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Monolayer transition metal dichalcogenides in strong magnetic fields: Validating the Wannier model using a microscopic calculation
摘要： Using an equation of motion (EOM) approach, we calculate excitonic properties of monolayer transition metal dichalcogenides perturbed by an external magnetic field. We compare our findings to the widely used Wannier model for excitons in two-dimensional materials and to recent experimental results. We find good agreement between the calculated excitonic transition energies and the experimental results. In addition, we find that the exciton energies calculated using the EOM approach are slightly lower than the ones calculated using the Wannier model. Finally, we also show that the effect of the dielectric environment on the magnetoexciton transition energy is minimal due to counteracting changes in the exciton energy and the exchange self-energy correction.
关键词： monolayer transition metal dichalcogenides,magnetic field,Wannier model,excitons,magnetoexcitons,equation of motion
更新于2025-09-23 15:23:52
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Exchange-driven intravalley mixing of excitons in monolayer transition metal dichalcogenides
摘要： Monolayer transition metal dichalcogenides (TMDCs) are promising two-dimensional (2D) semiconductors for application in optoelectronics. Their optical properties are dominated by two series of photo-excited exciton states—A (XA) and B (XB)1,2—that are derived from direct interband transitions near the band extrema. These exciton states have large binding energies and strong optical absorption3–6, and form an ideal system to investigate many-body effects in low dimensions. Because spin–orbit coupling causes a large splitting between bands of opposite spins, XA and XB are usually treated as spin-polarized Ising excitons, each arising from interactions within a specific set of states induced by interband transitions between pairs of either spin-up or spin-down bands (TA or TB). Here, by using monolayer MoS2 as a prototypical system and solving the first-principles Bethe–Salpeter equations, we demonstrate a strong intravalley exchange interaction between TA and TB, indicating that XA and XB are mixed states instead of pure Ising excitons. Using 2D electronic spectroscopy, we observe that an optical excitation of the lower-energy TA induces a population of the higher-energy TB, manifesting the intravalley exchange interaction. This work elucidates the dynamics of exciton formation in monolayer TMDCs, and sheds light on many-body effects in 2D materials.
关键词： intravalley exchange interaction,2D electronic spectroscopy,exciton states,many-body effects,monolayer transition metal dichalcogenides
更新于2025-09-04 15:30:14