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Catalysis

Working Paper

The role of hydrophobic hydration in the free energy of chemical reactions at the gold/water interface: size and position effects

Alessandra Serva, Martina Havenith, Simone Pezzotti

Version 1 posted 31 August 2021

412

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Catalysis

Working Paper

S.O.S: shape, orientation and size tune solvation in electrocatalysis

alessandra serva, Simone Pezzotti

Version 1 posted 26 December 2023

303

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Energy

Working Paper

Nanostructural Organization in a Biredox Ionic Liquid

Roxanne Berthin, Alessandra Serva, Olivier Fontaine, Mathieu Salanne

Version 1 posted 03 November 2022

215

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Theoretical and Computational Chemistry

Working Paper

MetalWalls: Simulating electrochemical interfaces between polarizable electrolytes and metallic electrodes

Alessandro Coretti, Camille Bacon, Roxanne Berthin, Alessandra Serva, Laura Scalfi, Iurii Chubak, Kateryna Goloviznina, Matthieu Haefele, Abel Marin-Laflèche, Benjamin Rotenberg, Sara Bonella, Mathieu Salanne

Version 1 posted 07 June 2022

572

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Physical Chemistry

Working Paper

Speciation of the proton in water-in-salt electrolytes

Kateryna Goloviznina, Alessandra Serva, Mathieu Salanne

Version 1 posted 21 February 2024

368

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Inorganic Chemistry

Working Paper

The Fate of Water at the Electrochemical Interfaces: Electrochemical Behavior of Free Water vs. Coordinating Water

Nicolas Dubouis, Alessandra Serva, Elodie Salager, Michael Deschamps, Mathieu Salanne, Alexis Grimaud

Version 2 posted 05 November 2018

1,228

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Physical Chemistry

Working Paper

Solvation of anthraquinone and Tempo redox-active species in acetonitrile using a polarizable force field

Roxanne Berthin, Alessandra Serva, Kyle Reeves, Esther Heid, Christian Schroeder, Mathieu Salanne

Version 1 posted 29 June 2021

442

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Catalysis

Working Paper

Tuning the Water Reduction Through Controlled Nanoconfinement Within an Organic Liquid Matrix

Nicolas Dubouis, Alessandra Serva, Roxanne Berthin, Guillaume Jeanmairet, Benjamin Porcheron, Elodie Salager, Mathieu Salanne, Alexis Grimaud

Version 2 posted 01 June 2020

1,485

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Energy

Working Paper

Simulating the charging mechanism of a realistic nanoporous carbon-based supercapacitor using a fully polarizable model

Camille Bacon, Patrice Simon, Mathieu Salanne, Alessandra Serva

Version 1 posted 19 February 2024

437

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Physical Chemistry

Working Paper

Correlating substrates reactivity at electrified interfaces with electrolyte structure in synthetically relevant organic solvent/water mixtures

Florian Dorchies, Alessandra Serva, Astrid Sidos, Laurent Michot, Michaël Deschamps, Mathieu Salanne, Alexis Grimaud

Version 2 posted 03 June 2024

445

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Refine Search

17 results in ALESSANDRA SERVA in Authors: ALESSANDRA SERVA

The role of hydrophobic hydration in the free energy of chemical reactions at the gold/water interface: size and position effects

S.O.S: shape, orientation and size tune solvation in electrocatalysis

Nanostructural Organization in a Biredox Ionic Liquid

MetalWalls: Simulating electrochemical interfaces between polarizable electrolytes and metallic electrodes

Speciation of the proton in water-in-salt electrolytes

The Fate of Water at the Electrochemical Interfaces: Electrochemical Behavior of Free Water vs. Coordinating Water

Solvation of anthraquinone and Tempo redox-active species in acetonitrile using a polarizable force field

Tuning the Water Reduction Through Controlled Nanoconfinement Within an Organic Liquid Matrix

Simulating the charging mechanism of a realistic nanoporous carbon-based supercapacitor using a fully polarizable model

Correlating substrates reactivity at electrified interfaces with electrolyte structure in synthetically relevant organic solvent/water mixtures

17 results in Authors: ALESSANDRA SERVA