lundi 15 septembre 2025
Heures | événement | (+) |
14:00 - 15:30 | Accueil - Enregistrement - Accueil - Enregistrement | |
15:30 - 15:45 | Ouverture | |
15:45 - 16:15 | Prix Chercheur Confirmé - Does the interfacial chemistry of atmospheric aerosols leads to the production of hydroxyl radicals? - Christian GEORGE | |
16:15 - 16:45 | Chimie Physique | (+) |
16:15 - 16:30 | › A Film of Hydrophobic Cations Reshapes the Electric Double Layer at the Metal/Water Interface - Qiwei YAO | |
16:30 - 16:45 | › Exploring the mechanisms of damage of biomolecules upon ionising irradiation with numerical simulations - Thomas BOUKEKE-LESPLULIER | |
16:45 - 17:00 | Pause | |
17:00 - 18:00 | Chimie Physique | (+) |
17:00 - 17:15 | › Simulating phase transitions in ZIF-4 using a machine learning potential - Léna TRIESTRAM | |
17:15 - 17:30 | › Raman spectra of silicic acids through classical polarisable molecular dynamics - Jessica BOWLES | |
17:30 - 17:45 | › Synthesis of ferrocene derivatives as novel posolytes for energy storage - Anna Maria HABAK | |
17:45 - 18:00 | › Multipodal Au–C grafting of calix[4]arene molecules on gold nanorods - Auguste TETENOIRE | |
18:00 - 19:00 | Session Posters - Posters | |
19:00 - 20:30 | Dîner |
mardi 16 septembre 2025
Heures | événement | (+) |
08:30 - 09:00 | Prix de Thèse - Design of magnetic iron oxide/graphene based nanomaterials for the efficient and selective removal of polycyclic aromatic hydrocarbons from the environment - Joana VAZ RAMOS | |
09:00 - 10:15 | Chimie Physique | (+) |
09:00 - 09:15 | › Simulation of a vibrational spectrum within a Quantum Computing framework - Joachim KNAPIK | |
09:15 - 09:30 | › Structure and dynamics in Surfactant-free microemulsions. - Marie PLAZANET | |
09:30 - 09:45 | › Electrochemical study of bio-polymer lignin: modification and valorization - Syed NOMAN | |
09:45 - 10:00 | › Diffusion of selenide in clay rock: an experimental journey at the crossroads between environmental sciences and radiochemistry. - Romain V. H. DAGNELIE | |
10:00 - 10:15 | › Direct time-resolved study of the interfacial reaction mechanism of metal-based catalysts in the CO2 conversion - Zhiwen JIANG | |
10:15 - 10:45 | Pause + Posters | |
10:45 - 11:15 | Conférence invitée - Quantum‑Chemical Insights into Actinide Bonding and Spectroscopy: 5f/6d Orbital Contributions, Spectral Signatures, and Volatility - Valérie VALLET | |
11:15 - 12:30 | Chimie Physique | (+) |
11:15 - 11:30 | › Modeling Water Clusters with Deep Neural Network Potentials - Maïa COURTIEL | |
11:30 - 11:45 | › Molecular Investigation of the Interaction of Fluorescent Probes with Early Protein Aggregates - Marium HAQ | |
11:45 - 12:00 | › Biomass conversion to added value products under Visible light excitation of Metal Halide Perovskites supported hollow spheres - Thi Hieu HOANG | |
12:00 - 12:15 | › Elucidating the complex photophysics of luminescent donor-acceptor keto-coumarins - Peter McDONALD | |
12:15 - 12:30 | › Experimental study on the uptake of gaseous molecular iodine by atmospheric droplets - Enida NUSHI | |
12:30 - 14:00 | Déjeuner & Discussions | |
14:00 - 14:30 | Prix Jeune Chercheur - Deciphering the synthesis, formulation and alteration of historical pigments at the multi-scale - Victor GONZALEZ | |
14:30 - 15:45 | Chimie Physique | (+) |
14:30 - 14:45 | › Raman Optical Activity and ECD-Raman in Chiral Transition Metal Complexes - Maria Sara RAJU | |
14:45 - 15:00 | › Tautomerism and Conformational Effects in Protonated and Copper(I)-Coordinated Bis(oxazoline) Ligands: Insights from IRMPD Spectroscopy and DFT - Alexandra TSYBIZOVA | |
15:00 - 15:15 | › Modeling the Vibrational Circular Dichroism spectroscopy of Phenylcyclohexanediol and Ionic Liquids to probe solvation properties - Emeline BOYER | |
15:15 - 15:30 | › Advanced modelling of nonlinear optoelectronic properties of functionalized CdTe quantum dots using machine learning combined with DFT - Justin GRILL | |
15:30 - 15:45 | › Production and study of model nanoplastics by top-down and bottom-up methods for environmentally relevant studies - Olivier SANDRE | |
15:45 - 16:15 | Pause | |
16:15 - 16:45 | Conférence invitée - How the behavior of water and ions in confinement explains the evolution of nanoporous materials in solution - Diane REBISCOUL | |
16:45 - 17:45 | Chimie Physique | (+) |
16:45 - 17:00 | › Accelerating the Structure Exploration of Diverse Bi–Pt Nanoclusters via Physics-Informed Machine Learning Potential and Particle Swarm Optimization - Raphaël VANGHELUWE | |
17:00 - 17:15 | › Experimental Characterization and Theoretical Modelling of X-ray Absorption Spectra of Protactinium(V) Complexes - Tamara SHAABAN | |
17:15 - 17:30 | › Electrochemical Analysis by mass spectrometry to study furfural reduction reactivity - Essyllt LOUARN | |
17:30 - 17:45 | › Electrostatically Embedded QM/MM Study of the Potential-Dependent Reorientation of Pyridine on Au(111) - Mingjun GU | |
17:45 - 19:00 | Session Posters - Posters | |
19:30 - 21:00 | Dîner de Gala |
mercredi 17 septembre 2025
Heures | événement | (+) |
08:30 - 09:10 | Conférence Jean Perrin - Taking Physical Chemistry into Cyberspace: From Computation to Immersive Discovery - Marc BAADEN | |
09:10 - 10:10 | Chimie Physique | (+) |
09:10 - 09:25 | › ICONE: une nouvelle source compacte de neutrons pour la physico-chimie. - Arnaud DESMEDT | |
09:25 - 09:40 | › Fluids at an electrostatically active surface: Optimum in interfacial friction and hydroelectronic drag - Cecilia HERRERO | |
09:40 - 09:55 | › Impact of the Host Polymer Viscoelastic properties on Magnetic Hyperthermia of Nanocomposites - Laura EA | |
09:55 - 10:10 | › Excited-state dynamics and thermal recovery of salicylidene-aniline photoswitches: a theoretical investigation - Isabella MERRITT | |
10:10 - 10:30 | Pause + Posters | |
10:30 - 11:00 | Prix de thèse - Watching the electrochemistry of individual nickel-based nanoparticles by optical and X-ray microscopy - Louis GODEFFROY | |
11:00 - 12:00 | Chimie Physique | (+) |
11:00 - 11:15 | › Theory and Lattice Boltzmann Modeling of Complex Pollutants in Solution: Effect of the Porous Medium Heterogeneity on Adsorption and Transport - Nada BEN AMOR | |
11:15 - 11:30 | › Interplay of Structure and Dynamics in Solid Polymer Electrolytes: a Molecular Dynamics Study on poly(propylene carbonate)-based / lithium salt - Amaury COSTE | |
11:30 - 11:45 | › Microscopic view of hydrogen adsorption in size-variant nano-clays materials - Mohammad ABDELSATER | |
11:45 - 12:00 | › Quantum algorithms for excited-state chemistry - Bruno SENJEAN | |
12:00 - 12:10 | Clôture | |
12:10 - 14:00 | Déjeuner et départ |