Superconductivity in two-dimensional materials has attracted considerable attention. A new material belonging to the family of Janus transition metal dichalcogenides with out-of-plane structural asymmetry has been recently found to show interesting physical and chemical properties. Using density functional theory and density functional perturbation theory, within the generalized gradient approximation with van der Waals correction, we performed a detailed investigation of the electronic structure, phonon dispersion, Eliashberg spectral function, and electron-phonon coupling of Janus MSSe bilayers (M = Mo or W) and the Janus MoSSe/WSSe heterostructure intercalated with alkali metals (Li, Na, and K) or alkaline earth metals (Mg, Ca, and Sr).
View Article and Find Full Text PDFDeveloping devices for optoelectronic and photonic applications-based nanomaterials has been one of the most critical challenges in the last decade. In this work, we use first-principles density functional theory combined with non-equilibrium Green's function to highlight for the first time the sensitivity of optoelectronic and photonic properties toward the exfoliation process. All the studied structures were relaxed and their relevant phonon modes confirm the high structural stability.
View Article and Find Full Text PDFBackground: Bipolar disorder (BD) is a complex neuropsychiatric disease that has been strongly linked to immune dysregulation. In particular, an abnormal inflammatory response mediated by toll-like receptor 2 - 1/6 (TLR2-1/6) was described in BD. Nevertheless, genetic factors' contribution is still unknown.
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