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Atomic Cluster Expansion (ACE): Hands-on worksho ... (No replies)
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We are pleased to announce a hands-on workshop focused on the development of atomic cluster expansion (ACE) models. The aim of the workshop is to help participants to train and validate their own ACE models. It will consist of several introductory lectures from ACE developers followed by hands-on tutorials of the ACE software packages (PACEmaker, PACE-lammps, active learning). Participants are encouraged to bring and work with their own DFT training data but several training datasets will be provided as well.
The workshop is free of charge and will take place on June 13-15, 2023 at the Interdisciplinary Centre for Advanced Materials Simulation (ICAMS), Ruhr-Universität Bochum, Germany. It is an in-person event only and will be limited to 30 participants. The registration will be confirmed on a first-come first-serve basis.
Please, register by sending an email to: [email protected]
On behalf of the organizer team:
Matous Mrovec
Yury Lysogorskiy