A review of applications, prospects, and challenges of proton-conducting zirconates in electrochemical hydrogen devices
In the future, when fossil fuels are exhausted, alternative energy sources will be essential for
everyday needs. Hydrogen-based energy can play a vital role in this aspect. This energy is …
everyday needs. Hydrogen-based energy can play a vital role in this aspect. This energy is …
Proton-conducting barium stannate for high-temperature purposes: A brief review
Solid oxide fuel cells (SOFCs) are highly efficient energy conversion devices. However, the
use of traditional yttria-stabilized zirconia materials for SOFC electrolytes requires high …
use of traditional yttria-stabilized zirconia materials for SOFC electrolytes requires high …
First principles insight into the study of the structural, stability, and optoelectronic properties of alkali‐based single halide perovskite ZSnCl3 (Z = Na/K) materials for …
Metal halide perovskites are crystalline materials with a sharp increase in popularity and
rapidly becoming a major contender for optoelectronic device applications. In this work, we …
rapidly becoming a major contender for optoelectronic device applications. In this work, we …
Numerical analysis of photovoltaic performance in NaSnCl3 and KSnCl3 perovskite absorber layers for solar energy harvesting: SCAPS-1D study
Lead-free alkali-based tin chloride materials, NaSnCl 3 and KSnCl 3, with cubic structures
are considered promising environmentally friendly alternatives for highly efficient perovskite …
are considered promising environmentally friendly alternatives for highly efficient perovskite …
An extensive study of structural, electronic, elastic, mechanical and optical properties of XCdH3 (X= K, Rb) for hydrogen storage applications: First-principles approach
The energy crisis can be met by switching to renewable energy sources. The present study
explores the physical and hydrogen storage capacity of XCdH 3 (X= K, Rb) by first-principles …
explores the physical and hydrogen storage capacity of XCdH 3 (X= K, Rb) by first-principles …
CASTEP investigation of structural, electronic, and optical properties of halide perovskites RbXCl3 (X= Ge, Sn, Pb) for solar cell applications
MU Ghani, M Sagir, MB Tahir, HI Elsaeedy… - Inorganic Chemistry …, 2023 - Elsevier
This work aims to test the structural, electronic, and optical properties of RbXCl 3 (X= Ge, Sn,
Pb). The presented discussion is reported through the Cambridge Assembly Serial Total …
Pb). The presented discussion is reported through the Cambridge Assembly Serial Total …
Study of the perovskites CaZrO3-xSx (x= 0, 1, 2 and 3) for photovoltaic applications
In this work, we present the calculations for the structural, electronic and optical properties of
simple perovskites CaZrO 3-x S x (x= 0, 1, 2 and 3) using density functional theory (DFT) …
simple perovskites CaZrO 3-x S x (x= 0, 1, 2 and 3) using density functional theory (DFT) …
Tuning the photocatalytic performance of halide perovskites for efficient solar hydrogen production: A DFT study of CsGeCl3-xXx (X= Br, I)
M El Akkel, H Ez-Zahraouy - Solid State Communications, 2024 - Elsevier
Photoelectrochemical water splitting holds immense potential for sustainable hydrogen
production to address mounting energy demands. However, the development of efficient …
production to address mounting energy demands. However, the development of efficient …
A comprehensive DFT study to evaluate the modulation in the band gap, elastic, and optical behaviour of CsPbBr3 under the effect of stress
Abstract The computational Generalized Gradient Approximations (GGA) are applied on
cubic Cesium Lead Bromide (CsPbBr 3) with different stress values of 0, 5, 10, and 15 GPa …
cubic Cesium Lead Bromide (CsPbBr 3) with different stress values of 0, 5, 10, and 15 GPa …
The electronic, structural, ferroelectric and optical properties of strontium and zirconium co-doped BaTiO3: First-principles calculations
H Shen, K **a, P Wang, R Tan - Solid State Communications, 2022 - Elsevier
Based on the first-principles calculations, we investigated the electronic, structural,
ferroelectric and optical properties of (Ba 0.875 Sr 0.125)(Zr 0.125 Ti 0.875) O 3 (BSZT). The …
ferroelectric and optical properties of (Ba 0.875 Sr 0.125)(Zr 0.125 Ti 0.875) O 3 (BSZT). The …