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Regensburg 2022 – scientific programme

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MM: Fachverband Metall- und Materialphysik

MM 31: Computational Materials Modelling: Physics of Ensembles 2

Thursday, September 8, 2022, 11:45–13:00, H44

11:45 MM 31.1 Making low-scaling GW accurate — •Jan Wilhelm and Dorothea Golze
12:00 MM 31.2 Atomic cluster expansion parametrization of carbon for a fast, accurate and transferable interatomic potential — •Minaam Qamar, Matous Mrovec, Yury Lysogorskiy, Anton Bochkarev, and Ralf Drautz
12:15 MM 31.3 Design and analysis of scattering data driven molecular dynamics simulation on the example of water and selected crystals — •Veronika Reich, Sebastian Busch, and Martin Müller
12:30 MM 31.4 Approximating nuclear quantum effects in solids by temperature remapping — •Raynol Dsouza, Liam Huber, Blazej Grabowski, and Jörg Neugebauer
12:45 MM 31.5 Sharp phase-field modeling of isotropic solidification with a super efficient spatial resolution — •Michael Fleck and Felix Schleifer
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