diff --git a/pyproject.toml b/pyproject.toml index 66468a1..b576f90 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -5,7 +5,7 @@ build-backend = "flit_core.buildapi" [project] name = "aiidalab-qe-vibroscopy" description="AiiDAlab QE plugin for vibrational spectoscopies." -version = "1.1.2" +version = "1.1.3" authors = [ {name = "Miki Bonacci", email = "miki.bonacci@psi.ch"}, {name = "Andres Ortega Guerrero", email = "andres.ortega-guerrero@empa.ch"} diff --git a/src/aiidalab_qe_vibroscopy/workflows/vibroworkchain.py b/src/aiidalab_qe_vibroscopy/workflows/vibroworkchain.py index 61d8cd9..3bab6cd 100644 --- a/src/aiidalab_qe_vibroscopy/workflows/vibroworkchain.py +++ b/src/aiidalab_qe_vibroscopy/workflows/vibroworkchain.py @@ -558,7 +558,6 @@ def get_builder_from_protocol( # MBO: I do not understand why I have to do this, but it works builder.phonon = builder_phonon - builder.phonon.symmetry = orm.Float(overrides["symmetry"]) # Adding the bands and pdos inputs. if structure.pbc != (True, True, True):