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3DMOSHBOND SIGNED

Three-Dimensional Mapping Of a Single Hydrogen Bond

Total Cost €

0

EC-Contrib. €

0

Partnership

0

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 3DMOSHBOND project word cloud

Explore the words cloud of the 3DMOSHBOND project. It provides you a very rough idea of what is the project "3DMOSHBOND" about.

3d    unprecedented    ab    place    strength    magnitude    layer    poorly    interaction    functional    reproduce    characterisation    variety    intermolecular    indirectly    precision    3dmoshbond    demonstration    single    interatomic    tip    critical    2011    shift    hitherto    all    complete    designed    outline    simulations    ultimately    despite    bond    resolution    initio    functionalisation    changed    forces    sub    create    governing    map    groups    interactions    microscope    vertically    relevance    molecule    oriented    theory    shape    imaging    dft    scanning    clear    experimental    molecular    atomic    paradigm    highlighting    hydrogen    junction    density    creation    investigation    bonding    direct    power    engage    governed    definition    fundamental    regarding    position    force    atoms    proof    potentials    unparalleled    molecules    reimagining    complementary    accuracy    relatively    biologically    generalised    techniques    iupac    probe    angstrom   

Project "3DMOSHBOND" data sheet

The following table provides information about the project.

Coordinator
UNIVERSITY OF LEEDS 

Organization address
address: WOODHOUSE LANE
city: LEEDS
postcode: LS2 9JT
website: www.leeds.ac.uk

contact info
title: n.a.
name: n.a.
surname: n.a.
function: n.a.
email: n.a.
telephone: n.a.
fax: n.a.

 Coordinator Country United Kingdom [UK]
 Total cost 1˙971˙468 €
 EC max contribution 1˙971˙468 € (100%)
 Programme 1. H2020-EU.1.1. (EXCELLENT SCIENCE - European Research Council (ERC))
 Code Call ERC-2017-STG
 Funding Scheme ERC-STG
 Starting year 2018
 Duration (year-month-day) from 2018-01-01   to  2022-12-31

 Partnership

Take a look of project's partnership.

# participants  country  role  EC contrib. [€] 
1    UNIVERSITY OF LEEDS UK (LEEDS) coordinator 1˙971˙468.00
2    THE UNIVERSITY OF NOTTINGHAM UK (NOTTINGHAM) participant 0.00

Map

 Project objective

All properties of matter are ultimately governed by the forces between single atoms, but our knowledge of interatomic, and intermolecular, potentials is often derived indirectly.

In 3DMOSHBOND, I outline a program of work designed to create a paradigm shift in the direct measurement of complex interatomic potentials via a fundamental reimagining of how atomic resolution imaging, and force measurement, techniques are applied.

To provide a clear proof of principle demonstration of the power of this concept, I propose to map the strength, shape and extent of single hydrogen bonding (H-bonding) interactions in 3D with sub-Angstrom precision. H-bonding is a key component governing intermolecular interactions, particularly for biologically important molecules. Despite its critical importance, H-bonding is relatively poorly understood, and the IUPAC definition of the H-bond was changed as recently as 2011- highlighting the relevance of a new means to engage with these fundamental interactions.

Hitherto unprecedented resolution and accuracy will be achieved via a creation of a novel layer of vertically oriented H-bonding molecules, functionalisation of the tip of a scanning probe microscope with a single complementary H-bonding molecule, and by complete characterisation of the position of all atoms in the junction. This will place two H-bonding groups “end on” and map the extent, and magnitude, of the H-bond with sub-Angstrom precision for a variety of systems. This investigation of the H-bond will present us with an unparalleled level of information regarding its properties.

Experimental results will be compared with ab initio density functional theory (DFT) simulations, to investigate the extent to which state-of-the-art simulations are able to reproduce the behaviour of the H-bonding interaction. The project will create a new generalised probe for the study of single atomic and molecular interactions.

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The information about "3DMOSHBOND" are provided by the European Opendata Portal: CORDIS opendata.

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