image charge effect
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The image charge effect and vibron-assisted processes in Coulomb blockade transport: a first principles approach

Nanoscale ◽  
2015 ◽  
Vol 7 (45) ◽  
pp. 19231-19240 ◽  
Author(s):  
A. M. Souza ◽  
I. Rungger ◽  
U. Schwingenschlögl ◽  
S. Sanvito
Keyword(s):  
Quantum Transport ◽  
First Principles ◽  
Coulomb Blockade ◽  
Density Functional ◽  
Image Charge ◽  
Functional Theory ◽  
Master Equation Approach ◽  
Image Charge Effect ◽  
Coulomb Blockade Regime ◽  
Non Equilibrium Green’S Function

We present a combination of density functional theory and of both non-equilibrium Green's function formalism and a Master equation approach to accurately describe quantum transport in molecular junctions in the Coulomb blockade regime.

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