Fabrication of Zinc incorporated Magnetic Iron Oxide Nanoparticles for Photocatalytic Degradation of Methylene Blue

The fabrication of sustainable and efficient metal oxide-based semiconductor materials for effective degradation of environmental pollutants and other applications are currently attracting major interest from researchers. For this reason, magnetic iron oxide (Fe۳O۴) and zinc incorporated magnetic iron oxide (Zn@Fe۳O۴) nanoparticles were successfully synthesized by a co-precipitation method and tested for their physical properties and also as a photocatalysts for the degradation of toxic dye from the environment. The photocatalyst were analyzed by the use of scanning electron microscopy (SEM), x-ray diffraction (XRD) and Ultra-Violet Visible spectrophotometer to evaluate their morphology, crystallinity and band gap properties, respectively. The photocatalytic degradation performance of synthesized Fe۳O۴ and Zn@Fe۳O۴ was studied for their degradation efficiency on methylene blue (MB) dye. The photocatalytic activity of Fe۳O۴ was affected by doping with Zn ion. The highest methylene blue degradation (۸۳.۸۰ % and ۷۰.۵۰ %) for Fe۳O۴ and Zn@Fe۳O۴ were obtained at ۰.۵ g dose. The XRD and SEM results approved the existence of Fe۳O۴ and Zn@Fe۳O۴, and also highlighted the successful entrance of zinc ion onto Fe۳O۴. The introduction of zinc dopant into Fe۳O۴ lattices increases the band gap from ۲.۷۷ eV to ۲.۸۰ eV. The study of electronic structure of methylene blue was examined through quantum chemical calculations using density functional theory method (DFT) in order to give an insight on the nature of MB interaction with synthesized photocatalyst. The DFT results revealed that the nitrogen atom of the MB molecule is the favorite sites of interaction with the metal oxide surface. Furthermore, the experimental findings showed that magnetic iron oxide demonstrated a good photocatalyst in degradation of methylene blue as compared to the zinc doped magnetic iron oxide particle.

کلیدواژه ها:

Photocatalysis ، Computational modeling ، Metal oxide ، Metal dopant ، Methylene blue