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Bug fix: changed use_rotations from bool to int

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mmerkel 2020-08-13 17:08:02 +02:00 committed by Alexander Hampel
parent 52d2159c18
commit c6385b16d4
1 changed files with 2 additions and 0 deletions
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2
python/triqs_dft_tools/converters/wannier90.py
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@ -356,6 +356,8 @@ class Wannier90Converter(ConverterTools):
iorb += norb
# Finally, save all required data into the HDF archive:
# use_rotations is supposed to be an int = 0, 1, no bool
use_rotations = int(use_rotations)
with HDFArchive(self.hdf_file, 'a') as ar:
if not (self.dft_subgrp in ar):
ar.create_group(self.dft_subgrp)