[Wannier] Error reading .eig file

SRKC Sharma Yamijala sharmajncasr at gmail.com
Tue Feb 3 05:58:15 CET 2015


 baruo3.eig
<https://docs.google.com/file/d/0B7l7TJgy0hzhRk81aXp2a0QyOVE/edit?usp=drive_web>

Dear Wannier developer,

Wannier90 is complaining against reading the .eig file. I couldn't find any
mistake in my calculation.  Even I have added spaces between columns in the
eig file but couldn't find any reason for the error. Could you please help
me in this regard.

Below I have given the error and I have attached input and *.eig files for
your reference. If needed please let me know, I will try to upload the
*.amn and *mmn files (mmn is ~ 4 GB, and hence, not attached here. I can
keep it in Gdrive if needed).

 Wannier90: Execution started on  2Feb2015 at 21:19:39
Found a mismatch in baruo3.eig
Wanted band  : 1 found band  : 35
Wanted kpoint: 2 found kpoint: 1

A common cause of this error is using the wrong
number of bands. Check your input files.
If your pseudopotentials have shallow core states remember
to account for these electrons.

 Exiting.......
 param_read: mismatch in baruo3.eig

Thanking you,
Sincerely,
Sharma.






********************************************************
*Chaitanya Sharma,*
*Prof. Pati'*s group,
Chemistry and Physics Materials unit,
JNCASR, BANGLORE,
Lab:: (080-2208) 2581, 2809
https://sites.google.com/site/sharmasrkcyamijala/
*********************************************************
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