maylis orio

99
Documents
Affiliations actuelles
  • Institut des Sciences Moléculaires de Marseille (ISM2)
  • BiosCiences
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Publications

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Accurate Calculation of Electron Paramagnetic Resonance Parameters for Molybdenum Compounds

Maria Drosou , Iris Wehrung , Dimitrios Pantazis , Maylis Orio

ChemPhysChem, 2025, ⟨10.1002/cphc.202500317⟩

Article dans une revue hal-05318994v1
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Hydrogen Evolution Reaction Mechanisms in Thiosemicarbazone Metal Complexes: A Combined Theoretical and Experimental Investigation on the Impact of Proton Source

Jana Mehrez , Alexandre Barrozo , Léa Delmotte , Renaud Hardré , Michael Papadakis et al.

Dalton Transactions, 2025, ⟨10.1039/D4DT03507K⟩

Article dans une revue hal-05020331v1
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Electrocatalytic water oxidation with bioinspired cubane-type Co(II) complexes

Roberto Favela-Mendoza , Elizabeth Rul-Ramírez , Ana Cristina García-Alvarez , Eduardo Sánchez-Lara , Stefani Gamboa-Ramírez et al.

Dalton Transactions, In press, ⟨10.1039/D5DT01000D⟩

Article dans une revue hal-05216709v1
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Mechanistic Promiscuity in Cobalt Mediated CO₂ Reduction Reaction: One-versus Two-Electron Reduction Process

Ayan Bera , Sarah Bimmermann , Philipp Gerschel , Dibya Jyoti Barman , Leon Gerndt et al.

Angewandte Chemie International Edition, 2025, 64 (31), pp.e202503705. ⟨10.1002/anie.202503705⟩

Article dans une revue hal-05216716v1
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Oxidation‐Deformylation Cascade Catalyzed By a Mononuclear Copper Complex

Yongxing Wang , Rogelio Gomez Pineiro , Rébecca Leblay , Michel Giorgi , Sylvain Bertaina et al.

Chemistry - A European Journal, 2025, 31 (26), pp.e202500626. ⟨10.1002/chem.202500626⟩

Article dans une revue hal-05216711v3
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Stereochemical Tailoring of Nickel-based Electrocatalysts for Hydrogen Evolution Reaction

Michael Papadakis , Jana Mehrez , Iris Wehrung , Léa Delmotte , Michel Giorgi et al.

ChemCatChem, In press, ⟨10.1002/cctc.202400426⟩

Article dans une revue hal-04557494v1
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Hemilabile Thio– and Selenoethers in Bis(benzimidazolyl)Amine Copper Complexes Relevant to the Active Sites of Copper‐Dependent Monooxygenases

Brenda Sánchez-Eguía , Hugo Hernández-Toledo , Sven Lidin , Marcos Flores-Alamo , Ebbe Nordlander et al.

ChemCatChem, 2024, ⟨10.1002/cctc.202401330⟩

Article dans une revue hal-04756778v1
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Bio-Inspired copper complexes with Cu 2 S cores: (solvent)effects on oxygen reduction reactions

Jordan Mangue , Iris Wehrung , Jacques Pécaut , Stéphane Ménage , Maylis Orio et al.

Dalton Transactions, 2024, 53 (43), pp.17728-17728. ⟨10.1039/x0xx00000x⟩

Article dans une revue hal-04890157v1
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Integrated Experimental and Theoretical Investigation of Copper Active Site Properties of a Lytic Polysaccharide Monooxygenase from Serratia marcescens

Alessia Munzone , Manon Pujol , Chris Joseph , Ievgen Mazurenko , Marius Réglier et al.

Inorganic Chemistry, 2024, 63 (24), pp.11063-11078. ⟨10.1021/acs.inorgchem.4c00602⟩

Article dans une revue hal-04595887v1
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A tetrathiafulvalene salt of the nitrite (NO2−) anion: investigations of the spin-Peierls phase

Loïc Soriano , Maylis Orio , Olivier Pilone , Olivier Jeannin , Eric Reinheimer et al.

Journal of Materials Chemistry C, 2023, 11, pp.8170. ⟨10.1039/d2tc05431k⟩

Article dans une revue hal-04006059v1
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How Metal Nuclearity Impacts Electrocatalytic H2 Production in Thiocarbohydrazone-based Complexes

Michael Papadakis , Alexandre Barrozo , Léa Delmotte , Tatiana Straistari , Sergiu Shova et al.

Inorganics, 2023, 11 (4), pp.149. ⟨10.3390/inorganics11040149⟩

Article dans une revue hal-04061771v1
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A series of cobalt bis(thiosemicarbazone) catalysts for effective photocatalytic hydrogen evolution reaction

Michael Papadakis , Georgios Landrou , Marie Poisson , Léa Delmotte , Katerina a G Achileos et al.

European Journal of Inorganic Chemistry, 2023, 26 (35), ⟨10.1002/ejic.202300352⟩

Article dans une revue hal-04200012v1
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Multi-Electron Visible Light Photoaccumulation on a Dipyridylamine Copper(II)–Polyoxometalate Conjugate Applied to Photocatalytic Generation of CF 3 Radicals

Weixian Wang , Lise-Marie Chamoreau , Guillaume Izzet , Anna Proust , Maylis Orio et al.

Journal of the American Chemical Society, 2023, 145 (22), pp.12136-12147. ⟨10.1021/jacs.3c01716⟩

Article dans une revue hal-04165763v1
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Highly Efficient Light‐Driven CO 2 to CO Reduction by an Appropriately Decorated Iron Porphyrin Molecular Catalyst

Aspasia Stoumpidi , Adelais Trapali , Marie Poisson , Alexandre Barrozo , Sylvain Bertaina et al.

ChemCatChem, 2023, ⟨10.1002/cctc.202200856⟩

Article dans une revue hal-03980075v1
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Structural Features Governing the Metabolic Stability of Tetraethyl-Substituted Nitroxides in Rat Liver Microsomes

Aleksandra Rančić , Nikola Babić , Maylis Orio , Fabienne Peyrot

Antioxidants , 2023, 12, pp.402. ⟨10.3390/antiox12020402⟩

Article dans une revue hal-03979927v1
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Syntheses and Electrochemical and EPR Studies of Porphyrins Functionalized with Bulky Aromatic Amine Donors

Mary-Ambre Carvalho , Khalissa Merahi , Julien Haumesser , Ana Mafalda Vaz Martins Pereira , Nathalie Parizel et al.

Molecules, 2023, 28 (11), pp.4405. ⟨10.3390/molecules28114405⟩

Article dans une revue hal-04157648v1
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Computational Insights of Selective Intramolecular O‐atom Transfer Mediated by Bioinspired Copper Complexes

Stefani Gamboa-Ramírez , Bruno Faure , M. Réglier , A. Jalila Simaan , Maylis Orio

Chemistry - A European Journal, 2022, pp.e202202206. ⟨10.1002/chem.202202206⟩

Article dans une revue hal-03789397v1
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Electron spins interaction in the spin-Peierls phase of the organic spin chain (o-DMTTF)2X (X = Cl, Br, I)

Loic Soriano , Olivier Pilone , Michael D. D Kuz'Min , Herve Vezin , Olivier Jeannin et al.

Physical Review B, 2022, 105 (6), ⟨10.1103/PhysRevB.105.064434⟩

Article dans une revue hal-03578624v1
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From Ligand‐ to Metal‐centered Reactivity: Metal Substitution Effect in Thiosemicarbazone‐based Complexes for H 2 Production

Alexandre Barrozo , Maylis Orio

ChemPhysChem, 2022, 23 (9), pp.e202200056. ⟨10.1002/cphc.202200056⟩

Article dans une revue hal-03862130v1
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Decoding the Ambiguous Electron Paramagnetic Resonance Signals in the Lytic Polysaccharide Monooxygenase from Photorhabdus luminescens

Rogelio Gómez-Piñeiro , Maria Drosou , Sylvain Bertaina , Christophe Decroos , A. Jalila Simaan et al.

Inorganic Chemistry, 2022, 61 (20), pp.8022-8035. ⟨10.1021/acs.inorgchem.2c00766⟩

Article dans une revue hal-03704221v1
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Quantum Bio-Inorganic Chemistry (QBIC) Society Special Collection

Lubomír Rulíšek , Maja Gruden , Maylis Orio , Robert Deeth

Chemistry - A European Journal, 2022, 28 (49), pp.e202202185. ⟨10.1002/chem.202202185⟩

Article dans une revue hal-03862141v1
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EPR Spectroscopy of Cu(II) Complexes: Prediction of g-Tensors Using Double-Hybrid Density Functional Theory

Maria Drosou , Christiana Mitsopoulou , Maylis Orio , Dimitrios Pantazis

Magnetochemistry, 2022, 8 (4), pp.36. ⟨10.3390/magnetochemistry8040036⟩

Article dans une revue hal-03862136v1
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Nickel Complexes and Carbon Dots for Efficient Light‐Driven Hydrogen Production

Kalliopi Ladomenou , Michael Papadakis , Georgios Landrou , Michel Giorgi , Charalambos Drivas et al.

European Journal of Inorganic Chemistry, 2021, 2021 (30), pp.3097-3103. ⟨10.1002/ejic.202100449⟩

Article dans une revue hal-03862123v1
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Cellulose Depolymerization with LPMO‐inspired Cu Complexes

Ivan Castillo , Andrea Torres-Flores , Diego Abad-Aguilar , Armando Berlanga-Vázquez , Maylis Orio et al.

ChemCatChem, 2021, 13 (22), pp.4700-4704. ⟨10.1002/cctc.202101169⟩

Article dans une revue hal-03862129v1
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A hybrid bioinspired catechol-alloxazine triangular nickel complex stabilizing protons and electrons

Agnideep Das , Hannah Jobelius , Jules Schleinitz , Stefani Gamboa-Ramirez , Geordie Creste et al.

Inorganic Chemistry Frontiers, 2021, 8 (24), pp.5286-5298. ⟨10.1039/D1QI01131F⟩

Article dans une revue hal-03578619v1
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Successes, challenges, and opportunities for quantum chemistry in understanding metalloenzymes for solar fuels research

Maylis Orio , Dimitrios A Pantazis

Chemical Communications, 2021, 57 (33), pp.3952-3974. ⟨10.1039/d1cc00705j⟩

Article dans une revue hal-03411777v1
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Magnetic exchange coupling in Cu dimers studied with modern multireference methods and broken-symmetry coupled cluster theory

Gurjot Singh , Stefani Gamboa , Maylis Orio , Dimitrios Pantazis , Michael Roemelt

Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 2021, 140 (10), pp.139. ⟨10.1007/s00214-021-02830-0⟩

Article dans une revue hal-03862126v1
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Unraveling the catalytic mechanisms of H 2 production with thiosemicarbazone nickel complexes

Alexandre Barrozo , Maylis Orio

RSC Advances, 2021, 11 (9), pp.5232-5238. ⟨10.1039/d0ra10212a⟩

Article dans une revue hal-03135551v1
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Self-assembled nickel cubanes as oxygen evolution catalysts

Ana C García-Álvarez , Stefani Gamboa-Ramírez , Diego Martínez-Otero , Maylis Orio , Ivan Castillo

Chemical Communications, 2021, 57, pp.8608 - 8611. ⟨10.1039/d1cc03227e⟩

Article dans une revue hal-03549840v1
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Quantum dynamics of Mn 2+ in dimethylammonium magnesium formate

Maylis Orio , J. K Bindra , J. van Tol , M. Giorgi , N. Dalal et al.

The Journal of Chemical Physics, 2021, 154 (15), pp.154201. ⟨10.1063/5.0046984⟩

Article dans une revue hal-03205428v1
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Unexpected rapid aerobic transformation of 2,2,6,6-tetraethyl-4-oxo (piperidin-1-yloxyl) radical by cytochrome P450 in the presence of NADPH: Evidence against a simple reduction of the nitroxide moiety to the hydroxylamine

Nikola Babić , Maylis Orio , Fabienne Peyrot

Free Radical Biology and Medicine, 2020, 156, pp.144-156. ⟨10.1016/j.freeradbiomed.2020.05.021⟩

Article dans une revue hal-02895031v1
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Role of the Metal Ion in Bio-Inspired Hydrogenase Models: Investigation of a Homodinuclear FeFe Complex vs Its Heterodinuclear NiFe Analogue

Lianke Wang , Marcello Gennari , Alexandre Barrozo , Jennifer Fize , Christian Philouze et al.

ACS Catalysis, 2020, 10 (1), pp.177-186. ⟨10.1021/acscatal.9b03212⟩

Article dans une revue hal-02406408v1
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Comparison of density functional and correlated wave function methods for the prediction of Cu(II) hyperfine coupling constants

Rogelio Gómez‐piñeiro , Dimitrios A Pantazis , Maylis Orio

ChemPhysChem, 2020, 21 (24), pp.2667-2679. ⟨10.1002/cphc.202000649⟩

Article dans une revue hal-03411757v1
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Electrochemical, Spectroscopic, and Computational Investigation of a Series of Polypyridyl Ruthenium(II) Complexes: Characterization of Reduced States

Nicolas Queyriaux , Charlène Esmieu , Arvind K Gupta , Laure Vendier , Sascha Ott et al.

ChemPhysChem, 2020, 13 (13), pp.1263-1270. ⟨10.1002/ejic.202001165⟩

Article dans une revue hal-03411768v1
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From non-innocent to guilty: on the role of redox-active ligands in the electro-assisted reduction of CO(2)mediated by a cobalt(ll)-polypyridyl complex

N. Queyriaux , K. Abel , J. Fize , J. Pécaut , Maylis Orio et al.

Sustainable Energy & Fuels, 2020, 4 (7), pp.3668-3676. ⟨10.1039/d0se00570c⟩

Article dans une revue hal-02909560v1
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Hydrogen evolution reaction mediated by an all-sulfur trinuclear nickel complex

Cyril Pieri , Anirban Bhattacharjee , Alexandre Barrozo , Bruno Faure , Michel Giorgi et al.

Chemical Communications, 2020, 56 (75), pp.11106-11109. ⟨10.1039/d0cc04174b⟩

Article dans une revue hal-02961657v1
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Electron Spin Resonance of Defects in Spin Chains— o-(DMTTF)2X: A Versatile System Behaving Like Molecular Magnet

Loic Soriano , Julian Zeisner , Vladislav Kataev , Olivier Pilone , Marc Fourmigue et al.

Applied Magnetic Resonance, 2020, 51 (11), pp.1307-1320. ⟨10.1007/s00723-020-01245-7⟩

Article dans une revue hal-02999563v1
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Optimizing Group Transfer Catalysis by Copper Complex with Redox-Active Ligand in an Entatic State

Yufeng Ren , Jeremy Forte , Khaled Cheaib , Nicolas Vanthuyne , Louis Fensterbank et al.

iScience, 2020, 23 (3), pp.UNSP 100955. ⟨10.1016/j.isci.2020.100955⟩

Article dans une revue hal-02887766v1
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Tuning Inner-Sphere Electron Transfer in a Series of Copper/Nitrosoarene Adducts

Mohammad Amin Askari , Farshid Effaty , Federica Gennarini , Maylis Orio , Nicolas Le Poul et al.

Inorganic Chemistry, 2020, 59, pp.8678 - 8689. ⟨10.1021/acs.inorgchem.9b03175⟩

Article dans une revue hal-02490219v1
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Ligand-based electronic effects on the electrocatalytic hydrogen production by thiosemicarbazone nickel complexes

Michael Papadakis , Alexandre Barrozo , Tatiana Straistari , Nicolas Queyriaux , Anisa Putri et al.

Dalton Transactions, 2020, 49 (16), pp.5064-5073. ⟨10.1039/c9dt04775a⟩

Article dans une revue hal-02877733v1
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Catalytic Reduction of Oxygen by a Copper Thiosemicarbazone Complex

Tatiana Straistari , Adina Morozan , Sergiu Shova , Marius Réglier , Maylis Orio et al.

European Journal of Inorganic Chemistry, 2020, 2020 (48), pp.4549-4555. ⟨10.1002/ejic.202000869⟩

Article dans une revue hal-03179025v2
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Neutral Lipophilic Palladium(II) Complexes and their Applications in Electrocatalytic Hydrogen Production and C-C Coupling Reactions

Olesea Cuzan-Munteanu , Dumitru Sirbu , Michel Giorgi , Sergiu Shova , Elizabeth A Gibson et al.

European Journal of Inorganic Chemistry, 2020, 2020, pp.813 - 822. ⟨10.1002/ejic.201901283⟩

Article dans une revue hal-03009779v1
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Magnetic resonance probing of ferroelectricity and magnetism in metal-organic frameworks

Nandita Abhyankar , S. Bertaina , Maylis Orio , Naresh S Dalal

Ferroelectrics, 2019, 534 (1), pp.11-18. ⟨10.1080/00150193.2018.1473484⟩

Article dans une revue hal-02339703v1
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Influence of the copper coordination spheres on the N2Or activity of a mixed-valent copper complex containing a {Cu2S} core

Charlène Esmieu , Maylis Orio , Stéphane Ménage , Stéphane Torelli

Inorganic Chemistry, 2019, 58 (17), pp.11649-11655. ⟨10.1021/acs.inorgchem.9b01594⟩

Article dans une revue hal-02274751v1
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Un duo gagnant pour la catalyse rédox

Maylis Orio , Sébastien Blanchard

L'Actualité Chimique, 2019

Article dans une revue hal-02190653v1
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When Light and Acid Play Tic-Tac-Toe with a Nine-State Molecular Switch

Clément Guerrin , Youssef Aidibi , Lionel Sanguinet , Philippe Leriche , Stephane Aloise et al.

Journal of the American Chemical Society, 2019, 141 (48), pp.19151-19160. ⟨10.1021/jacs.9b11048⟩

Article dans une revue hal-02406422v1
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Molecular electrocatalysts for Hydrogen Evolution Reaction: The input from quantum chemistry

Alexandre Barrozo , Maylis Orio

ChemSusChem, 2019, 12, pp.4905 - 4915. ⟨10.1002/cssc.201901828⟩

Article dans une revue hal-02336178v1
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Efficient Light-Driven Hydrogen Evolution Using a Thiosemicarbazone-Nickel (II) Complex

Stylianos Panagiotakis , Georgios Landrou , Vasilis Nikolaou , Anisa Putri , Renaud Hardré et al.

Frontiers in Chemistry, 2019, 7, pp.405. ⟨10.3389/fchem.2019.00405⟩

Article dans une revue hal-02190650v1

Influence of the Metal Ion on the Electrocatalytic Hydrogen Production by a Thiosemicarbazone Palladium Complex

Tatiana Straistari , Renaud M Hardré , Julien Massin , Mireille Attolini , Bruno Faure et al.

European Journal of Inorganic Chemistry, 2018, 20-21, pp.2259-2266

Article dans une revue hal-01948729v1
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Superlattice Induced by Charge Order in the Organic Spin Chain (TMTTF) 2 X ( X = SbF 6 , AsF 6 and PF 6 ) Revealed by High Field EPR

Charles-Emmanuel Dutoit , Anatoli Stepanov , Johan van Tol , Maylis Orio , Sylvain Bertaina

Journal of Physical Chemistry Letters, 2018, The Journal of Physical Chemistry Letters, 9, pp.5598. ⟨10.1021/acs.jpclett.8b02070⟩

Article dans une revue hal-01860270v1
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Measuring Motional Dynamics of [(CH 3 ) 2 NH 2 ] + in the Perovskite-Like Metal–Organic Framework [(CH 3 ) 2 NH 2 ][Zn(HCOO) 3 ]: The Value of Low-Frequency Electron Paramagnetic Resonance

Sylvain Bertaina , Nandita Abhyankar , Maylis Orio , Naresh S Dalal

Journal of Physical Chemistry C, 2018, 122 (28), pp.16431 - 16436. ⟨10.1021/acs.jpcc.8b04698⟩

Article dans une revue hal-01860254v1

Hydrogen evolution reaction catalyzed by a bis(thiosemicarbazone) cobalt complex: An experimental and theoretical study.

Tatiana Straistari , Renaud Hardré , Jennifer Fize , Sergiu Shova , Michel Giorgi et al.

Chemistry - A European Journal, 2018, 24 (35), pp.8779-8786. ⟨10.1002/chem.201801155⟩

Article dans une revue hal-01771020v1

Valence Localization at a Bio-inspired Mixed-Valent {Cu 2 S} 2+ Motif upon Solvation in Acetonitrile: Effect on Nitrous Oxide Reductase (N 2 Or) Activity

Charlène Esmieu , Maylis Orio , Jordan Mangue , Jacques Pécaut , Stéphane Ménage et al.

Chemistry - A European Journal, 2018, 24 (20), pp.5060 - 5063. ⟨10.1002/chem.201704737⟩

Article dans une revue hal-01771018v1
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Magneto-Structural and Computational Study of a Tetranuclear Copper Complex Displaying Carbonyl-π Interactions

Amélie Kochem , Bruno Faure , Sylvain Bertaina , Eric Riviere , Michel Giorgi et al.

European Journal of Inorganic Chemistry, 2018, 2018 (47), pp.5039-5046. ⟨10.1002/ejic.201801032⟩

Article dans une revue hal-02089367v1

Influence of the metal ion on the electrocatalytic hydrogen production by a thiosemicarbazone palladium complex

Tatiana Straistari , Renaud M Hardré , Julien Massin , Mireille Attolini , Bruno Faure et al.

European Journal of Inorganic Chemistry, 2018, pp.2259-2266

Article dans une revue hal-01771136v1

Copper-Catalyzed Aziridination with Redox-Active Ligands: Molecular Spin Catalysis

Yufeng Ren , Khaled Cheaib , Jérémy Jacquet , Hervé Vezin , Louis Fensterbank et al.

Chemistry - A European Journal, 2018, 24 (20), pp.5086 - 5090. ⟨10.1002/chem.201705649⟩

Article dans une revue hal-01771019v1
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Indolino-Oxazolidine Acido- and Photochromic System Investigated by NMR and Density Functional Theory Calculations

Clément Guerrin , György Szalóki , Jerôme Berthet , Lionel Sanguinet , Maylis Orio et al.

Journal of Organic Chemistry, 2018, 83 (17), pp.10409-10419. ⟨10.1021/acs.joc.8b01482⟩

Article dans une revue hal-02564565v1

An Air-Stable Molybdenum-Based Precatalyst in Oxygen-Atom Transfer Reactions

Emmanuel Oheix , Maylis Orio , Michel Giorgi , M. Réglier , Olga Iranzo et al.

European Journal of Inorganic Chemistry, 2018, 2018 (12), pp.1427-1434. ⟨10.1002/ejic.201701410⟩

Article dans une revue hal-01948731v1

Water Molecules Gating a Photoinduced One Electron Two Protons Transfer in a Tyr/His model of Photosystem II

Georgios Chararalambidis , Syamal Das , Adelais Trapali , Annamaria Quaranta , Maylis Orio et al.

Angewandte Chemie International Edition, 2018, ⟨10.1002/anie.201804498⟩

Article dans une revue hal-02176998v1
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Circumventing Intrinsic Metal Reactivity: Radical Generation with Redox-Active Ligands

Jérémy Jacquet , Khaled Cheaib , Yufeng Ren , Hervé Vezin , Maylis Orio et al.

Chemistry - A European Journal, 2017, 23 (60), pp.15030-15034. ⟨10.1002/chem.201704049⟩

Article dans une revue hal-01793183v1
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Characterization of Cu(II)-reconstituted ACC Oxidase using experimental and theoretical approaches

Nadia El Bakkali-Tahéri , Sybille Tachon , Maylis Orio , Sylvain Bertaina , Marlène Martinho et al.

Archives of Biochemistry and Biophysics, 2017, 623-624, pp.31 - 41. ⟨10.1016/j.abb.2017.03.012⟩

Article dans une revue hal-01627933v1

Understanding Ferroelectricity in the Pb-Free Perovskite-Like Metal–Organic Framework [(CH 3 ) 2 NH 2 ]Zn(HCOO) 3 : Dielectric, 2D NMR, and Theoretical Studies

Nandita Abhyankar , Jin Jung Kweon , Maylis Orio , Sylvain Bertaina , Minseong Lee et al.

Journal of Physical Chemistry C, 2017, ⟨10.1021/acs.jpcc.7b00596⟩

Article dans une revue hal-01492708v1
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Characterization of a Dinuclear Copper(II) Complex and Its Fleeting Mixed-Valent Copper(II)/Copper(III) Counterpart

Amélie Kochem , Federica Gennarini , Mehdi Yemloul , Maylis Orio , Nicolas Le Poul et al.

ChemPlusChem, 2017, 82 (4), pp.615 - 624. ⟨10.1002/cplu.201600636⟩

Article dans une revue hal-01624533v1
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Copper Complexes as Bioinspired Models for Lytic Polysaccharide Monooxygenases

Alda Lisa Concia , Maria Rosa Beccia , Maylis Orio , Francine Terra Ferre , Marciela Scarpellini et al.

Inorganic Chemistry, 2017, 56 (3), pp.1023 - 1026. ⟨10.1021/acs.inorgchem.6b02165⟩

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A Thiosemicarbazone-Nickel(II) Complex as Efficient Electrocatalyst for Hydrogen Evolution

Tatiana Straistari , Jennifer Fize , Sergiu Shova , Marius Réglier , Vincent Artero et al.

ChemCatChem, 2017, ⟨10.1002/cctc.201600967⟩

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Fusion of ultraviolet-visible and infrared transient absorption spectroscopy data to model ultrafast photoisomerization

Bruno Debus , Maylis Orio , Julien Rehault , Gotard Burdzinski , Cyril Ruckebusch et al.

Journal of Physical Chemistry Letters, 2017, 8 (15), pp.3530 - 3535. ⟨10.1021/acs.jpclett.7b01255⟩

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Redox-Innocent Metal-Assisted Cleavage of S–S Bond in a Disulfide-Containing Ligand

Charlène Esmieu , Maylis Orio , Laurent Le Pape , Colette Lebrun , Jacques Pécaut et al.

Inorganic Chemistry, 2016, 55 (12), pp.6208-6217. ⟨10.1021/acs.inorgchem.6b00819⟩

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Oxidative DNA Cleavage Promoted by a Phenoxyl-Radical Copper(II) Complex

Olesea Cuzan , Amélie Kochem , A. Jalila Simaan , Sylvain Bertaina , Bruno Faure et al.

European Journal of Inorganic Chemistry, 2016, 2016 (36), pp.5575 - 5584. ⟨10.1002/ejic.201601001⟩

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Changing the chemical and physical properties of high valent heterobimetallic bis-(μ-oxido) Cu–Ni complexes by ligand effects

Maria-Chrysanthi Kafentzi , Maylis Orio , Marius Réglier , Shenglai Yao , Uwe Kuhlmann et al.

Dalton Transactions, 2016, 45 (40), pp.15994 - 16000. ⟨10.1039/c6dt02391f⟩

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Coordination polymer structure and revisited hydrogen evolution catalytic mechanism for amorphous molybdenum sulfide.

Phong D. Tran , Thu V. Tran , Maylis Orio , Stéphane Torelli , Quang Duc Truong et al.

Nature Materials, 2016, 15 (6), pp.640-646. ⟨10.1038/nmat4588⟩

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Nickel-centred proton reduction catalysis in a model of [NiFe] hydrogenase.

Deborah Brazzolotto , Marcello Gennari , Nicolas Queyriaux , Trevor R. Simmons , Jacques Pécault et al.

Nature Chemistry, 2016, 8 (11), pp.1054-1060. ⟨10.1038/nchem.2575⟩

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Dinuclear iridium and rhodium complexes with bridging arylimidazolide-N3,C2 ligands: synthetic, structural, reactivity, electrochemical and spectroscopic studies†

Fan He , Laurent Ruhlmann , Jean-Paul Gisselbrecht , Sylvie Choua , Maylis Orio et al.

Dalton Transactions, 2015, 44, pp.17030-17044. ⟨10.1039/c5dt02403j⟩

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An experimental and theoretical investigation on pentacoordinated cobalt(III) complexes with an intermediate S=1 spin state: How halide ligands affect their magnetic anisotropy

Deborah Brazzolotto , Marcello Gennari , Shengying Yu , Jacques Pecaut , Mathieu Rouzieres et al.

Chemistry - A European Journal, 2015, 22 (3), pp.925-933. ⟨10.1002/chem.201502997⟩

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X-ray structure of a Ni(II)–tri-phenoxyl radical complex

Laurent Benisvy , Galina M Zats , Ohad Fleker , Dmitry S Yufit , Maylis Orio et al.

Dalton Transactions, 2015, pp.17924 - 17926. ⟨10.1039/c5dt03131a⟩

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Charge-ordering induces magnetic axes rotation in organic materials (TMTTF) 2 X (with X = SbF 6 , AsF 6 , and PF 6 )

C.-E. Dutoit , M. Dressel , A. Stepanov , Maylis Orio , S. Bertaina

Journal of Low Temperature Physics, 2015, 41, pp.942

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Pulsed-EPR evidence of a manganese(II) hydroxycarbonyl intermediate in the electrocatalytic reduction of carbon dioxide by a manganese bipyridyl derivative

M. Bourrez , M. Orio , F. Molton , H. Vezin , C. Duboc et al.

Angewandte Chemie International Edition, 2014, 53, pp.240-243. ⟨10.1002/anie.201306750⟩

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A Bio-Inspired Switch Based on Cobalt(II) Disulfide/Cobalt(III) Thiolate Interconversion

Marcello Gennari , Bertrand Gerey , Nikita Hall , Jacques Pécaut , Marie-Nöelle Collomb et al.

Angewandte Chemie International Edition, 2014, 53 (21), pp.5318-5321. ⟨10.1002/anie.201402125⟩

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N2O reduction at a dissymmetric {Cu2S}-containing mixed-valent center

Charlène Esmieu , Maylis Orio , Stéphane Torelli , Laurent Le Pape , Jacques Pécaut et al.

Chemical Science, 2014, 5 (12), pp.4774-4784. ⟨10.1039/C4SC01487A⟩

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Vanadium thiolate complexes for efficient and selective sulfoxidation catalysis: A mechanistic investigation

N. Hall , M. Orio , A. Jorge-Robin , B. Gennaro , C. Marchi-Delapierre et al.

Inorganic Chemistry, 2013, 52, pp.13424-13431. ⟨10.1021/ic4017504⟩

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One-electron oxidized copper(II) salophen complexes: phenoxyl versus diiminobenzene radical species

A. Kochem , O. Jarjayes , B. Baptiste , C. Philouze , H. Vezin et al.

Chemistry - A European Journal, 2012, 18, pp.1068 - 1072. ⟨10.1002/chem.201102882⟩

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Structure and dynamics of the excited states of 1,3-diarylisobenzofurans: an experimental and theoretical study

J. Jacq , S. Tseckhanovich , M. Orio , C. Einhorn , J. Einhorn et al.

Photochemistry and Photobiology, 2012, 88, pp.633 - 638. ⟨10.1111/j.1751-1097.2012.01090.x⟩

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Spin Interaction in Octahedral Zinc Complexes of Mono- and Diradical Schiff and Mannich Bases

M. Orio , C. Philouze , O. Jarjayes , F. Neese , F. Thomas

Inorganic Chemistry, 2010, 49 (2), pp.646 - 658. ⟨10.1021/ic901846u⟩

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Electropolymerized biotinylated poly (pyrrole–viologen) film as platform for the development of reagentless impedimetric immunosensors

Chantal Gondran , Maylis Orio , David Rigal , Bruno Galland , Laurent Bouffier et al.

Electrochemistry Communications, 2010, 12 (2), pp.311 - 314. ⟨10.1016/j.elecom.2009.12.026⟩

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X-Ray Structures of Copper(II) and Nickel(II) Radical Salen Complexes: The Preference of Galactose Oxidase for Copper(II)

Maylis Orio , Olivier Jarjayes , Hussein Kanso , Christian Philouze , Frank Neese et al.

Angewandte Chemie International Edition, 2010, 49 (29), pp.4989 - 4992. ⟨10.1002/anie.201001040⟩

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Separation of Geometric Isomers of a Dicopper Complex by Using a 19F-Labeled Ligand: Dynamics, Structures, and DFT Calculations

Durot Stéphanie , Leila Hossain , Sylvain Hamman , Jamet Hélène , Maylis Orio et al.

Inorganic Chemistry, 2010, 49 (17), pp.7832-7840. ⟨10.1021/ic1006567⟩

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Theoretical magnetochemistry of dinuclear manganese complexes: broken symmetry density functional theory investigation on the influence of bridging motifs on structure and magnetism

Dimitrios Pantazis , Vera Krewald , Maylis Orio , Frank Neese

Dalton Transactions, 2010, 39 (20), pp.4959. ⟨10.1039/C001286F⟩

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Unsymmetrical one-electron oxidized Ni(ii)–bis(salicylidene) complexes: a protonation-induced shift of the oxidation site

Amélie Kochem , Maylis Orio , Olivier Jarjayes , Frank Neese , Fabrice Thomas

Chemical Communications, 2010, 46 (36), ⟨10.1039/c0cc01775b⟩

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Reversible Apical Coordination of Imidazole between the Ni(III) and Ni(II) Oxidation States of a Dithiolate Complex: A Process Related to the Ni Superoxide Dismutase

Marcello Gennari , Maylis Orio , Jacques Pécaut , Frank Neese , Marie-Noëlle Collomb et al.

Inorganic Chemistry, 2010, 49 (14), pp.6399 - 6401. ⟨10.1021/ic100945n⟩

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Density functional theory

Maylis Orio , Dimitrios Pantazis , Frank Neese

Photosynthesis Research, 2009, 102 (2-3), pp.443-453. ⟨10.1007/s11120-009-9404-8⟩

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A New Quantum Chemical Approach to the Magnetic Properties of Oligonuclear Transition‐Metal Complexes: Application to a Model for the Tetranuclear Manganese Cluster of Photosystem II

Dimitrios A. Pantazis , Maylis Orio , Taras Petrenko , Samir Zein , Eckhard Bill et al.

Chemistry - A European Journal, 2009, 15 (20), pp.5108-5123. ⟨10.1002/chem.200802456⟩

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Structure of the oxygen-evolving complex of photosystem II: information on the S2 state through quantum chemical calculation of its magnetic properties

Dimitrios Pantazis , Maylis Orio , Taras Petrenko , Samir Zein , Wolfgang Lubitz et al.

Physical Chemistry Chemical Physics, 2009, 11 (31), pp.6788. ⟨10.1039/B907038A⟩

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Trinuclear terpyridine frustrated spin system with a Mn(IV)3O4 core: synthesis, physical characterization, and quantum chemical modeling of its magnetic properties.

Carole Baffert , Maylis Orio , Dimitrios A Pantazis , Carole Duboc , Allan G Blackman et al.

Inorganic Chemistry, 2009, 48 (21), pp.10281-8. ⟨10.1021/ic901409y⟩

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Magnetic and Spectroscopic Properties of Mixed Valence Manganese(III,IV) Dimers: A Systematic Study Using Broken Symmetry Density Functional Theory

Maylis Orio , Dimitrios Pantazis , Taras Petrenko , Frank Neese

Inorganic Chemistry, 2009, 48 (15), pp.7251-7260. ⟨10.1021/ic9005899⟩

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Variation of Average g Values and Effective Exchange Coupling Constants among [2Fe−2S] Clusters: A Density Functional Theory Study of the Impact of Localization (Trapping Forces) versus Delocalization (Double-Exchange) as Competing Factors

Maylis Orio , Jean-Marie Mouesca

Inorganic Chemistry, 2008, 47 (12), pp.5394-5416. ⟨10.1021/ic701730h⟩

Article dans une revue istex hal-05541967v1