• Title of article

    yambo: An ab initio tool for excited state calculations Original Research Article

  • Author/Authors

    Andrea Marini and Michele Cini، نويسنده , , Conor Hogan، نويسنده , , Myrta Grüning، نويسنده , , Daniele Varsano، نويسنده ,

  • Issue Information
    ماهنامه با شماره پیاپی سال 2009
  • Pages
    12
  • From page
    1392
  • To page
    1403
  • Abstract
    yambo is an ab initio code for calculating quasiparticle energies and optical properties of electronic systems within the framework of many-body perturbation theory and time-dependent density functional theory. Quasiparticle energies are calculated within the GW approximation for the self-energy. Optical properties are evaluated either by solving the Bethe–Salpeter equation or by using the adiabatic local density approximation. yambo is a plane-wave code that, although particularly suited for calculations of periodic bulk systems, has been applied to a large variety of physical systems. yambo relies on efficient numerical techniques devised to treat systems with reduced dimensionality, or with a large number of degrees of freedom. The code has a user-friendly command-line based interface, flexible I/O procedures and is interfaced to several publicly available density functional ground-state codes.
  • Keywords
    Quasiparticles , Electronic structure , Optical properties , Excitons
  • Journal title
    Computer Physics Communications
  • Serial Year
    2009
  • Journal title
    Computer Physics Communications
  • Record number

    1137719