LCPQ/dft_tools
3
0
Fork 0
mirror of https://github.com/triqs/dft_tools synced 2024-06-29 08:24:54 +02:00
Code Issues Releases Wiki Activity

Small bugfixes

Browse Source
This commit is contained in:
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
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

3
python/triqs_dft_tools/converters/wannier90.py
View File

@ -51,8 +51,7 @@ from h5 import *
from .converter_tools import *
from itertools import product
import os.path
import pytriqs.utility.mpi as mpi
import triqs.utility.mpi as mpi
class Wannier90Converter(ConverterTools):
"""

2
test/python/w90_convert.py
View File

@ -26,7 +26,7 @@ from h5 import *
from triqs.utility.h5diff import h5diff
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()