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Terahertz intersubband transitions in GaAsBi/AlGaAs single quantum well heterostructure
摘要： GaAsBi/AlGaAs single quantum well conduction band structure, energy levels, and their corresponding wavefunctions have been calculated by solving the Schr?dinger equation. The influences of the heterostructure parameters on the intersubband transition (ISBT) frequency within the terahertz (THz) domain have been investigated. The results show that the quantum well width has a great impact on the THz ISBT frequency. In particular, an ISBT with a frequency of 2.611 THz (10.80?meV) has been obtained for specifically optimized parameters. The study of the intersubband optical absorption coefficient (OAC) was centered in the frequency band of 2 – 14 THz ( ~ 8 – 58 meV), therefore the corresponding results are useful for the optimization of THz detectors. Correspondingly, by changing the thickness of the active layer the number of the OAC peaks has been tuned. The dipole matrix element and the Fermi occupation function have been also studied in detail. Furthermore, the influences coming from the incidence angle on the OAC intensity were numerically investigated. The obtained results could be beneficial for the design and the optimization of devices operating in the THz frequency band.
关键词： GaAsBi quantum well,Terahertz region,Intersubband transitions,Optical absorption coefficient,Incidence angle,Active layer thickness
更新于2025-09-19 17:13:59
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: Why Sn substitution should be preferred to Pb vacancy for optimum solar cell efficiency
摘要： Methylammonium lead halide (MAPbI3) perovskite has emerged as one of the frontier optoelectronic semiconductors. To avoid lead toxicity, the role of Sn substitution and Pb vacancy (Pb-(cid:2)) are addressed in regulating stability and solar cell ef?ciency of MAPb1?X ?Y SnX (cid:2)Y I3 perovskite using hybrid density functional theory (DFT). The role of spin-orbit coupling (SOC) and the electron’s self-interaction error are examined carefully. We ?nd to reduce the Pb content from pristine MAPbI3, Sn substitution has a more favorable thermodynamic stability than creating Pb-(cid:2). Moreover, on substituting Sn, due to strong s-p and p-p couplings, the lower parts of the conduction band gets shifted downwards, which results in the reduction of the band gap (direct). This further helps us to get a high optical absorption coef?cient (redshifted) and maximum solar cell ef?ciency in MAPb1?X SnX I3 for 0 < X (cid:2) 0.5.
关键词： spin-orbit coupling,MAPbI3,solar cell efficiency,Pb vacancy,thermodynamic stability,Sn substitution,Methylammonium lead halide,hybrid density functional theory,optical absorption coefficient
更新于2025-09-19 17:13:59