Electron-Phonon Coupling and Photoluminescence in monolayer MoS$_{2}$
ORAL
Abstract
We have carried out first principles calculations of the photoluminescent properties of monolayer MoS$_{2}$ using density functional theory. In particular, we have analyzed the role of electron-phonon interactions in the photoluminescence process. Phonon dispersion curves calculated using density functional perturbation theory served as the basis for the evaluation of the system electron-phonon coupling, which in turn was used to calculate electron self-energy and the electron spectral function within the Eliashberg approach. We find that the resulting photoemission spectrum is in good agreement with experimental data. We pay special attention to the ultrafast relaxation of the electron system as manifested by the electron-phonon coupling and evaluate the ultrafast photoluminescence of the excited system by using the two-temperature model. It is shown that similar to graphene, MoS$_{2}$ may demonstrate significant ultrafast photoluminescence.
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Authors
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Neha Nayyar
University of Central Florida
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Volodymyr Turkowski
University of Central Florida
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Duy Le
University of Central Florida
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Talat S. Rahman
University of Central Florida, Department of Physics, University of Central Florida, Department of Physics, University of Central Florida, Orlando, FL, Physics Department, University of Central Florida