Solving the Kadanoff-Baym equations for inhomogeneous systems: application to atoms and molecules.

نویسندگان

  • Nils Erik Dahlen
  • Robert van Leeuwen
چکیده

We implement time propagation of the nonequilibrium Green function for atoms and molecules by solving the Kadanoff-Baym equations within a conserving self-energy approximation. We here demonstrate the usefulness of time propagation for calculating spectral functions and for describing the correlated electron dynamics in a nonperturbative electric field. We also demonstrate the use of time propagation as a method for calculating charge-neutral excitation energies, equivalent to highly advanced solutions of the Bethe-Salpeter equation.

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عنوان ژورنال:
  • Physical review letters

دوره 98 15  شماره 

صفحات  -

تاریخ انتشار 2007