English

Time-dependent density-functional theory with self-interaction correction

Other Condensed Matter 2009-11-13 v2

Abstract

We discuss an extension of time-dependent density-functional theory by a self-interaction correction (SIC). A strictly variational formulation is given taking care of the necessary constraints. A manageable and transparent propagation scheme using two sets of wavefunctions is proposed and applied to laser excitation with subsequent ionization of a dimer molecule.

Keywords

Cite

@article{arxiv.0712.2306,
  title  = {Time-dependent density-functional theory with self-interaction correction},
  author = {J. Messud and P. M. Dinh and P. -G. Reinhard and E. Suraud},
  journal= {arXiv preprint arXiv:0712.2306},
  year   = {2009}
}

Comments

4 pages, 1 figure

R2 v1 2026-06-21T09:54:01.869Z