Floquet formulation of time-dependent density functional theory
Abstract
We present a generalized Floquet formulation of time-dependent density functional theory for nonperturbative treatment of both bound-bound and bound-free multiphoton transitions of many-electron systems in intense monochromatic laser fields. It is shown that the time-dependent Kohn-Sham equations can be converted into an equivalent time-independent infinite-dimensional non-Hermitian Floquet Hamiltonian eigenvalue problem. We introduce the notion of complex density and present a procedure for extracting the partial ionization rates from individual electron orbitals. The method is illustrated by a case study of multiphoton ionization of He in both weak and strong fields.
- Publication:
-
Chemical Physics Letters
- Pub Date:
- January 1997
- DOI:
- 10.1016/S0009-2614(96)01370-X
- Bibcode:
- 1997CPL...264..466T