中国物理B ›› 2017, Vol. 26 ›› Issue (8): 83101-083101.doi: 10.1088/1674-1056/26/8/083101

• ATOMIC AND MOLECULAR PHYSICS • 上一篇    下一篇

A numerical Hartree self-consistent field calculation of an autoionization resonance parameters for a doubly excited 2s2, 3s2, and 4s2 states of He atom with a complex absorbing potential

Tsogbayar Tsednee, Danny L Yeager   

  1. Department of Chemistry, Texas A & M University, College Station, TX 77843, USA
  • 收稿日期:2017-02-03 修回日期:2017-03-27 出版日期:2017-08-05 发布日期:2017-08-05
  • 通讯作者: Tsogbayar Tsednee E-mail:tsogbayar.tsednee@tamu.edu

A numerical Hartree self-consistent field calculation of an autoionization resonance parameters for a doubly excited 2s2, 3s2, and 4s2 states of He atom with a complex absorbing potential

Tsogbayar Tsednee, Danny L Yeager   

  1. Department of Chemistry, Texas A & M University, College Station, TX 77843, USA
  • Received:2017-02-03 Revised:2017-03-27 Online:2017-08-05 Published:2017-08-05
  • Contact: Tsogbayar Tsednee E-mail:tsogbayar.tsednee@tamu.edu
  • About author:0.1088/1674-1056/26/8/

摘要:

The self-consistent Hartree-Fock equation for the He atom is solved using the pseudospectral method. The Feshbach-type autoionization resonance parameters for doubly excited 2s2, 3s2, and 4s2 1S states of He have been determined by adding a complex absorbing potential to the Hamiltonian. The Riss-Meyer iterative and Padé extrapolation methods are applied to obtain reliable values for the autoionization resonance parameters, which are compared to previous results in the literature.

关键词: self-consistent field, Hartree-Fock equation, helium autoionization, pseudospectral method

Abstract:

The self-consistent Hartree-Fock equation for the He atom is solved using the pseudospectral method. The Feshbach-type autoionization resonance parameters for doubly excited 2s2, 3s2, and 4s2 1S states of He have been determined by adding a complex absorbing potential to the Hamiltonian. The Riss-Meyer iterative and Padé extrapolation methods are applied to obtain reliable values for the autoionization resonance parameters, which are compared to previous results in the literature.

Key words: self-consistent field, Hartree-Fock equation, helium autoionization, pseudospectral method

中图分类号:  (Theory of electronic structure, electronic transitions, and chemical binding)

  • 31.10.+z
31.15.xr (Self-consistent-field methods) 32.80.Zb (Autoionization)