Skip to content
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.

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

Nexus: Harden Nexus excitation checks #3729

Merged
merged 2 commits into from
Jan 14, 2022

Conversation

mcbennet
Copy link
Contributor

Proposed changes

For the excitation checks in Nexus, add a bit of hardening such that the bahavior is the same regardless of whether the orbital data structure is a list or ndarray

What type(s) of changes does this code introduce?

  • Code hardening

Does this introduce a breaking change?

  • No. All nxs-test tests pass

What systems has this change been tested on?

Laptop, linux

Checklist

  • Yes. This PR is up to date with current the current state of 'develop'
  • N/A. Code added or changed in the PR has been clang-formatted
  • N/A. This PR adds tests to cover any new code, or to catch a bug that is being fixed
  • N/A. Documentation has been added (if appropriate)

@mcbennet mcbennet changed the title Add np.asarray Nexus: Harden Nexus excitation checks Jan 13, 2022
@ye-luo
Copy link
Contributor

ye-luo commented Jan 14, 2022

Test this please

@ye-luo ye-luo merged commit 2ecd0be into QMCPACK:develop Jan 14, 2022
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Labels
None yet
Projects
None yet
Development

Successfully merging this pull request may close these issues.

2 participants