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Quantum Chemistry
Effects of inner electrons on atomic strong-field ionization dynamics
arXiv
Authors: J. Rapp, D. Bauer
Year
2013
Paper ID
32292
Status
Preprint
Abstract Read
~2 min
Abstract Words
133
Citations
N/A
Abstract
The influence of inner electrons on the ionization dynamics in strong laser fields is investigated in a wavelength regime where the inner electron dynamics is usually assumed to be negligible. The role of inner electrons is of particular interest for the application of frozen-core approximations and pseudopotentials in time-dependent density functional theory (TDDFT) and the single-active-electron (SAE) approximation in strong-field laser physics. Results of TDDFT and SAE calculations are compared with exact ones obtained by the numerical ab initio solution of the three-electron time-dependent Schrödinger equation for a lithium model atom. It is found that dynamical anti-screening, i.e., a particular form of dynamical core polarization, may substantially alter the ionization rate in the single-photon regime. Requirements for the validity of the approximations in the single and multiphoton ionization domain are identified.
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- The influence of inner electrons on the ionization dynamics in strong laser fields is investigated in a wavelength regime where the inner electron dynamics is usually assumed...
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