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DFT-FE appears to use libxc exclusively to evaluate density functionals, but doesn't seem to be printing out any information about it. I would kindly ask to include the following information in the DFT-FE output:
the version of libxc used (produced by xc_version_string())
the citation for the used version of libxc (journal reference produced by xc_reference() and doi by xc_reference_doi())
In addition to Libxc, users should also cite the employed density functionals. This information is conveniently stored inside Libxc in the func->info->refs field, which should be likewise printed out by DFT-FE.
The text was updated successfully, but these errors were encountered:
Hi,
DFT-FE appears to use libxc exclusively to evaluate density functionals, but doesn't seem to be printing out any information about it. I would kindly ask to include the following information in the DFT-FE output:
xc_version_string()
)xc_reference()
and doi byxc_reference_doi()
)In addition to Libxc, users should also cite the employed density functionals. This information is conveniently stored inside Libxc in the
func->info->refs
field, which should be likewise printed out by DFT-FE.The text was updated successfully, but these errors were encountered: