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Institut de Chimie Physique

Laboratory presentation

The Physical Chemistry Institute (ICP) is a multidisciplinary joint research laboratory (UMR 8000) where chemists, biologists and physicists are gathered around several societal challenges in the fields of Health (e.g. oxidative stress and theranostics), Environment (e.g. trace analysis, air and water depollution) and Energy (e.g. fuel cells, biofuels, photo- and/or electro-catalysis), which are explored with both theoretical and experimental approaches. Several theoretical approaches (in the context of the conception of software) and innovative experimental methodologies have been developed (some of them patented) in the ICP, namely the use of gold nanoparticles for therapeutic applications and the study of electron transfer in condensed media in order to unravel the elementary steps in redox reaction mechanisms. Scientific equipment and especially the platforms (CLIO, ELYSE, Gamma Source, SpICy, and Mass Spectrometry) of LCP are opened to academic and industrial collaborations. Several partnerships with the industry are under way, some of them concerning PhD research projects. It should also be stressed that ICP is strongly involved in the teaching of Physical Chemistry and its interfaces at the Paris-Sud Paris-Saclay University, as well as in the popularisation of Science.

The 20 latest publications

Title Authors Publication date Source
On the relevance of the electron density analysis for the study of micro-hydration and its impact on the formation of a peptide-like bond Roland Thissen, Christian Alcaraz, Claire Romanzin 07/01/22 Theoretical Chemistry Accounts
Exact Factorization Adventures: A Promising Approach for Non-Bound States Federica Agostini 07/01/22 Molecules
Insight into Interfacial Charge Transfer during Photocatalytic H<inf>2</inf> Evolution through Fe, Ni, Cu and Au Embedded in a Mesoporous TiO<inf>2</inf>@SiO<inf>2</inf> Core-shell Sylvain Franger 06/22/22 ChemCatChem
Rapid assessment of fatty acyls chains of phospholipids and plasmalogens by atmospheric pressure chemical ionization in positive mode and high-resolution mass spectrometry using in-source generated monoacylglycerol like fragments intensities Audrey Solgadi, Bastien Prost 06/21/22 Journal of Chromatography A
Consistent Picture of Phosphate-Divalent Cation Binding from Models with Implicit and Explicit Electronic Polarization Carine Clavaguéra 06/09/22 Journal of Physical Chemistry B
Superior photocatalytic activity of polypyrrole nanostructures prepared by radiolysis in water and dichloromethane Diana Dragoe, R. Saint-Martin, François Brisset 06/01/22 Radiation Physics and Chemistry
High-Energy Long-Lived Emitting Mixed Excitons in Homopolymeric Adenine-Thymine DNA Duplexes Ignacio Vayá, Thomas Gustavsson, Dimitra Markovitsi 06/01/22 Molecules
All-experimental analysis of doubly resonant sum-frequency generation spectra for Franck-Condon and Herzberg-Teller vibronic modes Bertrand Busson 05/28/22 Journal of Chemical Physics
Describing the photo-isomerization of a retinal chromophore model with coupled and quantum trajectories Francesco Talotta, David Lauvergnat, Federica Agostini 05/14/22 Journal of Chemical Physics
Ligation Motifs in Zinc-Bound Sulfonamide Drugs Assayed by IR Ion Spectroscopy Philippe Maitre 05/01/22 Molecules
Distinct timing of neutrophil spreading and stiffening during phagocytosis Alexandra Zak, Sophie Dupré-Crochet, Elodie Hudik, Oliver Nüsse 04/19/22 Biophysical Journal
Z-scheme WO<inf>3</inf>/PANI heterojunctions with enhanced photocatalytic activity under visible light: A depth experimental and DFT studies Mohamed Nawfal Ghazzal 04/01/22 Chemosphere
A tetrameric praseodymium substituted arsenotungstate (III) – Synthesis &amp; characterization, electrochemistry, catalytic and its magnetic applications Anne Lucie Teillout, Israël M. Mbomekallé, Pedro de Oliveira 04/01/22 Polyhedron
Synergetic Effects of Mixed-Metal Polyoxometalates@Carbon-Based Composites as Electrocatalysts for the Oxygen Reduction and the Oxygen Evolution Reactions Sraël Martyr Mbomekallé, Anne Lucie Teillout, Pedro de Oliveira 04/01/22 Catalysts
The long road to calibrated prediction uncertainty in computational chemistry Pascal Pernot 03/21/22 Journal of Chemical Physics
Erratum: Nonlinear optical response of a gold surface in the visible range: A study by two-color sum-frequency generation spectroscopy. II. Model for metal nonlinear susceptibility (J. Chem. Phys. (2018) 149 (034701) DOI: 10.1063/1.5027154) Bertrand Busson, L. Dalstein 03/14/22 Journal of Chemical Physics
Structural Elucidation of C<inf>6</inf>H<inf>4</inf><sup>+.</sup> Using Chemical Reaction Monitoring: Charge Transfer Versus Bond Forming Reactions Corentin Rossi, Claire Romanzin, Christian Alcaraz, Roland Thissen 03/04/22 ChemPhysChem
Inter- and Intramolecular Proton Transfer in an Isolated (Cytosine-Guanine)H<sup>+</sup>Pair: Direct Evidence from IRMPD Spectroscopy Debora Scuderi 03/03/22 Journal of Physical Chemistry A
Carbon nanotube-polyoxometalate nanohybrids as efficient electro-catalysts for the hydrogen evolution reaction Valérie Geertsen 03/01/22 Carbon
Molecular simulation of a reverse osmosis polyamide membrane layer. In silico synthesis using different reactant concentration ratios Xuefan Song, Jean Marie Teuler, Bernard Rousseau 03/01/22 Journal of Membrane Science

Number of publications of the laboratory by scientific field (2016-2021)

Every paper can be classified in one or more scientific fields. The figure below shows the lab's number of publications in each scientific field, according to the ASJC classification (Elsevier)