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Naji, M. |
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Motta, Antonella |
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Aletan, Dirar |
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Mohamed, Tarek |
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Ertürk, Emre |
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Taccardi, Nicola |
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Kononenko, Denys |
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Petrov, R. H. | Madrid |
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Alshaaer, Mazen | Brussels |
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Bih, L. |
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Casati, R. |
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Muller, Hermance |
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Kočí, Jan | Prague |
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Šuljagić, Marija |
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Kalteremidou, Kalliopi-Artemi | Brussels |
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Azam, Siraj |
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Ospanova, Alyiya |
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Blanpain, Bart |
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Ali, M. A. |
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Popa, V. |
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Rančić, M. |
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Ollier, Nadège |
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Azevedo, Nuno Monteiro |
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Landes, Michael |
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Rignanese, Gian-Marco |
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Tirth, Vineet
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (9/9 displayed)
- 2023Influence of Layering Pattern, Fibre Architecture, and Alkalization on Physical, Mechanical, and Morphological Behaviour of Banana Fibre Epoxy Compositescitations
- 2023Numerical simulation studies of the new quaternary MAX phase as future engineering applications: The case study of the Nb2ScAC2 (A = Al, Si) compoundscitations
- 2023Investigation of structural, electronic, mechanical, & optical characteristics of Ra based-cubic hydrides RbRaX3 (X= F and cl) perovskite materials for solar cell applicationscitations
- 2023Tribological performance of TiB2-graphene Al 7075 hybrid composite processed through squeeze casting: At room and high temperaturecitations
- 2023Quasi-static compressive behaviour of epoxy composites reinforced with crumb rubbercitations
- 2023Effect of Caesalpinia decapetala on the Dry Sliding Wear Behavior of Epoxy Compositescitations
- 2022Synthesis and Characterization of High Surface Area Transparent SiOC Aerogels from Hybrid Silicon Alkoxide: A Comparison between Ambient Pressure and Supercritical Dryingcitations
- 2022Machinability Performance Investigation of TiAlN-, DLC-, and CNT-Coated Tools during Turning of Difficult-to-Cut Materialscitations
- 2021Effect of Overheating and Incorrect Material Selection on Power Plant Superheater Tubecitations
Places of action
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article
Investigation of structural, electronic, mechanical, & optical characteristics of Ra based-cubic hydrides RbRaX3 (X= F and cl) perovskite materials for solar cell applications
Abstract
<p>Perovskite materials are considered the gateway of various physical applications to meet the production and consumption of energy and medical fields. Density Functional Theory (DFT) becomes the most important field in the modern era to investigate perovskite materials for various physical properties. DFT nowadays is used to explore the perovskite materials for a lot of applications like photocatalytic, optoelectronic, and photovoltaics. We discussed radium based cubic hydrides RbRaX<sub>3</sub> (while X = F & Cl) perovskite material's electrical, optical, elastic, & physical characteristics with the help of DFT-based CASTEP code with PBE exchange-correlation efficient of GGA. The RbRaF<sub>3</sub> & RbRaCl<sub>3</sub> have three-dimensional nature by means of space group 221 (Pm3 m). According to electronic characteristics, the direct bandgap of RbRaF<sub>3</sub> RbRaCl<sub>3</sub> are 3.18eV and 2.209eV, respectively. Both compounds are brittle in nature via Poisson's ratio & Pugh's criteria. Thus, our novel RbRaX<sub>3</sub> (X = F and Cl) compounds have excellent applications for solar cell and medical areas.</p>