Abstract:Based on the nonperturbative quantum scattering theory of high-order harmonic generation (HHG) and using the linear combination of atomic orbitals theory of molecular orbitals, we derive the HHG rate formula for molecules. Employing the formula, we study the intensity dependence of the interference effect induced by the molecular structure. We find that the molecular HHG was modulated by the interference not only in the recombination process but also in the ionization process. The location of the interference … Show more
“…For the HHG of small linear molecules, there is a minimum in the harmonic spectra due to the interference of many atomic centers. [22][23][24][25][26][27] This minimum in the molecular HHG spectrum was first predicted theoretically by Lein et al [16,17] and confirmed experimentally by Kanai et al [23] The interference structure changes with the internuclear distance, the symmetry of molecular orbit, and the multi-orbit effect. [27,28] Thus, it is necessary to figure out the physical mechanism behind the interference structure in the molecular HHG spectrum.…”
Wang Jun(王 俊) a) , Wang Bing-Bing(王兵兵) b) , Guo Fu-Ming(郭福明) a) , Li Su-Yu(李苏宇) a) , Ding Da-Jun(丁大军) a) , Chen Ji-Gen(陈基根) c) , Zeng Si-Liang(曾思良) d)e) , and Yang Yu-Jun(杨玉军) a) † a)
“…For the HHG of small linear molecules, there is a minimum in the harmonic spectra due to the interference of many atomic centers. [22][23][24][25][26][27] This minimum in the molecular HHG spectrum was first predicted theoretically by Lein et al [16,17] and confirmed experimentally by Kanai et al [23] The interference structure changes with the internuclear distance, the symmetry of molecular orbit, and the multi-orbit effect. [27,28] Thus, it is necessary to figure out the physical mechanism behind the interference structure in the molecular HHG spectrum.…”
Wang Jun(王 俊) a) , Wang Bing-Bing(王兵兵) b) , Guo Fu-Ming(郭福明) a) , Li Su-Yu(李苏宇) a) , Ding Da-Jun(丁大军) a) , Chen Ji-Gen(陈基根) c) , Zeng Si-Liang(曾思良) d)e) , and Yang Yu-Jun(杨玉军) a) † a)
“…On the other hand, the HHG spectra from symmetric molecules show a striking minimum, [39] which has been identified as arising from the effect of two-center interference and has attracted broad interest in recent years. [40][41][42][43][44] It has been shown that this minimum in the HHG spectrum corresponds to the minimum in the bound-continuum transition dipole and therefore has important applications in molecular high-order harmonic spectroscopy (HHS). For example, this minimum in the HHG spectrum can be used to read the bond length of the molecule [40,41] and judge the phase of the dipole which is important in the molecular orbital tomography procedure.…”
We study odd-even high-order harmonic generation (HHG) from oriented asymmetric molecules HeH 2+ numerically and analytically. The variational method is used to improve the analytical description of the ground-state wave function for the asymmetric system, with which the ground-state-continuum-state transition dipole is evaluated. The comparison between the odd-even HHG spectra and the improved dipoles allows us to identify and clarify the complex generation mechanism of odd-even harmonics from asymmetric molecules, providing deep insights into the relation between the odd-even HHG and the asymmetric molecular orbital.
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