Add updated MP workflows + cleanup #1139
Merged
Conversation
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
JaGeo
reviewed
Mar 12, 2025
JaGeo
reviewed
Mar 12, 2025
| copy_vasp_kwargs={"additional_vasp_files": ("WAVECAR", "CHGCAR")} | ||
| ) | ||
| ) | ||
| clean_files: Sequence[str] | None = ("WAVECAR",) |
There was a problem hiding this comment.
One last point: we also delete wavecars in the lobster workflow. Might be worth to make this consistent in the future.
|
This is great, @esoteric-ephemera . I will merge this and open an issue about the potential update for the Lobster workflow |
Merged
Sign up for free
to join this conversation on GitHub.
Already have an account?
Sign in to comment
Add this suggestion to a batch that can be applied as a single commit.
This suggestion is invalid because no changes were made to the code.
Suggestions cannot be applied while the pull request is closed.
Suggestions cannot be applied while viewing a subset of changes.
Only one suggestion per line can be applied in a batch.
Add this suggestion to a batch that can be applied as a single commit.
Applying suggestions on deleted lines is not supported.
You must change the existing code in this line in order to create a valid suggestion.
Outdated suggestions cannot be applied.
This suggestion has been applied or marked resolved.
Suggestions cannot be applied from pending reviews.
Suggestions cannot be applied on multi-line comments.
Suggestions cannot be applied while the pull request is queued to merge.
Suggestion cannot be applied right now. Please check back later.
Additions / removals:
Dev: