Structure and phase transition of BiFeO3 cubic micro-particles prepared by hydrothermal method

Single-phase bismuth ferrite (BiFeO3) powders were synthesized with a hydrothermal method by controlling the experimental conditions carefully. The powder structure, morphology and composition were characterized by using X-ray diffraction (XRD), scanning electron microscopy, transmission electron microscope, Raman measurement and X-ray photoelectron spectroscopy. The particles change from irregular agglomerations to regular cubes with increasing KOH concentration. The large BiFeO3 cubic particles enjoy much smooth surfaces with well-matched element ratio (Bi:Fe:O = 1:1:3) and chemical valence (Bi3+, Fe3+ and O2−). The high temperature XRD and differential scanning calorimetry show that BiFeO3 powders have a hexagonal perovskite structure with a space group R3c below 370 °C and a rhombohedral structure with a space group R3m below 755 °C. BiFeO3 undergoes a phase transition in the temperature range of 755–817 °C from rhombohedral structure to a cubic phase, then decomposes to liquid and Fe2O3 above 939 °C.

Graphical abstractBismuth ferrite (BiFeO3) cubic micro-particles with smooth surfaces were synthesized. BiFeO3 has a hexagonal perovskite structure with a space group R3c below 370 °C and rhombohedral perovskite structure with a space group R3m below 755 °C, undergoes a phase transition in the temperature range of 755–817 °C to a cubic structure, then decompose to liquid and Fe2O3 above 939 °C.Figure optionsDownload full-size imageDownload as PowerPoint slideHighlights► BiFeO3 micro-particles with smooth surface were synthesized by hydrothermal method. ► BiFeO3 enjoys hexagonal structure with well element ratio and chemical valence. ► BiFeO3 transition from rhombohedral phase to cubic phase lasts 60 °C.