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Small bugfixes

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mmerkel 2020-08-13 14:46:18 +02:00 committed by Alexander Hampel
parent 4ebfd15803
commit 52d2159c18
2 changed files with 3 additions and 4 deletions
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3
python/triqs_dft_tools/converters/wannier90.py
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@ -51,8 +51,7 @@ from h5 import *
from .converter_tools import * from .converter_tools import *
from itertools import product from itertools import product
import os.path import os.path
import pytriqs.utility.mpi as mpi import triqs.utility.mpi as mpi
class Wannier90Converter(ConverterTools): class Wannier90Converter(ConverterTools):
""" """

2
test/python/w90_convert.py
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@ -26,7 +26,7 @@ from h5 import *
from triqs.utility.h5diff import h5diff from triqs.utility.h5diff import h5diff
import triqs.utility.mpi as mpi import triqs.utility.mpi as mpi
Converter = Wannier90Converter(seedname='LaVO3-Pnma',hdf_filename='w90_convert.out.h5') Converter = Wannier90Converter(seedname='LaVO3-Pnma',hdf_filename='w90_convert.out.h5', rot_mat_type='wannier')
Converter.convert_dft_input() Converter.convert_dft_input()