Theoretical investigations of optoelectronic and transport properties of Rb2YInX6 (X= Cl, Br, I) double perovskite materials for solar cell applications
PA Nawaz, GM Mustafa, SS Iqbal, NA Noor, TS Ahmad… - Solar Energy, 2022 - Elsevier
The double perovskite-based materials have attracted considerable attention of scientists
owing to their potential applications in optoelectronic and transport properties. Here, we …
owing to their potential applications in optoelectronic and transport properties. Here, we …
Theoretical investigation of X2NaIO6 (X= Pb, Sr) double perovskites for thermoelectric and optoelectronic applications
The full-potential linearized augmented plane wave (FP-LAPW) method was used to
evaluate the structural, optical, electronic, and thermoelectric (TE) characteristics of X 2 NaIO …
evaluate the structural, optical, electronic, and thermoelectric (TE) characteristics of X 2 NaIO …
Physical properties of elastically and thermodynamically stable magnetic AcXO3 (X= Cr, Fe) perovskite oxides: a DFT investigation
Spin-polarized calculations of mechanical, electronic structure, phonon, optical and
magnetic properties of AcXO 3 (X= Cr, Fe) perovskite oxides (POs) has been computed …
magnetic properties of AcXO 3 (X= Cr, Fe) perovskite oxides (POs) has been computed …
Study of Mechanical, Optoelectronic, and thermoelectric aspects of lithium-based double perovskites Li2AgSbX6 (X= Cl, Br, I) for energy harvesting applications
Inorganic double perovskites appear to be incredible materials for renewable energy
purposes, particularly in thermoelectric generators and solar cells. This article systematically …
purposes, particularly in thermoelectric generators and solar cells. This article systematically …
Structural, magnetic, elastic, and thermoelectric properties of Ba2InOsO6 double perovskite in the cubic phase: A DFT+ U study with spin-orbit-coupling
In this study, we comprehensively investigate the structural, electronic, magnetic, elastic, and
thermal properties of the double perovskite Ba 2 InOsO 6 using density functional theory …
thermal properties of the double perovskite Ba 2 InOsO 6 using density functional theory …
Unraveling the complexities of A2NaMoCl6 (A= Cs, Rb) halide double perovskites through theoretical methods
This study explores the structural, electronic, magnetic, optical, mechanical and
thermoelectric (TE) properties of halide double perovskites (HDPs) A 2 NaMoCl 6 (A= Cs …
thermoelectric (TE) properties of halide double perovskites (HDPs) A 2 NaMoCl 6 (A= Cs …
Do** dependent magnetic and thermoelectric response of perovskite BaGeO3 for spintronics and energy applications
Using ab-initio simulations, we have investigated the magnetic and thermoelectric response
of the pristine and Mn-, Ni-, and In-doped BaGeO 3 at Ge-site. The dopants Mn, Ni, and In …
of the pristine and Mn-, Ni-, and In-doped BaGeO 3 at Ge-site. The dopants Mn, Ni, and In …
Electronic, Optical and Thermoelectric Properties of Cs2XInCl6 (X = Ag, Na) Halide Double Perovskites
Herein, the optoelectronic, structural, thermoelectric, and elastic features of halide double
perovskites (HDPs) Cs2XInCl6 (X= Ag, Na) are examined by using full‐potential linearized …
perovskites (HDPs) Cs2XInCl6 (X= Ag, Na) are examined by using full‐potential linearized …
First-principles calculations to investigate Structural, mechanical, electronic, magnetic and thermoelectric properties of MRh2O4 (M= Mg, Mn, Cd) spinel oxides
Structural, mechanical, magnetic, electronic and thermoelectric properties of MRh 2 O 4 (M=
Mg, Mn, Cd) spinel oxides are studied through first-principles calculations. Calculations of …
Mg, Mn, Cd) spinel oxides are studied through first-principles calculations. Calculations of …
First-principles calculations to investigate the structural, electronic, magnetic and thermoelectric properties of ARh2O4 (A= Co, Ni, Cu, Zn) oxides
Structural, elastic, magnetic, electronic and thermoelectric properties of ARh 2 O 4 (A= Co,
Ni, Cu, Zn) oxides are calculated theoretically. Density functional calculations are performed …
Ni, Cu, Zn) oxides are calculated theoretically. Density functional calculations are performed …