The present investigation aims to explore the structural, electronic, elastic, optical and
thermoelectric properties of germanium-based heavy thallium halide perovskites TlGeX 3 …

In this paper, the structural, optoelectronic, and thermoelectric characteristics of halide-
based double perovskite Rb 2 AlInX 6 (Cl, Br, I) compounds are examined by DFT. These …

In this paper, the crystal structures, thermodynamic stability, electronic densities of states,
band structures, and optical properties of the nontoxic Pb‐free vacancy ordered double …

We present thermoelectric properties such as the Seebeck coefficient, thermal conductivity,
electrical conductivity, figure of merit, and power factor of Tl 2 (Se, Te) Cl 6 vacancy-ordered …

A systematic ab initio study within the density functional theory is employed to investigate the
structural, mechanical, elasto-acoustic, and anisotropic properties of AePdH 3 (Ae= Ca, Sr …

The charge and spin degrees of freedom of electrons employed together introduce a new
field of electronics, known as spintronics, which has multifunctional applications in data …

Half metallicity is an appealing platform for emerging spintronic applications. The
researchers are focusing to find out the best material for such an application. Here, we …

The absolute spin polarization, stable structures, and non-toxic nature of vacancy-ordered
double perovskites (DPs) make them merging materials for spintronic. Therefore, in the …

The double perovskite type oxides are deemed to be an eloquent materials to be used for
applications in efficient optoelectronic devices/transducers. In order to explore physical …

Vacancy-ordered double perovskites (DPs) are emerging materials for spintronics due to
their stable structures and non-toxic properties. In this study, we conducted a comprehensive …