ]
Qu, Y. Z. [1 ]
Liu, C. H. [2 ]
Liu, L. [3 ]
Wu, Y. [3 ]
Liebermann, H-P [4 ]
Buenker, R. J. [4 ]
机构
[1] Univ Chinese Acad Sci, Coll Mat Sci & Optoelect Technol, Beijing 100049, Peoples R China
[2] Southeast Univ, Sch Phys, Nanjing 210094, Jiangsu, Peoples R China
[3] Inst Appl Phys & Computat Math, Data Ctr High Energy Dens Phys, Beijing 100088, Peoples R China
[4] Berg Univ Wuppertal, Fachbereich Math & Nat Wissensch C, D-42097 Wuppertal, Germany
基金
中国国家自然科学基金;
关键词
atoms and ions collision; quantum-mechanical molecular-orbital close-coupling; potential curves; pseudo state; MRD-CI method; CORRELATED MOLECULAR CALCULATIONS; GAUSSIAN-BASIS SETS; CHARGE-TRANSFER; CI CALCULATIONS; IONS;
D O I
10.1088/1361-6455/aafeb3
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
The nonradiative single-electron capture (SEC) processes for N5+(1s(2)) colliding with He atoms are investigated by using the quantum-mechanical molecular-orbital close-coupling method. Total and state-selective SEC cross sections are obtained in the energy range of 3-1700 eV amu(-1), for which the ab initio potential curves and nonadiabatic coupling matrix elements (involving physical and pseudo states) are computed by using the multireference single-and double-excitation configuration-interaction method. It is found that the pseudo states are also important to obtain the convergent results, especially in the low-energy region. Moreover, our results indicate that the n = 3 states are the dominant states in the considered energy region, and that the electron translation factor effects become important when the energy is above 1 keV amu(-1). In addition, it is observed that the total and state-selective cross sections for SEC are in general agreement with all available experimental data.
引用
收藏
页数:9
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