Complex oxides with pronounced proton transfer occupy a special place in modern solid-
state ionics and high-temperature electrochemistry, being of great interest from both …

First principles calculations on structural, electronic, magnetic and elastic properties of
BaNpO 3 oxide are reported using full potential augmented plane wave method. To achieve …

The rapid development of efficient high-temperature electrochemical devices stimulates the
search for new electrolytic materials with high conductivity and excellent chemical stability …

The structural, electronic, optical and thermoelectric (TE) characteristics of cubic KTaO 3
pervoskite are investigated at 0, 40, 80 and 150 GPa pressures by employing the full …

The objective of this work is to use density functional theory (DFT) analysis to explain the
effects of sulfur (S), selenium (Se), and oxygen vacancies on the mechanical, electrical …

The new oxygen-deficient orthorhombic perovskite LaIn 0.5 Zn 0.5 O 2.75 was obtained by
solid-state synthesis. Ionic transport properties were studied by a combined theoretical …

Successfully optimized calculations for the stability of SnAlO3 perovskite in its paramagnetic
phase and various structural parameters have been figured out in this study. Structural …

For the first time the LaIn 1-x Zn x O 3-1/2x samples was synthesized via solid-state reaction
method. The Zn 2+− doping effect on the B-site of LaInO 3 on structure, water uptake and …

A series of single-phased and color tunable LaInO3: Bi3+, Ho3+/Sm3+ nano phosphors
were synthesized via a cost effective and low temperature chemical route. The crystal …

We have systematically investigated the electronic structure, optical properties, Born
effective charges and the thermoelectric properties of PrMO3 (M= Al, Ga, In) compounds …