High-Harmonic Generation from Spin-Polarised Defects in Solids

The generation of high-order harmonics in gases enabled to probe the attosecond electron dynamics in atoms and molecules with unprecedented resolution. Extending these techniques to solids, which were originally developed for atomic and molecular gases, requires a fundamental understanding of the ph...

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Detalles Bibliográficos
Autores: Mrudul, M. S., Tancogne-Dejean, Nicolas, Rubio Secades, Angel, Dixit, Gopal
Tipo de recurso: artículo
Fecha de publicación:2020
País:España
Institución:Universidad del País Vasco
Repositorio:Addi. Archivo Digital para la Docencia y la Investigación
OAI Identifier:oai:addi.ehu.eus:10810/51351
Acceso en línea:http://hdl.handle.net/10810/51351
Access Level:acceso abierto
Palabra clave:single-photon emission
point-defects
semiconductors
impurities
Descripción
Sumario:The generation of high-order harmonics in gases enabled to probe the attosecond electron dynamics in atoms and molecules with unprecedented resolution. Extending these techniques to solids, which were originally developed for atomic and molecular gases, requires a fundamental understanding of the physics that has been partially addressed theoretically. Here, we employ time-dependent density-functional theory to investigate how the electron dynamics resulting in high-harmonic emission in monolayer hexagonal boron nitride is affected by the presence of vacancies. We show how these realistic spin-polarised defects modify the harmonic emission and demonstrate that important differences exist between harmonics from a pristine solid and a defected solid. In particular, we found that the different spin channels are affected differently by the presence of the spin-polarised point defect. Moreover, the localisation of the wavefunction, the geometry of the defect, and the electron-electron interaction are all crucial ingredients to describe high-harmonic generation in defected solids.