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Document type:
Zeitschriftenaufsatz 
Author(s):
Di Carlo, A.; Gheorghe, M.; Lugli, P.; Sternberg, M.A. 
Title:
Theoretical tools for transport in molecular nanostructures 
Abstract:
We have developed a quantum simulation tool to investigate transport in molecular structures. The method is based on the joint use of a density functional tight binding (DFTB) and of a Green's function technique which allows us the calculation of current flow through the investigated structures. Typical calculations are shown for carbon-nanotube-based field effect transistors and for DNA fragments. Transport; molecular structures 
Journal title:
Physica B: Condensed Matter Volume 314, Issues 1–4, March 2002, Pages 86–90 
Year:
2002 
Year / month:
2002-03 
Quarter:
1. Quartal 
Month:
Mar 
Pages contribution:
86 - 90 
Covered by:
Scopus 
Language:
en 
Publisher:
Elsevier B.V.