Simultaneous tuning of optical and electrical properties in a multifunctional LiNbO3 matrix upon doping with Eu3+ ions

Abstract

Combined photoluminescence (PL) and dielectric studies have been carried out on both undoped and Eu³⁺ doped LiNbO₃ compounds for their potential application in optical–electrical integration for the first time. Special focus has been given to simultaneously tuning both these physical properties. A PL study reveals that the blank compound is a blue emitting material, while upon doping with Eu³⁺ ions, the emitting color can be tuned from blue to red upon changing the excitation wavelength. Interestingly, the electrical property measurement of this ferroelectric compound showed that upon doping with Eu³⁺ ions, the remnant polarization was increased significantly. Density Functional Theory (DFT) based calculations were carried out to explain both the optical and electrical properties. It has been found that different defect centers are responsible for the bluish host emission while Eu³⁺ ions are energetically preferred to occupy the Nb site and gives rise to red emission. The DFT based results also showed that Eu³⁺ ions induced more distortion into the nearby Nb-site, which is responsible for enhancement of the remnant polarization. Stark-splitting patterns in the PL study also showed that the point symmetry of LiNbO₃ upon Eu³⁺ doping changes from C_6v to D₃, which indicates that the structure becomes less symmetric. Overall, the study presents a novel approach to designing multifunctional materials for optical–electrical integration application and to tuning their physical properties simultaneously in the desired range.