Search Results - "Kondov, I"

Vibronic Effects in Single Molecule Conductance: First-Principles Description and Application to Benzenealkanethiolates between Gold Electrodes by Benesch, C, Čížek, M, Klimeš, J, Kondov, I, Thoss, M, Domcke, W

“…The effect of vibrational motion on resonant charge transport through single molecule junctions is investigated. The study is based on a combination of…”
Get full text

SIMONA 1.0: An efficient and versatile framework for stochastic simulations of molecular and nanoscale systems by Strunk, T., Wolf, M., Brieg, M., Klenin, K., Biewer, A., Tristram, F., Ernst, M., Kleine, P. J., Heilmann, N., Kondov, I., Wenzel, W.

“…Molecular simulation methods have increasingly contributed to our understanding of molecular and nanoscale systems. However, the family of Monte Carlo…”
Get full text