Deligöz, EnginÇolakoğlu, KemalÇiftçi, Y.O.2024-10-152024-10-152007https://doi.org/10.1016/j.jallcom.2006.08.049https://hdl.handle.net/20.500.12451/12550Ab initio calculations, based on density functional theory and norm-conserving pseudopotentials, have been performed to investigate the some structural, elastic, electronic, and lattice-dynamical properties of pure CdF2. The calculated lattice parameter, phonon dispersion, and band structure are in accordance with the available experimental and other theoretical results. The pressure-dependent behaviours of elastic constants and band-structural properties of CdF2 are also reported.eninfo:eu-repo/semantics/embargoedAccessFirst-principles CalculationElastic PropertiesLattice DynamicsBand TructureArticle4381-2667110.1016/j.jallcom.2006.08.049N/A