Rashba interfaces have emerged as promising platforms for spin-charge interconversion
through the direct and inverse Edelstein effects. Notably, oxide-based two-dimensional …

In this study, we have employed first-principle calculations to investigate the structural,
mechanical, electronic, magnetic and the optical properties of Co-doped ZnS and ZnSe …

In this work, we present the first principles calculations for structural, electronic and optical
properties of perovskites C a Z r O 3 and C a H f O 3 using the full-potential linearized …

The mechanical, electronic, optical and thermoelectric properties of cubic perovskite BiScO
3 are studied by using density functional theory. The lattice parameter of BiScO 3 calculated …

We investigated the structural and luminescent properties of Eu 3+-doped CaHfO 3, which
was synthesized using the solid-state reaction method. The crystal structures of the samples …

The density functional theory based total energy calculations are performed to examine the
effect of charge neutral and fully charged intrinsic vacancy defects on the thermodynamic …

Using density functional theory calculations, the effects of various point defects, including
indium vacancy (V In) and europium do** (Eu In), on the crystal structure, electronic …

We investigate zinc-blende phase Al 0.75 Mn 0.25 Y (Y= N, P, As) compounds using full-
potential linear-augmented-plane wave plus local-orbital method. For computing structural …

In this work, we studied the properties of vanadium doped binary MgS compound Mg 1− x V
x S (x= 0.125, 0.25, 0.50 and 0.75) in both ferromagnetic rock-salt and zinc-blende …

This study aims to conduct a comprehensive investigation into the thermodynamic and
thermoelectric potential of the (Ca, Sr, Ba) HfO 3 family. This family has been selected for …