Strain engineering of low‐dimensional materials for emerging quantum phenomena and functionalities
Recent discoveries of exotic physical phenomena, such as unconventional
superconductivity in magic‐angle twisted bilayer graphene, dissipationless Dirac fermions in …
superconductivity in magic‐angle twisted bilayer graphene, dissipationless Dirac fermions in …
Numerical Analysis in DFT and SCAPS-1D on the Influence of Different Charge Transport Layers of CsPbBr3 Perovskite Solar Cells
The power conversion efficiency (PCE) of cesium lead halide (CsPbX3, X= l, Br, and Cl)-
based all-inorganic perovskite solar cells (PSCs) is still struggling to compete with …
based all-inorganic perovskite solar cells (PSCs) is still struggling to compete with …
Polymorphous nature of cubic halide perovskites
Many common crystal structures can be described by a single (or very few) repeated
structural motif (“monomorphous structures”) such as octahedron in cubic halide perovskites …
structural motif (“monomorphous structures”) such as octahedron in cubic halide perovskites …
Density Functional Study of Cubic, Tetragonal, and Orthorhombic CsPbBr3 Perovskite
Cesium lead bromide (CsPbBr3) perovskite has recently gained significance owing to its
rapidly increasing performance when used for light-emitting devices. In this study, we used …
rapidly increasing performance when used for light-emitting devices. In this study, we used …
Density functional theory analysis of structural, electronic, and optical properties of mixed-halide orthorhombic inorganic perovskites
Inorganic metal-halide perovskites hold a lot of promise for solar cells, light-emitting diodes,
and lasers. A thorough investigation of their optoelectronic properties is ongoing. In this …
and lasers. A thorough investigation of their optoelectronic properties is ongoing. In this …
Topological materials and topologically engineered materials: properties, synthesis, and applications for energy conversion and storage
Z Li, B Wei - Journal of Materials Chemistry A, 2021 - pubs.rsc.org
Topological materials have attracted intense research interest due to their nontrivial
topology of band structures and their promise in applications ranging from low-power …
topology of band structures and their promise in applications ranging from low-power …
Computational Study of Structural and Electronic Properties of Lead-Free CsMI3 Perovskites (M = Ge, Sn, Pb, Mg, Ca, Sr, and Ba)
Electronic structure calculations of five crystallography-imitated structures of CsMI3
perovskites with M= Ge, Sn, Pb, Mg, Ca, Sr, and Ba were performed. The formation energy of …
perovskites with M= Ge, Sn, Pb, Mg, Ca, Sr, and Ba were performed. The formation energy of …
Electronic, thermodynamical and thermoelectric performances of RbSnI3 halide perovskite for photovoltaic cell and UV absorber applications
P Kumari, R Sharma, Y Al-Douri, V Srivastava - Materials Today …, 2023 - Elsevier
Thermoelectric materials are the best materials for energy conservation and its use in
technological applications. In this context, the novel materials with multifunctional properties …
technological applications. In this context, the novel materials with multifunctional properties …
Robust half-metallic ferromagnet in doped double perovskite Sr2TiCoO6 by rare-earth elements for photovoltaic and thermoelectric conversion: A DFT method
In this study, we have discovered a novel candidate series of half-metals by replacement of
the Ti atom with the rare-earth elements RE (= Dy, Ho, Er, or Tm) in the double perovskite Sr …
the Ti atom with the rare-earth elements RE (= Dy, Ho, Er, or Tm) in the double perovskite Sr …
Investigation of thickness dependent efficiency of CsPbX3 (X= I, Br) absorber layer for perovskite solar cells
The drawbacks of solar cells consisting of hybrid organic-inorganic lead halide perovskites
led to the development of solar cells containing completely inorganic perovskites. Therefore …
led to the development of solar cells containing completely inorganic perovskites. Therefore …