[Wien] wien2wannier interface
Kyohn Ahn
kyohn1004 at gmail.com
Tue Mar 17 09:58:46 CET 2015
Hi, Elias.
Maybe I can share my experiences.
I'm a user of v0.96.
The problem occurs when "_" exists in the filename.
More specifically, the trouble appears when I tried to get Wannier plots.
I think that the key is in either [prepare_plots.sh] or [xsfAll.sh].
(I could not find any problem with other operations, such as write_w2win,
write_win, w2w, ..., etc.)
My filename was, for example, [SrVO3_super.~~~].
Then the outputs (~xsf files, etc,) were strange.
I deleted "_" in the name of input files,
i.e., [SrVO3_super.~~~] → [SrVO3super.~~~].
Then the problem disappeared.
Have a nice day.!
- Kyohn
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20150317/acd48736/attachment.html>
More information about the Wien
mailing list