Surface and Bulk Structural Properties of Single Crystalline Sr3Ru2O7

We report temperature and thermal-cycling dependence of surface and bulk structures of double-layered perovskite Sr3Ru2O7 single crystals. The surface and bulk structures were investigated using low-energy electron diffraction (LEED) and single-crystal X-ray diffraction (XRD) techniques, respectively. Single-crystal XRD data is in good agreement with previous reports for the bulk structure with RuO6 octahedral rotation, which increases with decreasing temperature (~ 6.7(6)degrees at 300 K and ~ 8.1(2) degrees at 90 K). LEED results reveal that the octahedra at the surface are much more distorted with a higher rotation angle (~ 12 degrees between 300 and 80 K) and a slight tilt ((4.5\pm2.5) degrees at 300 K and (2.5\pm1.7) degrees at 80 K). While XRD data confirms temperature dependence of the unit cell height/width ratio (i.e. lattice parameter c divided by the average of parameters a and b) found in a prior neutron powder diffraction investigation, both bulk and surface structures display little change with thermal cycles between 300 and 80 K.
Comment: 25 pages, 5 figures, 5 tables, to appear in Physical Review B