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Investigation of structural, mechanical, electronic, optical, and thermodynamic properties of AXI3 (A = Li, Na; X = Ca, Sr, and Ba) halide perovskites for emerging energy technologies: A DFT study

Md. Tanvir Hossain, Tasmi Akter, Jahirul Islam, Md. Al-Amin Bhuiyan Shuvo, Kamal Hossain, Md. Adil Hossain

2024Materials Science in Semiconductor Processing19 citationsDOI

Topics & Concepts

HalideMaterials sciencePerovskite (structure)Physical chemistryEngineering physicsCrystallographyInorganic chemistryChemistryPhysicsPerovskite Materials and ApplicationsThermal Expansion and Ionic ConductivityHeusler alloys: electronic and magnetic properties
Investigation of structural, mechanical, electronic, optical, and thermodynamic properties of AXI3 (A = Li, Na; X = Ca, Sr, and Ba) halide perovskites for emerging energy technologies: A DFT study | Litcius