Unraveling the Interplay between Quantum Transport and Geometrical Conformations in Monocyclic Hydrocarbons’ Molecular Junctions

In the field of molecular electronics, especially in quantum transport experiments, determining the geometrical configurations of a single molecule trapped between two electrodes can be challenging. To address this challenge, we employed a combination of molecular dynamics (MD) simulations and elect...

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Veröffentlicht in:	Journal of physical chemistry. C 2023-12, Vol.127 (48), p.23303-23311
Hauptverfasser:	Martinez-Garcia, A., de Ara, T., Pastor-Amat, L., Untiedt, C., Lombardi, E. B., Dednam, W., Sabater, C.
Format:	Artikel
Sprache:	eng
Schlagworte:	C: Spectroscopy and Dynamics of Nano, Hybrid, and Low-Dimensional Materials
Online-Zugang:	Volltext
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