Effects of vacancies on high-order harmonic generation in a linear chain with band gap

High-order harmonic generation (HHG) in imperfect lattices with point defect vacancies is studied using a self-consistent time-dependent density-functional approach for a one-dimensional linear chain with a band gap. Compared with a perfect lattice with no vacancies, the HHG yield decreases by incre...

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Main Authors: Hossein Iravani, Kenneth K. Hansen, Lars Bojer Madsen
Format: Article
Language:English
Published: American Physical Society 2020-02-01
Series:Physical Review Research
Online Access:http://doi.org/10.1103/PhysRevResearch.2.013204
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author Hossein Iravani
Kenneth K. Hansen
Lars Bojer Madsen
author_facet Hossein Iravani
Kenneth K. Hansen
Lars Bojer Madsen
author_sort Hossein Iravani
collection DOAJ
description High-order harmonic generation (HHG) in imperfect lattices with point defect vacancies is studied using a self-consistent time-dependent density-functional approach for a one-dimensional linear chain with a band gap. Compared with a perfect lattice with no vacancies, the HHG yield decreases by increasing the number of evenly distributed vacancies but remains almost unchanged in the case when vacancies are localized at neighboring lattice points. By introducing atomic-type point vacancies in the linear chain, it is effectively partitioned into several subsystems and the overall shape of HHG spectra of the resulting system can be modeled via the HHG of its subsystems provided each subsystem is large enough to behave like a bulk solid. For sufficiently small subsystems, the HHG spectra show detectable signatures of finite structure but maintains the overall structure of the spectrum of a bulk solids. A time-frequency profile of the emitted harmonics shows less regular sinusoidal patterns in the systems with vacancies compared with the perfect lattice. The role the vacancy-induced defect-state orbitals in the HHG process is investigated for different realizations of the linear chain and laser parameters.
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spelling doaj.art-b1ba4f2864aa4edb9b6c1c7fe2331ea72024-04-12T16:50:19ZengAmerican Physical SocietyPhysical Review Research2643-15642020-02-012101320410.1103/PhysRevResearch.2.013204Effects of vacancies on high-order harmonic generation in a linear chain with band gapHossein IravaniKenneth K. HansenLars Bojer MadsenHigh-order harmonic generation (HHG) in imperfect lattices with point defect vacancies is studied using a self-consistent time-dependent density-functional approach for a one-dimensional linear chain with a band gap. Compared with a perfect lattice with no vacancies, the HHG yield decreases by increasing the number of evenly distributed vacancies but remains almost unchanged in the case when vacancies are localized at neighboring lattice points. By introducing atomic-type point vacancies in the linear chain, it is effectively partitioned into several subsystems and the overall shape of HHG spectra of the resulting system can be modeled via the HHG of its subsystems provided each subsystem is large enough to behave like a bulk solid. For sufficiently small subsystems, the HHG spectra show detectable signatures of finite structure but maintains the overall structure of the spectrum of a bulk solids. A time-frequency profile of the emitted harmonics shows less regular sinusoidal patterns in the systems with vacancies compared with the perfect lattice. The role the vacancy-induced defect-state orbitals in the HHG process is investigated for different realizations of the linear chain and laser parameters.http://doi.org/10.1103/PhysRevResearch.2.013204
spellingShingle Hossein Iravani
Kenneth K. Hansen
Lars Bojer Madsen
Effects of vacancies on high-order harmonic generation in a linear chain with band gap
Physical Review Research
title Effects of vacancies on high-order harmonic generation in a linear chain with band gap
title_full Effects of vacancies on high-order harmonic generation in a linear chain with band gap
title_fullStr Effects of vacancies on high-order harmonic generation in a linear chain with band gap
title_full_unstemmed Effects of vacancies on high-order harmonic generation in a linear chain with band gap
title_short Effects of vacancies on high-order harmonic generation in a linear chain with band gap
title_sort effects of vacancies on high order harmonic generation in a linear chain with band gap
url http://doi.org/10.1103/PhysRevResearch.2.013204
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