relativity method

1b55a519 · Mikkel Strange · 30dbcec9 · 1b55a519
Commit 1b55a519 authored Sep 13, 2016 by Mikkel Strange
--- a/parser/parser-gpaw/parser.py
+++ b/parser/parser-gpaw/parser.py
@@ -75,7 +75,7 @@ def parse(filename):
        with o(p, 'section_frame_sequence'):
            pass
        with o(p, 'section_method') as method_gid:
-            #p.addValue('relativity_method', 'pseudo_scalar_relativistic')
+            p.addValue('relativity_method', 'pseudo_scalar_relativistic')
            p.addValue('electronic_structure_method', 'DFT')
            p.addValue('scf_threshold_energy_change', c(r.EnergyError,
                                                        'hartree'))