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Anisotropic Kubo conductivity of electric field-induced monolayer β(12)-borophene

In this paper, we used three monolayer β(12)-borophene Hamiltonian models to calculate the band structure, intra-band, and inter-band optical conductivity (IOC). Linear response theory and the Kubo formula are employed to calculate optical conductivity. We have shown that the band gap proportional t...

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Detalles Bibliográficos
Autor principal: Mortezaei Nobahari, Mohammad
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8696993/
https://www.ncbi.nlm.nih.gov/pubmed/35425137
http://dx.doi.org/10.1039/d1ra07945j
Descripción
Sumario:In this paper, we used three monolayer β(12)-borophene Hamiltonian models to calculate the band structure, intra-band, and inter-band optical conductivity (IOC). Linear response theory and the Kubo formula are employed to calculate optical conductivity. We have shown that the band gap proportional to the inversion non-symmetric model increases by applying an external electric field (EEF), and for homogeneous and inversion-symmetric models, gap opening occurs. We found an anisotropic behavior in the IOC of β(12)-borophene for polarized light along x and y-directions. The peak of the real part of the IOC for polarized light along the x-direction (ℜσ(xx)) locates at the energy equal to the band gap and by applying an EEF shifts to the higher energies and experiences a blue shift. Also, the electric field has little effect on the IOC along y-direction (σ(yy)) and in contrast to σ(xx), by applying an electric field, the peak of the IOC shifts towards lower energies and a redshift occurs. In addition, unlike inter-band transitions, the intra-band optical conductivity of β(12)-borophene is isotropic in all three models, and an EEF can not shift plots to higher or lower energies and only reduces the height of both imaginary and real parts of the optical conductivity.