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Regensburg 2025 – wissenschaftliches Programm

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CPP: Fachverband Chemische Physik und Polymerphysik

CPP 33: Modeling and Simulation of Soft Matter IV

Donnerstag, 20. März 2025, 11:45–13:00, H34

11:45 CPP 33.1 Understanding COF/Electrode interfaces for electrocatalysis using DFT and molecular simulations — •Henrik Stooß, Philip Stärk, and Alexander Schlaich
12:00 CPP 33.2 Porous microstructure of fibrous sheets in two transport regimesAlexandra Serebrennikova, Phillip Gräfensteiner, Matthias Neumann, Volker Schmidt, Andoni Rodriguez, Peter Leitl, Werner Napetschnig, Ekaterina Baikova, Maximilian Fuchs, and •Karin Zojer
12:15 CPP 33.3 Nuclear Quantum Effects in ClaysSam Shepherd, Pawan Kurapothula, Nataly Realpe, Gareth Tribello, and •David Wilkins
12:30 CPP 33.4 Protonated water clusters by stochastic approaches: probing machine learning resilience against quantum Monte Carlo noise — •Matteo Peria, Antonino Marco Saitta, and Michele Casula
12:45 CPP 33.5 Effect of solid fillers on the thermodynamics and electrical properties of diblock copolymers and polymer blends. — •Alexander Chervanyov
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