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ase
ase
Related to the atomic simulation environment integration
bug
bug
Something isn't working
build
build
Build system related issues (platform, compilers)
dependencies
dependencies
Pull requests that update a dependency file
documentation
documentation
Improvements or additions to documentation
duplicate
duplicate
This issue or pull request already exists
enhancement
enhancement
New feature or request
good first issue
good first issue
Good for newcomers
help wanted
help wanted
Extra attention is needed
invalid
invalid
This issue or pull request is not correct
qca
qca
Related to the QCArchive infrastructure
question
question
Further information is requested
unconfirmed
unconfirmed
This report has not yet been confirmed by the developers
unlikely
unlikely
This issue describes a low-probability event in a distant future
xtb
xtb
Related to the upstream xtb dependency