Theoretical investigation of Rb2AuBiX6 (X= Br, cl, F) double perovskite for thermoelectric and optoelectronic applications
The double perovskites are now being looked at as a possible way to meet the energy
needs. Therefore, in this study, the structural, optoelectronic, and thermoelectric properties of …
needs. Therefore, in this study, the structural, optoelectronic, and thermoelectric properties of …
Investigation of heavy thallium perovskites TlGeX3 (X= Cl, Br and I) for optoelectronic and thermoelectric applications: A DFT study
The present investigation aims to explore the structural, electronic, elastic, optical and
thermoelectric properties of germanium-based heavy thallium halide perovskites TlGeX 3 …
thermoelectric properties of germanium-based heavy thallium halide perovskites TlGeX 3 …
Optoelectronic and transport properties of new perovskites CsInTiX6 (X= Br, I and Cl) for thermoelectric and photovoltaic applications
A Harbi, M Moutaabbid - Polyhedron, 2023 - Elsevier
Halide perovskites have been developed as possible candidates for optoelectronic and
thermoelectric applications due to their high stability, non-toxicity and outstanding …
thermoelectric applications due to their high stability, non-toxicity and outstanding …
Tuning the optoelectronic and thermoelectric characteristics of narrow bandgap Rb2AlInX6 (X= Cl, Br, I) double perovskites: A DFT study
In this paper, the structural, optoelectronic, and thermoelectric characteristics of halide-
based double perovskite Rb 2 AlInX 6 (Cl, Br, I) compounds are examined by DFT. These …
based double perovskite Rb 2 AlInX 6 (Cl, Br, I) compounds are examined by DFT. These …
Ab initio study of structural, elastic, electronic, optical and thermoelectric properties of cubic Ge-based fluoroperovskites AGeF3 (A= K, Rb and Fr)
Structural, elastic, electronic, optical and thermoelectric properties of fluoroperovskites AGeF
3 (A= K, Rb, and Fr) have been investigated using Density Functional Theory (DFT) …
3 (A= K, Rb, and Fr) have been investigated using Density Functional Theory (DFT) …
First principles insight on mechanical stability, optical and thermoelectric response of novel lead-free Rb2ScCuBr6 and Cs2ScCuBr6 double perovskites
In this article, the structural properties, mechanical stability as well as electronic, optical, and
thermoelectric response of novel lead-free Rb 2 ScCuBr 6 and Cs 2 ScCuBr 6 double …
thermoelectric response of novel lead-free Rb 2 ScCuBr 6 and Cs 2 ScCuBr 6 double …
First-principles calculations to investigate lead-free double perovskites CsInSbAgX6 (X= Cl, Br and I) for optoelectronic and thermoelectric applications
In this study, novel lead-free double perovskites CsInSbAgX 6 (X= Cl, Br and I) are proposed
and theoretically investigated for the first time for their potential application in optoelectronic …
and theoretically investigated for the first time for their potential application in optoelectronic …
Appealing perspectives of the structural, electronic, elastic and optical properties of LiRCl 3 (R= Be and Mg) halide perovskites: a DFT study
To enhance the effectiveness of materials, we are motivated to investigate lithium-based
halide perovskites LiRCl3 (where R= Be and Mg) using first-principles techniques based on …
halide perovskites LiRCl3 (where R= Be and Mg) using first-principles techniques based on …
Examining computationally the structural, elastic, optical, and electronic properties of CaQCl 3 (Q= Li and K) chloroperovskites using DFT framework
This study presents the investigations of structural, elastic, optical, and electronic properties
of CaQCl3 (Q= Li and K) chloroperovskites for the first time using the DFT framework. The …
of CaQCl3 (Q= Li and K) chloroperovskites for the first time using the DFT framework. The …
Structural, electronic, elastic, and optical properties of cubic BaLiX 3 (X= F, Cl, Br, or I) perovskites: an ab-initio DFT study
This study reports for the first time the theoretical prediction of structural, electronic, elastic
and optical properties of cubic BaLiCl 3, BaLiBr 3, and BaLiI 3 perovskites. The …
and optical properties of cubic BaLiCl 3, BaLiBr 3, and BaLiI 3 perovskites. The …