Application of norm-conserving pseudopotentials to intense laser-matter interactions

被引:17
作者
Tong, Xiao-Min [1 ,2 ]
Wachter, Georg [3 ]
Sato, Shunsuke A. [2 ]
Lemell, Christoph [3 ]
Yabana, Kazuhiro [1 ,2 ]
Burgdoerfer, Joachim [3 ]
机构
[1] Univ Tsukuba, Ctr Computat Sci, Tsukuba, Ibaraki 3058577, Japan
[2] Univ Tsukuba, Grad Sch Pure & Appl Sci, Tsukuba, Ibaraki 3058571, Japan
[3] Vienna Univ Technol, Inst Theoret Phys, A-1040 Vienna, Austria
来源
PHYSICAL REVIEW A | 2015年 / 92卷 / 04期
基金
日本学术振兴会;
关键词
ORDER HARMONIC-GENERATION; DENSITY-FUNCTIONAL THEORY; NONSEQUENTIAL DOUBLE-IONIZATION; FIELD DOUBLE-IONIZATION; ELECTRONIC-STRUCTURE; ATOMS; PHOTOIONIZATION; APPROXIMATION; DISTRIBUTIONS; HELIUM;
D O I
10.1103/PhysRevA.92.043422
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
We investigate the applicability of norm-conserving pseudopotentials to intense laser-matter interactions by performing time-dependent density functional theory simulations with an all-electron potential and with norm-conserving pseudopotentials. We find pseudopotentials to be reliable for the simulation of above-threshold ionization over a broad range of laser intensities both for the total ionization probability and the photoelectron energy spectrum. For the simulation of high-order-harmonic generation, pseudopotentials are shown to be applicable for lower-order harmonics in the spectral range in which the one-photon recombination dipole-matrix element can be recovered by the pseudopotential calculation.
引用
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页数:9
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