From f00597306afcaae3138ecb4a1ebddfe5067046b4 Mon Sep 17 00:00:00 2001 From: "nathan.daelman@physik.hu-berlin.de" Date: Tue, 27 Jun 2023 16:39:30 +0200 Subject: [PATCH] Minor touch ups --- electronicparsers/fhiaims/parser.py | 4 +--- 1 file changed, 1 insertion(+), 3 deletions(-) diff --git a/electronicparsers/fhiaims/parser.py b/electronicparsers/fhiaims/parser.py index 55f3adf3..8fd69715 100644 --- a/electronicparsers/fhiaims/parser.py +++ b/electronicparsers/fhiaims/parser.py @@ -1816,9 +1816,7 @@ def parse_atom_type(species): sec_basis_func.x_fhi_aims_controlInOut_basis_func_primitive_gauss_alpha = alpha # add inout parameters read from main output - # species - species = self.out_parser.get('control_inout', {}).get('species') - if species is not None: + if (species := self.out_parser.get('control_inout', {}).get('species')) is not None: for specie in species: parse_atom_type(specie)