Originalsprog | Engelsk |
---|---|
Tidsskrift | Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory |
Vol/bind | 111 |
Udgave nummer | 26 |
Sider (fra-til) | 5692-5702 |
Antal sider | 11 |
ISSN | 1089-5639 |
DOI | |
Status | Udgivet - 2007 |
Udgivet eksternt | Ja |
The green's function density functional tight-binding (gDFTB) method for molecular electronic conduction
Jeffrey R. Reimers, Gemma C. Solomon, Alessio Gagliardi, Ante Bilic, Noel S. Hush, Thomas Frauenheim, Aldo Di Carlo, Alessandro Pecchia