Search Results - "Chiter, Fatah" :: K.UTB vyhledávací portál

DFT study of n-alkyl carboxylic acids on oxidized aluminum surfaces: From standalone molecules to self-assembled-monolayers

by Poberžnik, Matic, Chiter, Fatah, Milošev, Ingrid, Marcus, Philippe, Costa, Dominique, Kokalj, Anton
Published in Applied surface science (30.09.2020)

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Corrosion inhibition of locally de-passivated surfaces by DFT study of 2-mercaptobenzothiazole on copper

by Chiter, Fatah, Costa, Dominique, Maurice, Vincent, Marcus, Philippe
Published in Npj Materials degradation (30.09.2021)

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Corrosion inhibition at emergent grain boundaries studied by DFT for 2-mercaptobenzothiazole on bi-crystalline copper

by Chiter, Fatah, Costa, Dominique, Maurice, Vincent, Marcus, Philippe
Published in Npj Materials degradation (13.01.2023)

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DFT investigation of 2-mercaptobenzothiazole adsorption on model oxidized copper surfaces and relationship with corrosion inhibition

by Chiter, Fatah, Costa, Dominique, Maurice, Vincent, Marcus, Philippe
Published in Applied surface science (30.01.2021)

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DFT-Based Cu(111)||Cu2O(111) Model for Copper Metal Covered by Ultrathin Copper Oxide: Structure, Electronic Properties, and Reactivity

by Chiter, Fatah, Costa, Dominique, Maurice, Vincent, Marcus, Philippe
Published in Journal of physical chemistry. C (06.08.2020)

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Chemical interaction, self-ordering and corrosion inhibition properties of 2-mercaptobenzothiazole monolayers: DFT atomistic modeling on metallic copper

by Chiter, Fatah, Costa, Dominique, Maurice, Vincent, Marcus, Philippe
Published in Corrosion science (01.12.2022)

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Adsorption of 2-mercaptobenzimidazole Corrosion Inhibitor on Copper: DFT Study on Model Oxidized Interfaces

by Chiter, Fatah, Costa, Dominique, Maurice, Vincent, Marcus, Philippe
Published in Journal of the Electrochemical Society (01.12.2020)

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Atomic Scale Insight into Corrosion Inhibition: DFT Study of 2-Mercaptobenzimidazole on Locally De-Passivated Copper Surfaces

by Chiter, Fatah, Costa, Dominique, Maurice, Vincent, Marcus, Philippe
Published in Journal of the Electrochemical Society (01.12.2021)

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ToF-SIMS, XPS and DFT study of the adsorption of 2-mercaptobenzothiazole on copper in neutral aqueous solution and corrosion protection in chloride solution

by Vernack, Eléa, Zanna, Sandrine, Seyeux, Antoine, Costa, Dominique, Chiter, Fatah, Tingaut, Philippe, Marcus, Philippe
Published in Corrosion science (01.01.2023)

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Insight at the atomic scale of corrosion inhibition: DFT study of 8-hydroxyquinoline on oxidized aluminum surfaces

by Chiter, Fatah, Costa, Dominique, Pébère, Nadine, Marcus, Philippe, Lacaze-Dufaure, Corinne
Published in Physical chemistry chemical physics : PCCP (01.02.2023)

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On the identification of favourable factors for corrosion inhibition of aluminium by 8-hydroxyquinoline and its derivatives: DFT and electrochemical studies

by Chiter, Fatah, Bulteau, Yann, Bonin, Pierre, Pébère, Nadine, Lacaze-Dufaure, Corinne
Published in Corrosion science (01.06.2024)

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DFT Study of Cl− Ingress into Organic Self-Assembled Monolayers on Aluminum

by Chiter, Fatah, Costa, Dominique, Poberžnik, Matic, Milošev, Ingrid, Marcus, Philippe, Kokalj, Anton
Published in Journal of the Electrochemical Society (14.07.2023)

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DFT-Based Cu(111)||Cu 2 O(111) Model for Copper Metal Covered by Ultrathin Copper Oxide: Structure, Electronic Properties, and Reactivity

by Chiter, Fatah, Costa, Dominique, Maurice, Vincent, Marcus, Philippe
Published in Journal of physical chemistry. C (06.08.2020)

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DFT investigation of 2-mercaptobenzothiazole adsorption on model oxidized copper surfaces and relationship with corrosion inhibition

by Chiter, Fatah, Costa, Dominique, Maurice, Vincent, Marcus, Philippe
Published in Applied surface science (01.01.2021)

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Correction: Insight at the atomic scale of corrosion inhibition: DFT study of 8-hydroxyquinoline on oxidized aluminum surfaces

by Chiter, Fatah, Costa, Dominique, Pébère, Nadine, Marcus, Philippe, Lacaze-Dufaure, Corinne
Published in Physical chemistry chemical physics : PCCP (15.02.2023)

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DFT studies of the bonding mechanism of 8-hydroxyquinoline and derivatives on the (111) aluminum surface

by Chiter, Fatah, Lacaze-Dufaure, Corinne, Tang, Hao, Pébère, Nadine
Published in Physical chemistry chemical physics : PCCP (01.01.2015)

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Capture of Iodine Species in MIL-53(Al), MIL-120(Al), and HKUST-1(Cu) Periodic DFT and Ab-Initio Molecular Dynamics Studies

by Chibani, Siwar, Chiter, Fatah, Cantrel, Laurent, Paul, Jean-François
Published in Journal of physical chemistry. C (16.11.2017)

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In Situ EC-STM Study and DFT Modeling of the Adsorption of Glycerol on Cu(111) in NaOH Solution

by Abrahami, Shoshan, Chiter, Fatah, Klein, Lorena, Maurice, Vincent, Terryn, Herman, Costa, Dominique, Marcus, Philippe
Published in Journal of physical chemistry. C (16.08.2019)

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Corrosion protection of Al(111) by 8-hydroxyquinoline: a comprehensive DFT study

by Chiter, Fatah, Bonnet, Marie-Laure, Lacaze-Dufaure, Corinne, Tang, Hao, Pébère, Nadine
Published in Physical chemistry chemical physics : PCCP (2018)

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In Situ EC-STM Study and DFT Modeling of the Adsorption of Glycerol on Cu(111) in NaOH Solution

by Abrahami, Shoshan T, Chiter, Fatah, Klein, Lorena H, Maurice, Vincent, Terryn, Herman, Costa, Dominique, Marcus, Philippe
Published in Journal of physical chemistry. C (12.09.2019)

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