The stability, electronic, optical and thermodynamic properties of X 3 OI (X= Na, K, Rb) have
been calculated by first principles. The Birch-Murnaghan method was used to fit the optimal …

In this study, the micro-emulsion approach was adopted to fabricate rare earth (Nd) and
transition metal (Cu) co-doped barium hexaferrite (Ba 1-x Nd x Fe 12-y Cu y O 19) …

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 …

We thoroughly inspected the strain induced electronic properties, phonon dynamics and
thermoelectric performance of ZrRhSb compound via density functional theory calculations …

On basis of our first principle calculations, we suggest lead free defective perovskites Cs 2
SeCl 6 and Cs 2 TeCl 6 as efficient high temperature thermoelectric materials. Our …

Solid-state batteries present potential advantages over their liquid-based electrolyte
equivalents, including enhanced safety and increased energy density. In the search for …

Solid-state electrolytes (SSEs) play the most important role in the development of cutting-
edge all-solid-state batteries (ASSBs). The lithium (sodium)-rich antiperovskite solid …

The rotation of organic cations is considered to be an important reason for the dynamic
changes in stability and photoelectric properties of organic perovskites. However, the …

We have studied the origin of the semimetallic pseudo gap and the role of site preference in
the L 2 1-type Heusler compound Ru 2 TaGa. A detailed account of the structural stability …

In this work, we investigated the physical properties of the Quaternary Full-Heusler alloy
FeCuMnSi, including: the structural, magnetic, electronic, optical, and thermoelectric …