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