Publications associées à Reaction pathway of oxygen evolution on Pt(111) revealed through constant Fermi level molecular dynamics

Grand canonical simulations of electrochemical interfaces in implicit solvation models

Nicola Marzari, Oliviero Andreussi, Nicolas Georg Hörmann

We discuss grand canonical simulations based on density-functional theory to study the thermodynamic properties of electrochemical interfaces of metallic electrodes in aqueous environments. Water is represented using implicit solvation, here via the self-c ...

AMER INST PHYSICS2019

Electrochemical Behavior of Carbon Electrodes for In Situ Redox Studies in a Transmission Electron Microscope

Vasiliki Tileli, Robin Pierre Alain Girod, Nikolaos Nianias

Electrochemical liquid cell transmission electron microscopy (TEM) is a unique technique for probing nanocatalyst behavior during operation for a range of different electrocatalytic processes, including hydrogen evolution reaction (HER), oxygen evolution r ...

CAMBRIDGE UNIV PRESS2019

Highly Active Nanoperovskite Catalysts for Oxygen Evolution Reaction: Insights into Activity and Stability of Ba0.5Sr0.5Co0.8Fe0.2O2+delta and PrBaCo2O5+delta

Nicola Marzari, Ivano Eligio Castelli, Xi Cheng

It is shown that producing PrBaCo2O5+delta and Ba0.5Sr0.5Co0.8Fe0.2O2+delta nanoparticle by a scalable synthesis method leads to high mass activities for the oxygen evolution reaction (OER) with outstanding improvements by 10x and 50x, respectively, compar ...

WILEY-V C H VERLAG GMBH2018

Injectable, self-opening, and freestanding retinal prosthesis for fighting blindness made of conjugated polymers

Diego Ghezzi, Kevin Sivula, Marta Jole Ildelfonsa Airaghi Leccardi, Laura Ferlauto

Fighting blindness with retinal prostheses requires challenges not yet achieved: implanting a prosthesis (i) large enough to cover the retinal surface and (ii) embedding a high number of highly dense stimulatory elements. We developed an injectable, self-o ...

2017

Rationalizing the In Vivo Degradation of Metal-on-Metal Artificial Hip Joints Using Tribocorrosion Concepts

Stefano Mischler, Shoufan Cao

In this study, the in vivo degradation of metal-on-metal (MoM) artificial hip joints was assessed based on the present state of the art concepts of tribocorrosion. A recently developed tribocorrosion model, based on the combination of mechanical and corros ...

Natl Assoc Corrosion Eng2017

Scalable Row/Column Addressing of Silicon Photonic MEMS Switches

Niels Quack

In this letter, we demonstrate a scalable addressing scheme for silicon photonic MEMS switches. For a crossbar architecture switch fabric of dimension N x N, the row/column addressing scales with 2 . N electrodes, much reduced from the N-2 electrodes in in ...

Institute of Electrical and Electronics Engineers2016

Scalable Row/Column Addressing of Silicon Photonic MEMS Switches

Niels Quack

Ieee-Inst Electrical Electronics Engineers Inc2016

Hydrogen and Hydrogen Peroxide Formation in Trifluorotoluene-Water Biphasic Systems

Hubert Girault, Jonnathan Cesar Hidalgo Acosta

Hydrogen or hydrogen peroxide can be generated in liquid-liquid biphasic systems, where the organic phase contains sufficiently strong electron donor (whose redox potential is lower than the potential of reversible hydrogen electrode). H2O2 generation with ...

Amer Chemical Soc2014

Study of the Redox Properties of Singlet and Triplet Tris(2,2 '-bipyridine)ruthenium(II) ([Ru(bpy)(3)](2+)) in Aqueous Solution by Full Quantum and Mixed Quantum/Classical Molecular Dynamics Simulations

Ursula Röthlisberger, Ivano Tavernelli, Polydefkis Diamantis, Jérôme Florian Gonthier

The oxidation of ground-state (singlet) and triplet Ru(bpy)(3) were studied by full quantum-mechanical (QM) and mixed quantum/classical (QM/MM) molecular dynamics simulations. Both approaches provide reliable results for the redox potentials of the t ...

2014

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Reaction pathway of oxygen evolution on Pt(111) revealed through constant Fermi level molecular dynamics

Grand canonical simulations of electrochemical interfaces in implicit solvation models

Electrochemical Behavior of Carbon Electrodes for In Situ Redox Studies in a Transmission Electron Microscope

Highly Active Nanoperovskite Catalysts for Oxygen Evolution Reaction: Insights into Activity and Stability of Ba0.5Sr0.5Co0.8Fe0.2O2+delta and PrBaCo2O5+delta

Injectable, self-opening, and freestanding retinal prosthesis for fighting blindness made of conjugated polymers

Rationalizing the In Vivo Degradation of Metal-on-Metal Artificial Hip Joints Using Tribocorrosion Concepts

Scalable Row/Column Addressing of Silicon Photonic MEMS Switches

Scalable Row/Column Addressing of Silicon Photonic MEMS Switches

Effects of Ti Buffer Layer on Retention and Electrical Characteristics of Cu-Based Conductive-Bridge Random Access Memory (CBRAM) Electronic Materials and Processing

Hydrogen and Hydrogen Peroxide Formation in Trifluorotoluene-Water Biphasic Systems

Study of the Redox Properties of Singlet and Triplet Tris(2,2 '-bipyridine)ruthenium(II) ([Ru(bpy)(3)](2+)) in Aqueous Solution by Full Quantum and Mixed Quantum/Classical Molecular Dynamics Simulations

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Grand canonical simulations of electrochemical interfaces in implicit solvation models

Scalable Row/Column Addressing of Silicon Photonic MEMS Switches

Electrochemical Behavior of Carbon Electrodes for In Situ Redox Studies in a Transmission Electron Microscope

Injectable, self-opening, and freestanding retinal prosthesis for fighting blindness made of conjugated polymers

Rationalizing the In Vivo Degradation of Metal-on-Metal Artificial Hip Joints Using Tribocorrosion Concepts

Highly Active Nanoperovskite Catalysts for Oxygen Evolution Reaction: Insights into Activity and Stability of Ba0.5Sr0.5Co0.8Fe0.2O2+delta and PrBaCo2O5+delta

Scalable Row/Column Addressing of Silicon Photonic MEMS Switches

Hydrogen and Hydrogen Peroxide Formation in Trifluorotoluene-Water Biphasic Systems

Effects of Ti Buffer Layer on Retention and Electrical Characteristics of Cu-Based Conductive-Bridge Random Access Memory (CBRAM) Electronic Materials and Processing

Study of the Redox Properties of Singlet and Triplet Tris(2,2 '-bipyridine)ruthenium(II) ([Ru(bpy)(3)](2+)) in Aqueous Solution by Full Quantum and Mixed Quantum/Classical Molecular Dynamics Simulations