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CLUNATRA SIGNED

Discovering new Catalysts in the Cluster-Nanoparticle Transition Regime

Total Cost €

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EC-Contrib. €

0

Partnership

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 CLUNATRA project word cloud

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

entities    interdisciplinary    interactive    added    reactions    particle    co2    energy    active    characterization    dft    gt    thermally    fundamental    nanoparticles    electrochemical    hydrogen    scalable    simulations    sulfides    catalysts    loop    efficient    behavior    chemical    regime    drastic    thereby    clusters    nitrides    breakthroughs    difficult    progress    nm    discovery    inorganic    losses    amount    ides    solar    completely    setting    atomic    adding    oxides    break    phosphides    subsequently    area    hypothesis    reactivity    exist    overarching    flat    lack    unexplored    recipient    explored    atom    n2    devoted    catalytic    conventional    barely    employ    landscape    intermediates    limited    sustainable    relations    provides    enhanced    synthesis    material    fuels    reaction    away    optimized    freedom    nanoparticle    methodology    chemicals    instrument    catalyst    scaling    purpose    activated    cluster    transition    mass    size    synthesizing   

Project "CLUNATRA" data sheet

The following table provides information about the project.

Coordinator
DANMARKS TEKNISKE UNIVERSITET 

Organization address
address: ANKER ENGELUNDSVEJ 1 BYGNING 101 A
city: KGS LYNGBY
postcode: 2800
website: www.dtu.dk

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 Denmark [DK]
 Total cost 2˙500˙000 €
 EC max contribution 2˙500˙000 € (100%)
 Programme 1. H2020-EU.1.1. (EXCELLENT SCIENCE - European Research Council (ERC))
 Code Call ERC-2016-ADG
 Funding Scheme ERC-ADG
 Starting year 2017
 Duration (year-month-day) from 2017-09-01   to  2022-08-31

 Partnership

Take a look of project's partnership.

# participants  country  role  EC contrib. [€] 
1    DANMARKS TEKNISKE UNIVERSITET DK (KGS LYNGBY) coordinator 2˙500˙000.00

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 Project objective

The purpose of this proposal is to establish new fundamental insight of the reactivity and thereby the catalytic activity of oxides, nitrides, phosphides and sulfides (O-, N-, P-, S- ides) in the Cluster-Nanoparticle transition regime. We will use this insight to develop new catalysts through an interactive loop involving DFT simulations, synthesis, characterization and activity testing. The overarching objective is to make new catalysts that are efficient for production of solar fuels and chemicals to facilitate the implementation of sustainable energy, e.g. electrochemical hydrogen production and reduction of CO2 and N2 through both electrochemical and thermally activated processes. Recent research has identified why there is a lack of significant progress in developing new more active catalysts. Chemical scaling-relations exist among the intermediates, making it difficult to find a reaction pathway, which provides a flat potential energy landscape - a necessity for making the reaction proceed without large losses. My hypothesis is that going away from the conventional size regime, > 2 nm, one may break such chemical scaling-relations. Non-scalable behavior means that adding an atom results in a completely different reactivity. This drastic change could be even further enhanced if the added atom is a different element than the recipient particle, providing new freedom to control the reaction pathway. The methodology will be based on setting up a specifically optimized instrument for synthesizing such mass-selected clusters/nanoparticles. Thus far, researchers have barely explored this size regime. Only a limited amount of studies has been devoted to inorganic entities of oxides and sulfides; nitrides and phosphides are completely unexplored. We will employ atomic level simulations, synthesis, characterization, and subsequently test for specific reactions. This interdisciplinary loop will result in new breakthroughs in the area of catalyst material discovery.

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

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