Tammo van der Heide
Tammo van der Heide
> Definitely wrong, as Python2 sunsetted years ago. What feature are you thinking that appears in 3.8? Python 3.8 was just a guess/placeholder, I now changed it to `requires-python =...
@bhourahine Switched to Python `>=3.10`.
@bhourahine Switched to Python `>=3.10`.
> @vanderhe What do you think about installing the package via just `pip install .[skprogs]` which compiles all necessary binaries from the Fortran files inside the procedure? I guess, a...
Hi @iampapai, indeed, the wfc.hsd file is missing for ob2-1-1. I quickly reproduced the parameter set and generated the basis information required by waveplot. Feel free to give it a...
@iampapai Short addendum: The wfc.hsd file above was generated for the ob2-1-1 (_base_) parameters. Note that it may not hold for either of the _shift_ or _split_ subset.
> [@vanderhe](https://github.com/vanderhe) Was this for the base, shift or split parts of the set? Base, see https://github.com/dftbplus/dftbplus/issues/1482#issuecomment-2208408288.