Phonons in Epitaxial DySi 2 : From the Bulk to Self-Organized Nanoislands and Nanowires

Using nuclear inelastic scattering on 161Dy, we determined the Dy-partial phonon density of states of
epitaxial DySi2 in bulk and self-organized nanoislands and nanowires (NWs) on vicinal Si(001) surface.
Compared to the bulk, the nanoislands exhibit softening of the crystal lattice, which is further enhanced in
the NWs and significantly affects their thermodynamic and elastic properties. Our ab initio calculations
reveal that the origin of this effect is the vibrations of Dy atoms located at the surfaces of the nanoislands and
the NWs as well as forming a (2 × 4) reconstruction on the Si(001) surface between the NWs. The results
demonstrate that, opposite to the widely accepted anisotropic lattice mismatch model, the NWs form with
their length along the [0001] direction of the strained hexagonal unit cell with lattice parameters close to the
Si(001) surface.