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High-order harmonic generation by static coherent states method in single-electron atomic and molecular systems

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Eidi,  Mohammadreza
Max Planck Institute for the Physics of Complex Systems, Max Planck Society;

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Koochaki Kelardeh,  Hamed
Max Planck Institute for the Physics of Complex Systems, Max Planck Society;

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1910.03885.pdf
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Citation

Eidi, M., Vafaee, M., Koochaki Kelardeh, H., & Landsman, A. (2021). High-order harmonic generation by static coherent states method in single-electron atomic and molecular systems. Journal of Computational Chemistry, 24(18), 1312-1320. doi:10.1002/jcc.26549.


Cite as: https://hdl.handle.net/21.11116/0000-0008-947A-8
Abstract
We solve the time-dependent Schrodinger equation using the coherent states as basis sets for computing high harmonic generation (HHG) in a full-dimensional single-electron "realistic" system. We apply the static coherent states (SCS) method to investigate HHG in the hydrogen molecular ion induced by a linearly polarized laser field. We show that SCS gives reasonable agreement compared to the three dimensional unitary split-operator approach. Next, we study isolated attosecond pulse generation in H2+. To do so, we employ the well-known polarization gating technique, which combines two delayed counter-rotating circular laser pulses, and opens up a gate at the central portion of the superposed pulse. Our results suggest that the SCS method can be used for full-dimensional quantum simulation of higher dimensional systems such as the hydrogen molecule in the presence of an external laser field.