Antton Curutchet
Présentation
Publications
Publications
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Using grand-canonical DFT to investigate electrochemical reactions on semiconductor surfaces.9ièmes journées nationales des carburants solaires, Jul 2025, Strasbourg, France |
Revealing the Photochromism Mechanism of Sulphur-Doped Sodalites using DFT, TD-DFT and SAC-CI methods.International Conference on Molecular Simulation 2019, Nov 2019, Jeju, South Korea |
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Modelling heterogeneous photocatalysts for water splitting: What can we ask from quantum chemistry?International Conference on Advanced Materials and Processes for Environment, Energy and Health, Oct 2018, Montréal, Canada |
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Modelling heterogeneous photocatalyst for water splitting: What can we ask from quantum chemistry?Journées des Carburants Solaires 2018, May 2018, Paris, France |
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Ab initio design of BiCuOS derivatives as semiconductors for photochemical water splittingEuropean Materials Research Society Congress, Jun 2018, Strasbourg, France |
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Modeling the Photochromism of Sulphur-Doped Sodalites using DFT, TDDFT and SAC-CI methods.4th International Workshop on Nano and Bio-Photonics, Sep 2017, Vogüé, France |
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AB INITIO DESIGN OF BICUOS DERIVATIVES AS SEMICONDUCTORS FOR PHOTOCHEMICAL WATER SPLITTINGJournées des Carburants Solaires 2017, May 2017, Autrans, France |
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Modeling the Photochromism of Sulphur-Doped Sodalites using DFT, TD-DFT and SAC-CI methods.World Association of Theoretical and Computational Chemists, Aug 2017, Munich, Germany |
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Investigation of electronic properties of photochromic sodalite by DFT/TD-DFT calculations.Multi-Responsive Photochromes, Apr 2016, Nantes, France |
Modeling the Photochromism of Sulphur-Doped Sodalites using DFT, TDDFT and SAC-CI methods.EMRS, Mar 2018, Strasbourg, France |
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DFT investigation of tenebrescent natural mineralsWorkshop on Charge Trapping Defects in Semiconductors and Insulators, Mar 2017, York, United Kingdom |
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Research activities on solar fuels in the laboratoy of Chemistry of ENS Lyon – Group of Theoretical ChemistryJournée des Carburants Solaires 2017, May 2017, Autran, France |
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Etude par DFT de la ténébrescence dans les composés photochromiques minérauxRencontre des chimistes théoriciens francophones, Jun 2016, Lyon, France |
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Etude par DFT de photocatalyseurs pour des applications en photodissociation de l'eauChimie théorique et/ou physique. Université de Lyon, 2019. Français. ⟨NNT : 2019LYSEN010⟩ |