Investigating the physical characteristics and photovoltaic performance of inorganic Ba3NCl3 perovskite utilizing DFT and SCAPS-1D simulations
AA Hassan, MSI Ria, A Ghosh, HA Alrafai… - Materials Science and …, 2024 - Elsevier
Lead-free inorganic cubic halide perovskites exhibit outstanding physical properties in solar
technology. Ba 3 NCl 3 emerges as a promising absorber material in solar cells. Utilizing …
technology. Ba 3 NCl 3 emerges as a promising absorber material in solar cells. Utilizing …
Structural, elastic and optoelectronic properties of inorganic cubic FrBX 3 (B= Ge, Sn; X= Cl, Br, I) perovskite: the density functional theory approach
Inorganic metal-halide cubic perovskite semiconductors have become more popular in
industrial applications of photovoltaic and optoelectronic devices. Among various …
industrial applications of photovoltaic and optoelectronic devices. Among various …
[HTML][HTML] TlBX3 (B= Ge, Sn; X= Cl, Br, I): Promising non-toxic metal halide perovskites for scalable and affordable optoelectronics
Inorganic, non-toxic metal halide perovskites are the benchmark for optoelectronic device
commercialization. Due to their significant importance, the density functional theory-based …
commercialization. Due to their significant importance, the density functional theory-based …
Pressure-Induced Band Gap Engineering of Nontoxic Lead-Free Halide Perovskite CsMgI3 for Optoelectronic Applications
Recently, lead halide perovskites have gained considerable attention by dint of their
predominant physiochemical features and potential use in various applications with an …
predominant physiochemical features and potential use in various applications with an …
Ultra-violet to visible band gap engineering of cubic halide KCaCl 3 perovskite under pressure for optoelectronic applications: insights from DFT
Density functional theory is utilized to explore the effects of hydrostatic pressure on the
structural, electrical, optical, and mechanical properties of cubic halide perovskite KCaCl3 …
structural, electrical, optical, and mechanical properties of cubic halide perovskite KCaCl3 …
Boosting efficiency above 30% of novel inorganic Ba3SbI3 perovskite solar cells with potential ZnS electron transport layer (ETL)
Abstract The inorganic Ba 3 SbI 3 perovskite has emerged as a promising, stable absorber
material for efficient and cost-effective solar cells, owing to its intriguing compositional …
material for efficient and cost-effective solar cells, owing to its intriguing compositional …
First-principles calculations to explore the metallic behavior of semiconducting lead-free halide perovskites RbSnX3 (X = Cl, Br) under pressure
The ab initio calculations of structural, electronic, mechanical, and optical properties of
rubidium-based halide perovskites RbSnX3 (X= Cl, Br) have been performed under different …
rubidium-based halide perovskites RbSnX3 (X= Cl, Br) have been performed under different …
First-principles investigation of pressure-modulated structural, electronic, mechanical, and optical characteristics of Sr3PX3 (X = Cl, Br) for enhanced …
This study investigates the influence of hydrostatic pressure on structural, electronic,
mechanical and optical properties of Sr3PX3 (X= Cl and Br) compounds, by using the first …
mechanical and optical properties of Sr3PX3 (X= Cl and Br) compounds, by using the first …
Pressure-driven modification of optoelectronic features of ACaCl3 (A= Cs, Tl) for device applications
Intending to advance the use of halide-perovskites in technological applications, in this
research, we investigate the structural, electronic, optical, and mechanical behavior of metal …
research, we investigate the structural, electronic, optical, and mechanical behavior of metal …
Band gap shifting of halide perovskite CsCaBr3 from ultra-violet to visible region under pressure for photovoltaic applications
Throughout this study, the effects of hydrostatic pressure on the physical properties of halide
perovskite CsCaBr 3 are explored using the density functional theory. The calculated lattice …
perovskite CsCaBr 3 are explored using the density functional theory. The calculated lattice …