219 citations · 219 across the 1 of their papers we have counts for
3 papers
First-Principles Analysis of Molecular Conduction Using Quantum Chemistry Software
Prashant Damle, Avik W. Ghosh, Supriyo Datta
We present a rigorous and computationally efficient method to do a parameter-free analysis of molecular wires connected to contacts. The self-consistent field approach is coupled w…
Current-voltage Characteristics of Molecular Conductors: Two versus Three Terminal
Prashant Damle, Titash Rakshit, Magnus Paulsson +1
This paper addresses the question of whether a ``rigid molecule'' (one which does not deform in an external field) used as the conducting channel in a standard three-terminal MOSFE…
Insights into molecular conduction from I-V asymmetry
Avik W. Ghosh, Ferdows Zahid, Prashant S. Damle +1
We investigate the origin of asymmetry in the measured current-voltage (I-V) characteristics of molecules with no inherent spatial asymmetry. We establish that such molecules can e…