Publication

Lyapunov exponents of Green's functions for random potentials tending to zero

Publications associées (31)

Mapping of Chemical Heterogeneity at Surfaces with High-Throughput Wide-Field Second Harmonic Microscopy

Many industrial processes are based on electrochemical reactions using engineered electrocatalysts. However, the current lack of theoretical knowledge obscures efforts to maximize catalysts' efficiency, and the optimization process is mostly empirical. To ...

EPFL2020

Influence of Bovine Serum Albumin (BSA) on the Tribocorrosion Behaviour of a Low Carbon CoCrMo Alloy in Simulated Body Fluids

Stefano Mischler, Shoufan Cao, Choshun Yoneyama

Tribocorrosion, as the interaction between mechanical wear and electrochemical corrosion, has been found to be the main problem causing the failure and limiting the lifetime of metal-on-metal artificial hip joints. Better understanding of the tribocorrosio ...

2020

Mapping Electrochemical Heterogeneity at Gold Surfaces: A Second Harmonic Imaging Study

Arianna Marchioro, Sylvie Roke, Igor Nahálka

Designing efficient catalysts requires correlating surface structure and local chemical composition with reactivity on length scales from nanometers to tens of microns. While much work has been done on this structure/function correlation on single crystals ...

2020

Electrosorption at metal surfaces from first principles

Nicola Marzari

Electrosorption of solvated species at metal electrodes is a most fundamental class of processes in interfacial electrochemistry. Here, we use its sensitive dependence on the electric double layer to assess the performance of ab initio thermodynamics appro ...

NATURE PUBLISHING GROUP2020

Non-equilibrium kinetics and trajectory thermodynamics of synthetic molecular pumps

Cristian Pezzato

A major goal in the design of synthetic molecular machines is the creation of pumps that can use the input of energy to transport material from a reservoir at low chemical potential to a different reservoir at higher chemical potential, thereby forming and ...

ROYAL SOC CHEMISTRY2020

Equation of State of Fluid Methane from First Principles with Machine Learning Potentials

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The predictive simulation of molecular liquids requires potential energy surface (PES) models that are not only accurate but also computationally efficient enough to handle the large systems and long time scales required for reliable prediction of macrosco ...

AMER CHEMICAL SOC2019

Compressive sensing adaptation for polynomial chaos expansions

Panagiotis Tsilifis

Basis adaptation in Homogeneous Chaos spaces rely on a suitable rotation of the underlying Gaussian germ. Several rotations have been proposed in the literature resulting in adaptations with different convergence properties. In this paper we present a new ...

ACADEMIC PRESS INC ELSEVIER SCIENCE2019

Light-Enhanced Blue Energy Generation Using MoS2 Nanopores

Andras Kis, Aleksandra Radenovic, Michael Graf, Martina Lihter, Dmitrii Unuchek, Aditya Sarathy

Blue energy relies on the chemical potential difference between solutions of high and low ionic concentrations, potentially providing an independent energy source at estuaries around the world. The energy conversion relies on reverse electrodialysis via io ...

2019

Electrochemical Dynamics of a Single Platinum Nanoparticle Collision Event for the Hydrogen Evolution Reaction

Haiqiang Deng, Pekka Eero Peljo

Chronoamperometry was used to study the dynamics of Pt nanoparticle (NP) collision with an inert ultramicroelectrode via electrocatalytic amplification (ECA) towards hydrogen evolution reaction. First, ECA and dynamic light scattering (DLS) results reveal ...

Wiley-VCH Verlag GmbH2018

Electrochemical potential window of battery electrolytes: the HOMO-LUMO misconception

Hubert Girault, Pekka Eero Peljo

A widespread misconception in the lithium ion battery literature is the equality of the energy difference of HOMO and LUMO of the solvent with the electrochemical stability window. HOMO and LUMO are concepts derived from approximated electronic structure t ...

2018

Photosensitized Hydrogen Evolution on a Floating Electrocatalyst Coupled to Electrochemical Recycling

Hubert Girault, Astrid Johana Olaya Avendano, Jonnathan Cesar Hidalgo Acosta, Terumasa Omatsu

Photoexcited protonated tetrathiafulvalene (HTTF+) was found to act as a photosensitizer, injecting electrons into Pt microparticles (floating electrocatalysts) to produce H2 and TTF•+ in acidic acetonitrile. In addition, TTF•+ was electrochemically reduce ...

2018