Data Science Based Mg Corrosion Engineering

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In Situ Monitoring of the Surface Evolution of a Silver Electrode from Polycrystalline to Well-Defined Structures

Yunchang Liang

Capturing the surface-structural dynamics of metal electrocatalysts under certain electrochemical environments is intriguingly desired for understanding the behavior of various metal-based electrocatalysts. However, in situ monitoring of the evolution of a ...

AMER CHEMICAL SOC2022

A general and efficient framework for atomistic machine learning

Félix Benedito Clément Musil

Over the last two decades, many technological and scientific discoveries, ranging from the development of materials for energy conversion and storage through the design of new drugs, have been accelerated by the use of preliminary in silico experiments, to ...

EPFL2021

A Crevice Corrosion Model for Biomedical Trunnion Geometries and Surfaces Feature

Stefano Mischler, Anna Neus Igual Muñoz, Angela Bermudez Castañeda

Modular hip joint implants were introduced in arthroplasty medical procedures because they facilitate the tailoring of patients’ anatomy, the use of different materials in one single configuration, as well as medical revision. However, in certain cases, su ...

2021

Investigation of the specificity and mechanism of action of the ULK1/AMPK inhibitor SBI-0206965

Katyayanee Neopane

SBI-0206965, originally identified as an inhibitor of the autophagy initiator kinase ULK1, has recently been reported as a more potent and selective AMP-activated protein kinase (AMPK) inhibitor relative to the widely used, but promiscuous inhibitor Compou ...

2021

Azole-Based Indoleamine 2,3-Dioxygenase 1 (IDO1) Inhibitors

Pierre Vogel, George Coukos, Florence Pojer, Somi Reddy Majjigapu, Aline Emma Christine Reynaud

The heme enzyme indoleamine 2,3-dioxygenase 1 (IDO1) plays an essential role in immunity, neuronal function, and aging through catalysis of the rate-limiting step in the kynurenine pathway of tryptophan metabolism. Many IDO1 inhibitors with different chemo ...

AMER CHEMICAL SOC2021

Emergence of Potential-Controlled Cu-Nanocuboids and Graphene-Covered Cu-Nanocuboids under Operando CO2 Electroreduction

Magalí Alejandra Lingenfelder, Fernando Pablo Cometto, Karla Banjac, Thanh Hai Phan

The electroreduction of CO2 (CO2RR) is a promising strategy toward sustainable fuels. Cu is the only Earth-abundant and pure metal capable of catalyzing CO2-to-hydrocarbons conversion with significant Faradaic efficiencies; yet, its dynamic structure under ...

AMER CHEMICAL SOC2021

Fretting-corrosion behavior of electroless Ni-P/Ni-P-TiO2 coatings obtained on AZ91D magnesium alloy by a chromium-free process

Stefano Mischler, Angela Bermudez Castañeda

Ni-P electroless coatings are widely applied for protection of magnesium alloys and other materials due to the low energy consumption of the process and high resistance to corrosion and wear, properties that can be improved with the incorporation of partic ...

ELSEVIER2020

Modeling Current Transients in a Reciprocal Motion Tribocorrosion Experiment

Stefano Mischler, Anna Neus Igual Muñoz, Shoufan Cao

Tribocorrosion of passivating metals is a dynamic phenomenon causing degradation of materials by a combination of mechanical wear and electrochemical dissolution. The mechanical action typically produces a local removal of particles, metal as well as oxide ...

ELECTROCHEMICAL SOC INC2021

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

Stefano Mischler, Shoufan Cao

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

Multiaxial fatigue behavior and strengthening of riveted double-angle connections in steel bridges using prestressed CFRP rods

Hossein Heydarinouri

A large number of aging road and railway riveted metallic bridges suffer from fatigue problems. Stringer-to-floor-beam double-angle bridge connections are among the most fatigue-prone details due to the many cyclic distortion-induced stresses from axle loa ...

EPFL2021

Tribocorrosion behaviour of pure titanium in bovine serum albumin solution: A multiscale study

Anna Neus Igual Muñoz

Tribocorrosion behaviour of pure titanium in phosphate buffer saline (PBS) solution has been investigated systematically as a function of surface chemistry and bovine serum albumin (BSA) content in the solution. A ball-on-disk tribometer coupled with an el ...

ELSEVIER2020

Transferable machine-learning models of complex materials: the case of GaAs

Giulio Imbalzano

Molecular simulations allow to investigate the behaviour of materials at the atomistic level, shedding light on phenomena that cannot be directly observed in experiments. Accurate results can be obtained with ab initio methods, while simulations of large-s ...

EPFL2021