Polarization Dependence of Laser-Induced Dynamics on Non-Flat Metal Surfaces: A Time-Dependent Density Functional Theory Approach

Abstract

Real-time time-dependent density functional theory was used to study the laser-pulse-induced ion dynamics on metal surfaces featuring rows of atomic ridges. In contrast to atomically flat surfaces, the rows of atomic ridges induce anisotropy on the surface even in surface-parallel directions. This anisotropy causes the laser-induced ion dynamics to depend on the orientation of the laser polarization vector in the surface-parallel directions. This polarization dependence occurs for both copper (111) and aluminum (111) surfaces, indicating that the existence of localized d orbitals in the electronic system does not play a crucial role. The difference in kinetic energies between ions on the ridges and those on the planar surface reached a maximum when the laser polarization vector was perpendicular to the rows of ridges but parallel to the surface. A simple mechanism for the polarization dependence and some potential applications in laser processing are discussed.