期刊
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS
卷 52, 期 7, 页码 -出版社
IOP PUBLISHING LTD
DOI: 10.1088/1361-6455/aafeb3
关键词
atoms and ions collision; quantum-mechanical molecular-orbital close-coupling; potential curves; pseudo state; MRD-CI method
资金
- National Key Research and Development Program of China [2017YFA0402300]
- National Natural Science Foundation of China [11774344, 11474033, 11574326]
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.
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