LAMMPS with MACE: create_lammps_model.py doesn't exist

[ShubhangG]

Hello, I have been following the MACE in LAMMPS documentation. I think the create_lammps_model.py script is no longer available in this MACE repository. I notice a lammps_mace.py class but no script that will convert the mace model to lammps. Was it removed?

[ilyes319]

It was moved to mace/cli/create_lammps_model.py for better integration. It should appear as such in the new documentation.

[ShubhangG]

I'm sorry I was trying to follow the new documentation but there doesn't seem to be a subfolder cli in this repository, is there another one I should take a look at?

Sorry if its an obvious question

[ilyes319]

Please look at the develop branch

[ShubhangG]

Got it Thank you for your patience 🙏!