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Publications associées (27)

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Publications associées (27)

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Influence of aerosol acidity and organic ligands on transition metal solubility and oxidative potential of fine particulate matter in urban environments

Athanasios Nenes, Gerhard Lammel

The adverse health effects of air pollution around the world have been associated with the inhalation of fine particulate matter (PM2.5). Such outcomes are thought to be related to the induction of oxidative stress due to the excess formation of reactive o ...

Elsevier2023

Efficient Semiclassical Evaluation of Electronic Coherences in Polyatomic Molecules

Jiri Vanicek, Nikolay Golubev

Exposing a molecule to an intense light pulse can create a nonstationary quantum state, thus launching correlated dynamics of electrons and nuclei. Although much had been achieved in the understanding of fundamental physics behind the electron-nuclear inte ...

SWISS CHEMICAL SOC2022

Modeling non-covalent interactions in condensed phase

Veronika Juraskova

The modeling of non-covalent interactions, solvation effects, and chemical reactions in complex molecular environment is a challenging task. Current state-of-the-art approaches often rely on static computations using implicit solvent models and harmonic ap ...

EPFL2022

Identifying the mediators of intracellular E. coli inactivation under UVA light: The (photo) Fenton process and singlet oxygen

César Pulgarin, Stefanos Giannakis

Solar disinfection (SODIS) was probed for its underlying mechanism. When Escherichia coli was exposed to UVA irradiation, the dominant solar fraction acting in SODIS process, cells exhibited a shoulder before death ensued. This profile resembles cell killi ...

PERGAMON-ELSEVIER SCIENCE LTD2022

Carbon K-edge x-ray emission spectroscopy of gas phase ethylenic molecules

Majed Chergui, Camila Bacellar Cases Da Silveira, Rebecca Ann Ingle, Luca Longetti, Thomas Roland Barillot

We report on the C K-edge x-ray absorption spectra and the resonant (RXES) and non-resonant (NXES) x-ray emission spectra of ethylene, allene and butadiene in the gas phase. The RXES and NXES show clear differences for the different molecules. Overall both ...

IOP Publishing2022

Permanganate Reduction by Hydrogen Peroxide: Formation of Reactive Manganese Species and Superoxide and Enhanced Micropollutant Abatement

Urs von Gunten

Permanganate (MnO4-, Mn(VII)) is widely applied at the initial stage of water treatment to, e.g., abate taste and odor compounds, Mn(II) and Fe(II). However, its selectivity limits its application for micropollutant abatement. Hydrogen peroxide (H2O2), whi ...

AMER CHEMICAL SOC2021

Enhanced Treatment of Municipal Wastewater Effluents by Fe-TAML/H2O2: Efficiency of Micropollutant Abatement

Urs von Gunten

Combining iron with a tetraamido-macrocyclic ligand (Fe-TAML) as a catalyst and with hydrogen peroxide (H2O2) as the bulk oxidant is a process that has been suggested for the oxidative abatement of micropollutants during water treatment. In this study, the ...

AMER CHEMICAL SOC2021

Kinetics of the reaction between hydrogen peroxide and aqueous iodine: Implications for technical and natural aquatic systems

Urs von Gunten, Jaedon Shin

Oxidative treatment of iodide-containing waters can lead to a formation of potentially toxic iodinated disinfection byproducts (I-DBPs). Iodide (I-) is easily oxidized to HOI by various oxidation processes and its reaction with dissolved organic matter (DO ...

2020

Kinetic and mechanistic aspects of selenite oxidation by chlorine, bromine, monochloramine, ozone, permanganate, and hydrogen peroxide

Urs von Gunten

Selenium (mainly in the forms of selenite (Se(IV)) and selenate (Se(VI)) is a regulated drinking water contaminant, but there is little information on the kinetics and mechanisms of Se(IV) oxidation during water treatment. Species-specific and apparent sec ...

2019

Photoredox-Catalyzed Decarboxylation for the Transfer of Alkynes and Nitriles Using Hypervalent Iodine Reagents

Franck Le Vaillant

Aliphatic alkynes and nitriles are privileged motifs in organic chemistry. Therefore, alkynes and nitriles have played a central role for the exploration and development of novel strategies to forge C-C bonds in efficient manner. They are broadly used as v ...

EPFL2019

Photocatalytic Performance of CuxO/TiO2 Deposited by HiPIMS on Polyester under Visible Light LEDs: Oxidants, Ions Effect, and Reactive Oxygen Species Investigation

Sami Rtimi

In the present study, we propose a new photocatalytic interface prepared by high-power impulse magnetron sputtering (HiPIMS), and investigated for the degradation of Reactive Green 12 (RG12) as target contaminant under visible light light-emitting diodes ( ...

2019

Alignment of energy levels in amorphous oxides and at semiconductor-water interfaces

Zhendong Guo

We conduct a detailed investigation of defects in two representative amorphous oxides: amorphous Al2O3 (am-Al2O3) and TiO2 (am-TiO2), by combining ab initio molecular dynamics (MD) simulations and hybrid functional calculations. Our results indicate that o ...

EPFL2019

Study of a photocatalytic process for removal of antibiotics from wastewater in a falling film photoreactor: Scavenger study and process intensification feasibility

Sami Rtimi

This study focused on the removal of antibiotic by coupling of heterogeneous photocatalysis with ozonation and hydrogen peroxide. The main objective was to intensify the efficiency of photocatalytic activity for better and faster antibiotic elimination/min ...

Elsevier2017

Photocatalytic performance of TiO2 impregnated polyester for the degradation of Reactive Green 12: Implications of the surface pretreatment and the microstructure

Sami Rtimi

In the present work, we investigate the degradation of recalcitrant industrial textile dye (Reactive green 12) in aqueous solution by TiO2 impregnated polyester at room temperature. The TiO2 loading on polyester was optimized using different polyester pret ...

Elsevier2017

Heterogeneous versus homogeneous electron transfer reactions at liquid–liquid interfaces: The wrong question?

Hubert Girault, Pekka Eero Peljo, Evgeny Smirnov

Functionalization of a soft or liquid-liquid interface by a one gold nanoparticle thick “nanofilm” provides a conductive pathway to facilitate interfacial electron transfer from a lipophilic electron donor to a hydrophilic electron acceptor in a process kn ...

Elsevier Science Sa2016

H2O2 generation at carbon paste electrode with decamethylferrocene solution in 2-nitrophenyloctyl ether as a binder. The catalytic effect of MoS2 particles

Hubert Girault

Here, we report hydrogen peroxide generation at 2-nitrophenyloctyl ether (NPOE)-water interface with decamethylferrocene as an electron donor. The progress of this reaction was detected by the observation of color change of the organic and aqueous phases i ...

Wiley-V C H Verlag Gmbh2016

Gold Nanofilm Redox Catalysis for Oxygen Reduction at Soft Interfaces

Hubert Girault, Pekka Eero Peljo, Micheal Diarmaid Scanlon, Evgeny Smirnov

Elsevier2016

Multiscattering-enhanced optical probes for biosensing

Volodymyr Koman

Although reactive oxygen species (ROS) are an inescapable part of every living organism, we are only beginning to understand their functions and mechanics. As of now, we know that ROS are involved in cell signalling, stress-response and defence against pat ...

EPFL2015

Portable oxidative stress sensor: Dynamic and non-invasive measurements of extracellular H2O2 released by algae

Olivier Martin, Christian Santschi, Volodymyr Koman

Reactive oxygen species (ROS) generated by aerobic organisms are essential for physiological processes such as cell signaling, apoptosis, immune defense and oxidative stress mechanisms. Unbalanced oxidant/antioxidant budgets are involved in many diseases a ...

Elsevier2015

Degradation rates of benzotriazoles and benzothiazoles under UV-C irradiation and the advanced oxidation process UV/H2O2

Urs von Gunten

Benzotriazoles (BTs) and benzothiazoles (BTHs) are extensively used chemicals found in a wide range of household and industrial products. They are chemically stable and are therefore ubiquitous in the aquatic environment. The present study focuses on the p ...

Elsevier2015