Structural and optical properties of Bi1−xAxFeO3 (A=Sr, Ca; 0.40⩽x⩽0.55)

• Published in: Journal of molecular structure 2014-09, Vol.1074, p.186-192
• Main Authors: Thakur, Samita, Pandey, O.P., Singh, K.
• Format: Article
• Language: English
• Subjects: Iodometric titration; Optical properties; Oxygen vacancies; Raman spectroscopy
• ISSN: 0022-2860; 1872-8014
• DOI: 10.1016/j.molstruc.2014.05.063

[Display omitted] •Sr2+/Ca2+ substituted BiFeO3 are synthesized and characterized.•Substitution has profound effect on structural and optical properties.•Bi0.45Sr0.55FeO3 exhibits lowest optical band gap. The effect of Sr2+ and Ca2+ cation substitution on BiFeO3-type (Bi1−xAxFeO3; A=Sr, Ca; 0.40⩽x⩽0.55) ceramics are investigated for structural and optical properties. X-ray diffraction patterns confirmed that Ca2+/Sr2+ substitution facilitates the formation of tetragonal phase instead of rhombohedral phase as observed in undoped BiFeO3 (BFO). The iodometric titration results show that substitution of Sr2+ has higher tendency to form oxygen vacancies than Ca2+ substituted samples. On the other hand, Ca2+ substitution shows opposite trend. The FT-IR and Raman spectra show shift in the peak positions towards higher wavenumber and diffused bands with the increasing concentration of substituent. The parameters like band gap energy, Urbach energy has been calculated from the UV–visible spectra. Sr2+ substituted samples show higher structural distortion and low optical band gap values which can be correlated to the higher oxygen vacancies and low Fe4+ content as compared to Ca2+ substituted samples.