BiSe, an exciting member of homologous family (Bi 2) m (Bi 2 Se 3) n [where, m= 1; n= 2],
has recently gained attention in thermoelectric research due to its intrinsically ultralow lattice …

The TaAs family (NbAs, TaAs, NbP, TaP) are kinds of Weyl semimetals with lots of novel
properties, thus attracting considerable attention in recent years. Here, we systematically …

We systematically study the lattice-dependent spin Hall effect of light (SHEL) in a Weyl
semimetal (WSM) by considering left-handed polarization of the incident beam, and propose …

A systematic density functional theory based first principles electronic structure studies on
AeAFe 4 As 4 known as, 1144 iron based superconductors (IBSC) for various Ae= Ca, Sr, Eu …

We report a comprehensive density functional theory based first principles studies on newly
discovered iron-based RbLn 2 Fe 4 As 4 O 2 (Ln= Sm, Tb, Dy, Ho) superconducting …

We perform first-principles density-functional theory calculations to determine the
equilibrium defect structures, formation energies, charge transition levels, and electronic …

The weakly screened electron-hole interactions in an atomically thin semiconductor not only
downshift its excitation spectrum from a quasiparticle one, but also redistribute excitation …

We investigate in detail the electronic structure of very recently discovered electron doped
12442-type iron based BaTh 2 Fe 4 As 4 (N 1− x O x) 2 compounds (x= 0.1–0.6), using …

The transition metal monopnictide family of Weyl semimetals recently has been shown to
exhibit anomalously strong second-order optical nonlinearity, which is theoretically …

The nodal-line semimetals have recently gained attention as a promising material due to
their exotic electronic structure and properties. Here, we investigated the structural evolution …