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TWOSENS SIGNED

Towards Highly-Efficient Two-Photon Absorbing Sensitizers within a Confined Chromophore Space:From Computer-Aided Design to New Concepts and Applications

Total Cost €

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EC-Contrib. €

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Partnership

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 TWOSENS project word cloud

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

computational    candidates    combined    electronic    systematic    counter    extensive    space    medicine    cell    switzerland    engineering    difficulties    sections    center    bioimaging    synthesis    error    boosting    construction    start    microfabrication    greece    meet    strategies    cross    instrumentation    confined    furnish    expertise    rely    quantum    laser    conjugated    enhancement    appreciated    pi    absorption    metal    relationships    slovakia    chemistry    exhibiting    property    intuitive    displaying    permeability    action    efficiency    predictable    computer    return    material    chemically    demonstrated    experimentation    excellent    tpa    nonlinear    synthesized    optical    photon    heteroaromatic    simulations    guidelines    small    international    technologies    patterns    multidisciplinary    structure    trial    boosts    materials    skills    independent    hi    career    chemists    demand    hardly    connected    belgium    biomedical    fellow    therapy    collaborators    extremely    sensitizers    platforms    substitution    molecules    heteroarene    perturbations    germany    photodynamic    environment    complexes    chemical    accurate    chromophore   

Project "TWOSENS" data sheet

The following table provides information about the project.

Coordinator
UNIVERZITA KOMENSKEHO V BRATISLAVE 

Organization address
address: SAFARIKOVO NAM 6
city: BRATISLAVA
postcode: 814 99
website: http://www.uniba.sk

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 Slovakia [SK]
 Total cost 153˙381 €
 EC max contribution 153˙381 € (100%)
 Programme 1. H2020-EU.1.3.2. (Nurturing excellence by means of cross-border and cross-sector mobility)
 Code Call H2020-MSCA-IF-2016
 Funding Scheme MSCA-IF-EF-ST
 Starting year 2018
 Duration (year-month-day) from 2018-01-01   to  2019-12-31

 Partnership

Take a look of project's partnership.

# participants  country  role  EC contrib. [€] 
1    UNIVERZITA KOMENSKEHO V BRATISLAVE SK (BRATISLAVA) coordinator 153˙381.00

Map

 Project objective

Materials exhibiting large two-photon absorption (TPA) are in great demand to meet the needs of emerging laser technologies and applications in medicine and biomedical engineering (bioimaging, photodynamic therapy, microfabrication). Most design strategies to enhance TPA activity rely on construction of extremely large pi-conjugated molecules, which are not appreciated in practice due to difficulties connected with their synthesis or low cell permeability. The fellow recently demonstrated that significant TPA enhancement can be achieved by small perturbations in the heteroaromatic unit, but these effects are often hardly predictable or chemically counter-intuitive. The objective of this action is to provide material chemists with general guidelines for construction of heteroaromatic-based sensitizers and their metal complexes displaying very high TPA within a confined chromophore space. This will allow to avoid trial-and-error experimentation done so far. A systematic computational study of TPA cross-sections using state-of-the-art quantum-chemical methods for a large set of different heteroarene platforms and substitution patterns will furnish essential structure-property relationships and their understanding based on extensive analysis will bring new knowledge for boosting the TPA efficiency. The most promising candidates will be synthesized and their efficiency will be demonstrated in real applications. The HI and International Laser Center offer excellent multidisciplinary research environment and enable the fellow an access to their unique expertise in highly accurate electronic structure methods and instrumentation. In return, the fellow will bring his unique combined experience in computer simulations and synthesis of nonlinear optical materials as well as new collaborators from Germany, Switzerland, Belgium and Greece. The project boosts the fellow’s research skills in materials chemistry and enables him to start his independent research career in Slovakia.

 Publications

year authors and title journal last update
List of publications.
2019 Kimberly C. Mullane, Peter Hrobárik, Thibault Cheisson, Brian C. Manor, Patrick J. Carroll, Eric J. Schelter
13 C NMR Shifts as an Indicator of U–C Bond Covalency in Uranium(VI) Acetylide Complexes: An Experimental and Computational Study
published pages: 4152-4163, ISSN: 0020-1669, DOI: 10.1021/acs.inorgchem.8b03175
Inorganic Chemistry 58/7 2020-02-13
2020 Andrew W. Cook, Peter Hrobárik, Peter L. Damon, Guang Wu, Trevor W. Hayton
A Ketimide-Stabilized Palladium Nanocluster with a Hexagonal Aromatic Pd 7 Core
published pages: 1471-1480, ISSN: 0020-1669, DOI: 10.1021/acs.inorgchem.9b03276
Inorganic Chemistry 59/2 2020-02-13
2018 Luca Rocchigiani, Julio Fernandez-Cestau, Isabelle Chambrier, Peter Hrobárik, Manfred Bochmann
Unlocking Structural Diversity in Gold(III) Hydrides: Unexpected Interplay of cis / trans -Influence on Stability, Insertion Chemistry, and NMR Chemical Shifts
published pages: 8287-8302, ISSN: 0002-7863, DOI: 10.1021/jacs.8b04478
Journal of the American Chemical Society 140/26 2020-02-13
2018 Marissa Ringgold, David Rehe, Peter Hrobárik, Anna Y. Kornienko, Thomas J. Emge, John G. Brennan
Thorium Cubanes–Synthesis, Solid-State and Solution Structures, Thermolysis, and Chalcogen Exchange Reactions
published pages: 7129-7141, ISSN: 0020-1669, DOI: 10.1021/acs.inorgchem.8b00836
Inorganic Chemistry 57/12 2020-02-13
2018 Kostas Seintis, Çiǧdem Şahin, Ivica Sigmundová, Elias Stathatos, Peter Hrobárik, Mihalis Fakis
Solvent-Acidity-Driven Change in Photophysics and Significant Efficiency Improvement in Dye-Sensitized Solar Cells of a Benzothiazole-Derived Organic Sensitizer
published pages: 20122-20134, ISSN: 1932-7447, DOI: 10.1021/acs.jpcc.8b05686
The Journal of Physical Chemistry C 122/35 2020-02-13
2019 Andrew W. Cook, Peter Hrobárik, Peter L. Damon, Daniel Najera, Branislav Horváth, Guang Wu, Trevor W. Hayton
Synthesis and Characterization of a Linear, Two-Coordinate Pt(II) Ketimide Complex
published pages: 15927-15935, ISSN: 0020-1669, DOI: 10.1021/acs.inorgchem.9b02443
Inorganic Chemistry 58/23 2020-02-13
2019 Julien Fuchs, Elisabeth Irran, Peter Hrobárik, Hendrik F. T. Klare, Martin Oestreich
Si–H Bond Activation with Bullock’s Cationic Tungsten(II) Catalyst: CO as Cooperating Ligand
published pages: 18845-18850, ISSN: 0002-7863, DOI: 10.1021/jacs.9b10304
Journal of the American Chemical Society 141/47 2020-02-13

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