Postdoctoral Associate at Julia Lab, MIT.
20:10 UTC
Scaling up atomistic simulation models is hampered by expensive calculations of interatomic forces. Machine learning potentials address this challenge and promise the accuracy of first-principles methods at a lower computational cost. This talk presents, as part of the research activities of the CESMIX project, how Julia is used to facilitate automating the composition of a novel neural potential based on the Atomic Cluster Expansion.