Skip to content
New issue

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

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

Already on GitHub? # to your account

Add tstep and etemp parameters to the QCxMS tool #586

Merged
merged 2 commits into from
Oct 17, 2024
Merged

Conversation

wverastegui
Copy link
Contributor

This PR introduces the advanced parameters tstep and etemp to the QCxMS neutral run. It also removes the sentence about CID, which is not implemented in this version, from the tmax parameter's help description.

closes #585

@wverastegui wverastegui changed the title Wverastegui/issue585 Add tstep and etemp parameters to the QCxMS tool Sep 26, 2024
@hechth hechth merged commit 5a088c3 into master Oct 17, 2024
12 checks passed
# for free to join this conversation on GitHub. Already have an account? # to comment
Labels
None yet
Projects
None yet
Development

Successfully merging this pull request may close these issues.

Add extra advanced qcxms parameters
2 participants