Mapping Conformational Changes in a Self-Assembled Two-Dimensional Molecular Network by Statistical Analysis of Conductance Images

Naydenov B, Torsney S, Bonilla AS, Gualandi A, Mengozzi L, Cozzi PG, Gutierrez R, Cuniberti G, Boland JJ (2019)

Publication Type: Journal article

Publication year: 2019

Journal

Physical Review Applied American Physical Society

Book Volume: 11

Article Number: 034070

Journal Issue: 3

DOI: 10.1103/PhysRevApplied.11.034070

Abstract

A self-assembled two-dimensional (2D) film of tetra-phenyl-porphyrin-4-ferrocene molecules on Au(111) is studied by STM for the presence of intra- and intermolecular correlations in the configurations of the four-pendant ferrocenyl moieties. A statistical analysis of STS images exploits the Pearson's linear correlation coefficient derived from changes in the molecular electron density across lateral positions in the molecular network as a measure of the intra- and intermolecular coupling and/or conjugation between adjacent equivalent molecular components. Density functional theory (DFT) calculation shows that these electron density changes can be assigned to conformational changes of the ferrocenyl units of the molecules. The methodology presented here can be extended to measure correlations in other 2D systems.

Involved external institutions

Trinity College Dublin IE Ireland (IE) Technische Universität Dresden DE Germany (DE) University of Bologna / Università di Bologna IT Italy (IT)

How to cite

APA:

Naydenov, B., Torsney, S., Bonilla, A.S., Gualandi, A., Mengozzi, L., Cozzi, P.G.,... Boland, J.J. (2019). Mapping Conformational Changes in a Self-Assembled Two-Dimensional Molecular Network by Statistical Analysis of Conductance Images. Physical Review Applied, 11(3). https://doi.org/10.1103/PhysRevApplied.11.034070

MLA:

Naydenov, Borislav, et al. "Mapping Conformational Changes in a Self-Assembled Two-Dimensional Molecular Network by Statistical Analysis of Conductance Images." Physical Review Applied 11.3 (2019).

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