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
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