Supporting files for "Activation entropy of dislocation glide in body-centered cubic metals from atomistic simulations"

Supporting files for the publication: "Activation entropy of dislocation glide in body-centered cubic metals from atomistic simulations" This repository contains a minimal dataset useful to interpret/extend the work presented in the article. This includes : Machine-learning interatomic potentials for Fe and W developped in this work Example LAMMPS and PAFI scripts Molecular dynamics structures used for all calculations All data presented in the figures of the article are released Repository structure is documented in structure.yaml.