In the WIEN2k directory SRC_lapw0, there should be a file called
lapw0.F. You have to open the file in a text editor. Then, you need to
find line 1831, which should have on that line:
READ(11,'(1X," ",I10)') NKKSP
You need to replace (1X," ",I10) with (9X,I10) in that line so
that you have:
READ(11,'(9X,I10)') NKKSP
Finally, you need to use siteconfig to recompile.
However, that is not expected to be the best solution. The better
solution should be to update to the latest WIEN2k version (currently,
14.2), which already contains a fix to this problem and others.
On 2/5/2015 10:47 PM, bayarr temuujin wrote:
Dear Wien2k users,
I am using Wien2k version 13.1. I followed all the steps in userguide
but i am getting error:
hup: Command not found.
STOP LAPW0 END
At line 1831 of file lapw0.F (unit = 11, file = 'TiO2_rutile_mBJ.r2v')
Fortran runtime error: Constant string in input format
(1X," ",I10)
^
> stop error
I searched mailing list for similar problems and Mr. Peter Blaha mentioned to
replace it by (9X,I10) but i do not understand how to replace it. Can someone
explain it to me?
Best regards,
Temuujin Bayaraa
Researcher
Institute of Physics and Technology,
Mongolian Academy of Sciences
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