Bug in extract_orbital TopologyNormalizer
@ndaelman there is a bug in the TopologyNormalizer._extract_orbital
. The variable active_orbitals_run
takes [None]
if there are is not a core_hole
section under each AtomParameters
, meaning, the loop later when we run active_orbitals.normalize(None, None)
is giving the failure (NoneType does not have attribute normalize).
Do you mind doing a quick hotfix? Thanks!