libAtoms / matscipy

Materials science with Python at the atomic-scale
http://libatoms.github.io/matscipy/
GNU Lesser General Public License v2.1
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ASE neb changes #249

Closed jameskermode closed 4 months ago

jameskermode commented 4 months ago

Tests are failing with latest ASE release as ase.neb has moved into a new ase.mep.neb module.