Skip to content

v0.4.1

Choose a tag to compare

View all tags
@robinzyb robinzyb released this 20 Oct 09:35
· 191 commits to main since this release
v0.4.1
854d95e
This commit was created on GitHub.com and signed with GitHub’s verified signature. The key has expired.
GPG key ID: 4AEE18F83AFDEB23
Expired
Verified
Learn about vigilant mode.

What's Changed

  • add test function for
    • basis set
    • cutoff
    • Hubbard u
  • add test file generation command line tool for
    - basis set
    • cutoff
    • Hubbard u
  • add plot command line tool for
    - basis set test
    • cutoff test
    • Hubbard u test
    • fep plot
  • add frequently used units from cp2k
Assets 2
Loading