Crystal structure of the parent misfit-layered cobalt oxide [Sr2O2]qCoO2

The crystal structure of our newly discovered Sr-Co-O phase is investigated in detail through high-resolution electron microscopy (HREM) techniques. Electron diffraction (ED) measurement together with energy dispersive X-ray spectroscopy (EDS) analysis show that an ampoule-synthesized sample contains an unknown Sr-Co-O ternary phase with monoclinic symmetry and the cation ratio of Sr/Co = 1. From HREM images a layered structure with a regular stacking of a CdI2-type CoO, sheet and a rock-salt-type Sr2O2 double-layered block is observed, which confirms that the phase is the parent of the more complex "misfit-layered (ML)" cobalt oxides of [M(m)A(2)O(m+2)],CoO2 with the formula of [Sr2O2](q)CoO2, i.e. m = 0. It is revealed that the misfit parameter q is 0.5, i.e. the two sublattices of the CoO2 sheet and the Sr2O2 block coexist to form a commensurate composite structure. We propose a structural model with monoclinic P2(1)/m symmetry, which is supported by simulations of ED patterns and HREM images based on dynamical diffraction theory. (c) 2006 Elsevier Inc. All rights reserved.