http://www.cnr.it/ontology/cnr/individuo/prodotto/ID184113
yambo: An ab initio tool for excited state calculations (Articolo in rivista)
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- yambo: An ab initio tool for excited state calculations (Articolo in rivista) (literal)
- Anno
- 2009-01-01T00:00:00+01:00 (literal)
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#doi
- 10.1016/j.cpc.2009.02.003 (literal)
- Alternative label
MARINI, ANDREA (1,5); HOGAN, CONOR (2,5); Grüning, Myrta (3,5); Varsano, Daniele (4,5) (2009)
yambo: An ab initio tool for excited state calculations
in Computer physics communications
(literal)
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori
- MARINI, ANDREA (1,5); HOGAN, CONOR (2,5); Grüning, Myrta (3,5); Varsano, Daniele (4,5) (literal)
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- top 25 hottest articles of Computer Physics Communications for the July-September 2009 (literal)
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- (1) Dipartimento di Fisica, CNISM, and SMC Institute for Statistical Mechanics and Complexity, Università di Roma \"Tor Vergata\", Via della Ricerca Scientifica 1, I-00133 Roma, Italy;
(2) Dipartimento di Fisica and INFM-CNR, Università di Roma \"Tor Vergata\", Via della Ricerca Scientifica 1, I-00133 Roma, Italy;
(3) Unité PCPM, Université Catholique de Louvain, 1348 Louvain-la-Neuve, Belgium;
(4) National Center on nanoStructures and Biosystems at Surfaces (S3) of INFM-CNR, I-41100 Modena, Italy;
(5) European Theoretical Spectroscopy Facility (ETSF) (literal)
- Titolo
- yambo: An ab initio tool for excited state calculations (literal)
- 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. (literal)
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