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单电子原子和分子系统中基于静态相干态方法的高次谐波产生

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

作者信息

Eidi Mohammadreza, Vafaee Mohsen, Koochaki Kelardeh Hamed, Landsman Alexandra

机构信息

Max Planck Institute for the Physics of Complex Systems, Dresden, Germany.

Department of Chemistry, Tarbiat Modares University, Tehran, Iran.

出版信息

J Comput Chem. 2021 Jul 5;42(18):1312-1320. doi: 10.1002/jcc.26549. Epub 2021 May 7.

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 . 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.

摘要

我们使用相干态作为基组来求解含时薛定谔方程,以计算全维单电子“真实”系统中的高次谐波产生(HHG)。我们应用静态相干态(SCS)方法来研究线偏振激光场诱导的氢分子离子中的高次谐波产生。我们表明,与三维幺正分裂算符方法相比,SCS给出了合理的一致性。接下来,我们研究了[此处原文缺失具体研究对象]中的孤立阿秒脉冲产生。为此,我们采用了著名的偏振门控技术,该技术结合了两个延迟的反向旋转圆偏振激光脉冲,并在叠加脉冲的中心部分打开一个门。我们的结果表明,SCS方法可用于在外部激光场存在的情况下对诸如氢分子等高维系统进行全维量子模拟。

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