In this review, we consider state-of-the-art density functional theory (DFT) investigations of
strongly correlated systems performed with the meta-generalized gradient approximation …

Some of the important applications in the field of spintronics are spin current driven logic
devices having logic gates and in read heads in the hard disk drives, magnetic random …

A series of full Heusler (FH) alloys Co 2 FeZ (Z= Al, Ga, Si, Ge, S, Se and Te) have been
investigated using density functional theory (DFT) with full potential-linearized augmented …

The electronic structure and metallicity of Si‐doped Mn2VGe Heusler alloys within the first‐
principles density‐functional theory framework are discussed. Mn2VGe is found to assume …

In the present work, full Heusler alloy (FHA) Co 2 FeSi (CFS) epitaxial thin films with
thickness (t CFS) ranging from 5–25 nm were grown by Pulse laser deposition (PLD) on …

The utilization of spin rather than charge as a functional aspect in the electronic devices will
result in an energy-efficient, thermally stable, and fast operation. Cobalt-based Heusler alloy …

The creation of innovative functional materials with outstanding overall performance is the
main challenge encountered in practical application. This study investigated the pressure …

Magnetocaloric, electrocaloric, and mechanocaloric effects are nominally reversible thermal
changes that occur in magnetically, electrically, and mechanically responsive materials …

The importance of the Density Functional Theory (DFT) calculation approach lies in their
ability to provide a highly accurate prediction of structural and optoelectronic properties …

We propose a ferromagnetic Heusler alloy that can switch between a metal and a half-metal.
This effect can provide tunable spintronics properties. Using the density functional theory …