Recent progress of lead-free halide double perovskites for green energy and other applications

M Sk - Applied Physics A, 2022 - Springer
In recent years, the metal halide perovskites (MHPs) have gained substantial interest due to
their versatile applications in the field of the solar cell, Field-Effect Transistor (FET), and Light …

Reliability of 3D Cs 2 M+ M 3+ X 6 type absorbers for perovskite solar cells: assessing the figures of merit

A Pasha, S Akhil, RG Balakrishna - Journal of Materials Chemistry A, 2021 - pubs.rsc.org
In the realm of perovskite-based solar cells, the quest for lead-free absorber materials is the
epicenter of research. The search has led to the development of various lead-free …

Exploring the structural, phononic, electronic, magnetic, optical, and thermoelectric properties of Pb-free vanadium-based double perovskites using the first-principles …

SZA Shah, S Niaz, T Nasir, SM Ramay - Solar Energy, 2022 - Elsevier
Double perovskites are very famous among the scientific community as non-traditional, eco-
friendly, low cost, efficient and stable energy harvesting materials, especially for the …

[HTML][HTML] Influence of heavy Hf doping in CeO2: prediction on various physical properties

KM Hossain, SK Mitro, SA Moon, MM Ali, S Chandra… - Results in Physics, 2022 - Elsevier
This work employs density functional theory for calculating the structural, mechanical,
anisotropic, thermal, electronic, and optical properties of Ce 1-x Hf x O 2 (x= 0, 0.25, 0.5, and …

Structural stability, mechanical, and optoelectronic properties of A2TlBiI6 (A= Cs and Rb) for energy harvesting: A first principles investigation

A ul Haq, SS Iqbal, A Ahmad, TS Ahmad… - Journal of Physics and …, 2023 - Elsevier
Halide double perovskite materials have potential application in renewable energy devices.
Herein, the optoelectronic properties and mechanical stability of A 2 TlBiI 6 (A= Cs and Rb) …

Structural and optoelectronic properties of the Cs2InMCl6 (M: Sb, Bi, Ag) double perovskite compounds: a first-principles study

MM Pirvahshi, M Izadifard, ME Ghazi - Computational Condensed Matter, 2022 - Elsevier
In this work we implied density-functional theory (DFT) to study structural and optoelectronic
properties of the double perovskite Cs 2 InSbCl 6 (CISC), Cs 2 InBiCl 6 (CIBC) and Cs 2 …

Chlorine and zinc co-doping effects on the electronic structure and optical properties of {\gamma}-CuI

C Li, M Li, Z Zhang, Q Zhao, N Liu, K Wang… - arXiv preprint arXiv …, 2024 - arxiv.org
The effects of chlorine (Cl) and zinc (Zn) co-doping on the electronic structure and optical
properties of the zinc blende ({\gamma}) phase of copper iodide ({\gamma}-CuI) scintillator …

Influence of Heavy Hf Doping in Ceo2: Prediction on Various Physical Properties Via Density Function Theory Approach

KM Hossain, SK Mitro, SA Moon, MM Ali… - Available at SSRN …, 2022 - papers.ssrn.com
This work employs density functional theory to calculate the structural, mechanical, elastic
anisotropy, thermal, electronic, and optical properties of Ce 1-x Hf x O 2 (x= 0, 0.25, 0.5, and …