• Title of article

    Symplectic integrators for the multilevel Redfield equation

  • Author/Authors

    Kalyanaraman، نويسنده , , C. and Evans، نويسنده , , D.G.، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2000
  • Pages
    7
  • From page
    459
  • To page
    465
  • Abstract
    We develop a method for solving the Redfield equation using symplectic integrators (SI). We show how the Redfield equation for a reduced density matrix of a multi-level system interacting with a thermal bath can be rewritten in a symplectic form so that numerical algorithms used in classical mechanics can readily be applied. The symplectic structure of the Redfield equation is established for a superoperator which is complex, non-Hermitian, and explicitly time-dependent in some cases. The efficiency of several SI schemes are studied and compared for a model dissipative system: electron transfer coupled to a vibrational mode and a thermal bath.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2000
  • Journal title
    Chemical Physics Letters
  • Record number

    1772430