Crystal and domain structure of the BiFeO3–PbTiO3 solid solution

X-ray diffraction and transmission electron microscopy have been performed on samples in the solid solution series (BiFeO3) x– (PbTiO3) 1−x in which a morphotropic phase boundary occurs at x≈0. 7. BiFeO3 exhibits superlattice reflections at 12hklp positions in some electron diffraction patterns, the distribution of which unambiguously demonstrates that the FeO6 octahedra are rotated in anti-phase about the pseudocubic 111 axis, consistent with the rhombohedral (R) space group R3c. The amplitude of the rotations decreases in the R phase as PbTiO3 content increases and superlattice reflections are absent in electron diffraction patterns from the tetragonal (T) phase (x=0. 6), indicating that it is untilted with space group P4mm. Electron diffraction patterns from samples where x=0. 7 reveal superlattice reflections not associated with octahedral rotations and consistent with an intermediate phase with lower symmetry than T and R.