๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

First-Principles Calculation of Transport Properties of a Molecular Device

โœ Scribed by Di Ventra, M.; Pantelides, S. T.; Lang, N. D.


Book ID
126897869
Publisher
The American Physical Society
Year
2000
Tongue
English
Weight
112 KB
Volume
84
Category
Article
ISSN
0031-9007

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


Electronic transport properties of molec
โœ A. Pecchia; L. Latessa; A. Di Carlo; P. Lugli; Th. Neihaus ๐Ÿ“‚ Article ๐Ÿ“… 2003 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 248 KB

Density functional theory calculations combined with non-equilibrium Green's function technique have been used to compute electronic transport in organic molecules. In our approach the system Hamiltonian is obtained by means of a self-consistent density-functional tight-binding (DFTB) method. This a