Time-dependent density-functional-theory study of the suppressed tunneling ionization of vanadium

被引:4
|
作者
Chu, Xi [1 ]
Groenenboom, Gerrit C. [2 ]
机构
[1] Univ Montana, Dept Chem & Biochem, Missoula, MT 59812 USA
[2] Radboud Univ Nijmegen, Inst Mol & Mat, Heyendaalseweg 135, NL-6525 AJ Nijmegen, Netherlands
基金
美国国家科学基金会;
关键词
SYSTEMS;
D O I
10.1103/PhysRevA.94.053417
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
Using a time-dependent density-functional-theory (TDDFT) method that incorporates the exact exchange, we reproduce the measured ionization suppression for vanadium in 1500-nm lasers of 1.4 to 2.8 x 10(13) W/cm(2). The calculated ionization yields are 0.07 to 0.5 in 100 fs sin(2) pulses. For weaker laser intensities a method with more configurations is needed to properly describe the multiphoton, rather than tunneling, ionization of a transition-metal atom. Our calculations show that the isotropic component of the induced potential increases the binding energy of the electron while the dipole component elevates the potential barrier of tunneling ionization. Both effects suppress the tunneling ionization.
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页数:5
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