Fix quantum espresso parser

nomad-coe · Dec 22, 2023 · 3a65fee · 3a65fee
1 parent 891c450
commit 3a65fee
Showing 2 changed files with 3 additions and 2 deletions.
diff --git a/electronicparsers/quantumespresso/parser.py b/electronicparsers/quantumespresso/parser.py
@@ -2274,7 +2274,7 @@ def parse_diagonalization(source, target):
                 diagonalization_section = x_qe_section_bands_diagonalization
             sec_diagonalization = diagonalization_section()
             sec_def = target.m_def.all_sub_sections_by_section.get(diagonalization_section.m_def)[0]
-            target.m_add_sub_section(sec_def, diagonalization_section)
+            target.m_add_sub_section(sec_def, sec_diagonalization)
             for key, val in diagonalization.items():
                 if val is None:
                     continue

diff --git a/electronicparsers/utils/utils.py b/electronicparsers/utils/utils.py
@@ -100,7 +100,8 @@ def run_workflow_archive(self, workflow_archive: EntryArchive):
         if workflow_archive.run:
             sec_run = workflow_archive.run[-1]
         else:
-            sec_run = workflow_archive.m_create(Run)
+            sec_run = Run()
+            workflow_archive.run.append(sec_run)
         sec_run.program = self.archive.run[-1].program
 
     def parse_gw_workflow(self, gw_archive: EntryArchive, gw_workflow_archive: EntryArchive):