New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

Sign up for GitHub

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

Jump to bottom

ValueError: Invalid format: `*****/poscar` #26

Open

skvarjun opened this issue Jan 14, 2023 · 0 comments

skvarjun commented Jan 14, 2023

iface_slab.to('poscar', str(min_thick)+'_'+str(min_vac)+'/POSCAR') #Write file

This line of code is not writing POSCAR with Pymatgen, instead throwing an error "ValueError: Invalid format: *****/poscar"

The text was updated successfully, but these errors were encountered:

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment