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Title:

GW Corrections of Energy Bandgaps for Coherent Transport Across Molecular Junctions

Document type:
Konferenzbeitrag
Author(s):
Pecchia, A.; Gagliardi, A.; Niehaus, T.A.; Frauenheim, T.; Di Carlo, A.
Abstract:
Despite its mathematical complexity, the nonequilibrium Green's function method has gained a great popularity in recent years in the computation of transport across molecular junctions, mostly because of the elegant way in which, at least in principle, electron-phonon and electron-electron interactions can be treated in a unied and systematic way [1], [2], [3]. In most cases the system Hamiltonian is described within a single particle DFT approach. The advantage is the possibility to i...     »
Book / Congress title:
11th International Workshop on Computational Electronics (IWCE-11), Talk Session 6
Congress (additional information):
Vienna, Austria, 25-27 May 2006-05
Year:
2006
Quarter:
2. Quartal
Year / month:
2006-05
Month:
May
Pages:
357 - 358
Print-ISBN:
3-901578-16-1
Language:
en
WWW:
http://in4.iue.tuwien.ac.at/pdfs/iwce/iwce11_2006/pp357-358.pdf
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