Mapping the force field of a hydrogen-bonded assembly

Hydrogen bonding underpins the properties of a vast array of systems spanning a wide variety of scientific fields. From the elegance of base pair interactions in DNA to the symmetry of extended supramolecular assemblies, hydrogen bonds play an essential role in directing intermolecular forces. Yet f...

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Main Authors: Sweetman, Adam, Jarvis, Samuel Paul, Sang, Hongqian, Lekkas, Ioannis, Rahe, Philipp, Wang, Yu, Wang, Jianbo, Champness, Neil R., Kantorovich, Lev, Moriarty, Philip
Format: Article
Published: Nature Publishing Group 2014
Online Access:https://eprints.nottingham.ac.uk/31710/
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author Sweetman, Adam
Jarvis, Samuel Paul
Sang, Hongqian
Lekkas, Ioannis
Rahe, Philipp
Wang, Yu
Wang, Jianbo
Champness, Neil R.
Kantorovich, Lev
Moriarty, Philip
author_facet Sweetman, Adam
Jarvis, Samuel Paul
Sang, Hongqian
Lekkas, Ioannis
Rahe, Philipp
Wang, Yu
Wang, Jianbo
Champness, Neil R.
Kantorovich, Lev
Moriarty, Philip
author_sort Sweetman, Adam
building Nottingham Research Data Repository
collection Online Access
description Hydrogen bonding underpins the properties of a vast array of systems spanning a wide variety of scientific fields. From the elegance of base pair interactions in DNA to the symmetry of extended supramolecular assemblies, hydrogen bonds play an essential role in directing intermolecular forces. Yet fundamental aspects of the hydrogen bond continue to be vigorously debated. Here we use dynamic force microscopy (DFM) to quantitatively map the tip-sample force field for naphthalene tetracarboxylic diimide molecules hydrogen-bonded in two-dimensional assemblies. A comparison of experimental images and force spectra with their simulated counterparts shows that intermolecular contrast arises from repulsive tip-sample interactions whose interpretation can be aided via an examination of charge density depletion across the molecular system. Interpreting DFM images of hydrogen-bonded systems therefore necessitates detailed consideration of the coupled tip-molecule system: analyses based on intermolecular charge density in the absence of the tip fail to capture the essential physical chemistry underpinning the imaging mechanism.
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spelling nottingham-317102020-05-04T16:47:28Z https://eprints.nottingham.ac.uk/31710/ Mapping the force field of a hydrogen-bonded assembly Sweetman, Adam Jarvis, Samuel Paul Sang, Hongqian Lekkas, Ioannis Rahe, Philipp Wang, Yu Wang, Jianbo Champness, Neil R. Kantorovich, Lev Moriarty, Philip Hydrogen bonding underpins the properties of a vast array of systems spanning a wide variety of scientific fields. From the elegance of base pair interactions in DNA to the symmetry of extended supramolecular assemblies, hydrogen bonds play an essential role in directing intermolecular forces. Yet fundamental aspects of the hydrogen bond continue to be vigorously debated. Here we use dynamic force microscopy (DFM) to quantitatively map the tip-sample force field for naphthalene tetracarboxylic diimide molecules hydrogen-bonded in two-dimensional assemblies. A comparison of experimental images and force spectra with their simulated counterparts shows that intermolecular contrast arises from repulsive tip-sample interactions whose interpretation can be aided via an examination of charge density depletion across the molecular system. Interpreting DFM images of hydrogen-bonded systems therefore necessitates detailed consideration of the coupled tip-molecule system: analyses based on intermolecular charge density in the absence of the tip fail to capture the essential physical chemistry underpinning the imaging mechanism. Nature Publishing Group 2014-05-30 Article PeerReviewed Sweetman, Adam, Jarvis, Samuel Paul, Sang, Hongqian, Lekkas, Ioannis, Rahe, Philipp, Wang, Yu, Wang, Jianbo, Champness, Neil R., Kantorovich, Lev and Moriarty, Philip (2014) Mapping the force field of a hydrogen-bonded assembly. Nature Communications, 5 . 3931/1-3931/7. ISSN 2041-1723 http://www.nature.com/ncomms/2014/140530/ncomms4931/full/ncomms4931.html doi:10.1038/ncomms4931 doi:10.1038/ncomms4931
spellingShingle Sweetman, Adam
Jarvis, Samuel Paul
Sang, Hongqian
Lekkas, Ioannis
Rahe, Philipp
Wang, Yu
Wang, Jianbo
Champness, Neil R.
Kantorovich, Lev
Moriarty, Philip
Mapping the force field of a hydrogen-bonded assembly
title Mapping the force field of a hydrogen-bonded assembly
title_full Mapping the force field of a hydrogen-bonded assembly
title_fullStr Mapping the force field of a hydrogen-bonded assembly
title_full_unstemmed Mapping the force field of a hydrogen-bonded assembly
title_short Mapping the force field of a hydrogen-bonded assembly
title_sort mapping the force field of a hydrogen-bonded assembly
url https://eprints.nottingham.ac.uk/31710/
https://eprints.nottingham.ac.uk/31710/
https://eprints.nottingham.ac.uk/31710/