[Wien] error in wannier function plotting with wien2wannier
wasim raja Mondal
wasimr.mondal at gmail.com
Tue Mar 10 10:27:38 CET 2015
Dear Ellias,
I have a doubt thet my mail is sent or not. I am
sending you again. I am facing following problem
My case is subdir_final.
I am able to produce the following
*write_wplotdef subdir_final*
*write_wplotin subdir_final*
*prepare_plots.sh subdir_final*
I have got the following files:
subdir_final_1.psiarg
subdir_final_1.psink
subdir_final_2.psiarg
subdir_final_2.psink
subdir_final_3.psiarg
subdir_final_3.psink
* xsfAll.sh subdir_final*
I have got the following files:
subdir_final_1.xsf.gz
subdir_final_2.xsf.gz
subdir_final_3.xsf.gz
When I open these file in xcrysden, I am not finding anything.
I gunzip one file
* gunzip subdir_final_1.xsf.gz*
Inside this file it is showing
[E] Could not find file subdir_final_final.psink
version1:
To transform xsf file I use the command
* wplot2xsf subdir_final*
I am getting following error message
Traceback (most recent call last):
File "/home/wasim/wien2k_14_installation/wplot2xsf", line 112, in <module>
args = parser.parse_args()
File "/usr/lib/python2.7/argparse.
py", line 1688, in parse_args
args, argv = self.parse_known_args(args, namespace)
File "/usr/lib/python2.7/argparse.py", line 1720, in parse_known_args
namespace, args = self._parse_known_args(args, namespace)
File "/usr/lib/python2.7/argparse.py", line 1929, in _parse_known_args
stop_index = consume_positionals(start_index)
File "/usr/lib/python2.7/argparse.py", line 1885, in consume_positionals
take_action(action, args)
File "/usr/lib/python2.7/argparse.py", line 1778, in take_action
argument_values = self._get_values(action, argument_strings)
File "/usr/lib/python2.7/argparse.py", line 2218, in _get_values
value = [self._get_value(action, v) for v in arg_strings]
File "/usr/lib/python2.7/argparse.py", line 2233, in _get_value
result = type_func(arg_string)
File "/home/wasim/wien2k_14_installation/wplot2xsf", line 58, in
int_or_file
else: return open(x)
IOError: [Errno 2] No such file or directory: 'subdir_final'
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