This Study uses density function theory calculations to examine the structural, elastic,
optoelectronic, and thermal properties of lithium-based double perovskites Li2AgBiZ6 (Z …

All-inorganic halide double perovskite has recently emerged as a potential substitute for
lead halide perovskite capable of solving the problem of toxicity associated with lead content …

Recently, direct band gap double perovskites have become more popular among the
photovoltaic research community owing to their potential to address issues of lead toxicity …

Perovskite materials have generated research attention in recent times owing to their
potential to be deployed as photovoltaic materials. In this study, an examination of the …

Thermoelectricity generation techniques utilized for conversion of waste heat into electric
power are currently gaining prominence. It is necessary that for improved efficiency, the …

A semi-empirical ion sputtering model (SEISM) was extended for clearer ripple profiles on
material surfaces on which atoms self-organise into rippled topography. The improvement …

Transition metal nitrides possess important properties of interest such as superconductivity,
high hardness, optical, electronic and magnetic among others which are relevant for …

A polymer like polyethylene (PE) has attracted intense research exploits in recent years due
to their inherent versatile properties like high optical clarity, mechanical properties, light …

In recent years, perovskite materials have been the focus in solar cell fabrication industry.
Herein, an investigation was conducted on the effect of ion-solid interactions on factors are …

Abstract Properties of materials are best analyzed when lattice parameters of such
compounds of materials are predicted accurately. In density functional theory prediction of …