From adf2935e7efc0329cfc6894582ed44cb8aaba674 Mon Sep 17 00:00:00 2001 From: Edan Bainglass Date: Mon, 3 Feb 2025 13:03:05 +0000 Subject: [PATCH] Move resetting of `spin_orbit` to the basic settings model --- src/aiidalab_qe/app/configuration/advanced/model.py | 1 - src/aiidalab_qe/app/configuration/basic/model.py | 1 + 2 files changed, 1 insertion(+), 1 deletion(-) diff --git a/src/aiidalab_qe/app/configuration/advanced/model.py b/src/aiidalab_qe/app/configuration/advanced/model.py index a09253701..6e412e862 100644 --- a/src/aiidalab_qe/app/configuration/advanced/model.py +++ b/src/aiidalab_qe/app/configuration/advanced/model.py @@ -239,7 +239,6 @@ def reset(self): self.scf_conv_thr = self._get_default("scf_conv_thr") self.scf_conv_thr_step = self._get_default("scf_conv_thr_step") self.electron_maxstep = self._get_default("electron_maxstep") - self.spin_orbit = self._get_default("spin_orbit") self.kpoints_distance = self._get_default("kpoints_distance") self.optimization_maxsteps = self._get_default("optimization_maxsteps") diff --git a/src/aiidalab_qe/app/configuration/basic/model.py b/src/aiidalab_qe/app/configuration/basic/model.py index f526e547d..b85305e0a 100644 --- a/src/aiidalab_qe/app/configuration/basic/model.py +++ b/src/aiidalab_qe/app/configuration/basic/model.py @@ -71,3 +71,4 @@ def reset(self): self.protocol = self.traits()["protocol"].default_value self.spin_type = self.traits()["spin_type"].default_value self.electronic_type = self.traits()["electronic_type"].default_value + self.spin_orbit = self.traits()["spin_orbit"].default_value