[Wien] error in x wplot

Elias Assmann elias.assmann at gmail.com
Mon Aug 1 14:05:57 CEST 2016


On 08/01/2016 12:34 PM, Ravi Kashikar wrote:
> Hi Elias
> 
> Now I Have tried with w90chk2chk.x utility, its creating case.chk.fmt.
> error is repeating. After x Wannier90 execution. I used  *w90chk2chk.x*,
> then *write_inwplot* and *x wplot -wf 1*. which is printing the error, as

w90chk2chk.x is for converting the .chk to plain text so you can read it
and check for problems (or transfer it to another machine without binary
compatibility).  It is not useful to call it before ‘wplot’.

> -------------------------------------------------
> forrtl: severe (24): end-of-file during read, unit 32, file
> /home/cmtcl/WIEN2k_cal/ga/gas/gas.chk
> Image              PC                Routine            Line       
> Source            
> wplotc             000000000042BEB3  Unknown               Unknown  Unknown
> wplotc             0000000000457A74  Unknown               Unknown  Unknown
> wplotc             0000000000415C32  main2_                    180  main.F
> wplotc             00000000004034BE  MAIN__                     61  wplot.f
> wplotc             0000000000402FEE  Unknown               Unknown  Unknown
> libc.so.6          00002B529756CF45  Unknown               Unknown  Unknown
> wplotc             0000000000402EE9  Unknown               Unknown  Unknown
> 0.0u 0.0s 0:00.00 0.0% 0+0k 0+8io 0pf+0w
> error: command   /home/cmtcl/WIEN2k_14/wplotc wplot.def 1   failed
> ----------------------------------------------------

I notice that this error comes from a different line than before.  Is it
possible that w90chk2chk replaced the binary .chk with the plain-text
one, i.e. that wplot is trying to read a text file as binary?

Otherwise I cannot say any more than I already have.

>     Something seems to be wrong with Wannier90's checkpoint file ‘case.chk’.
>      It could also be an inconsistency between input files.  Try re-running
>     Wannier90; if the problem persists and you want to dig deeper, new
>     versions of Wannier90 come with a utility called ‘w90chk2chk.x’ which
>     you can use to convert the .chk to plain text.


	Elias



-------------- next part --------------
A non-text attachment was scrubbed...
Name: signature.asc
Type: application/pgp-signature
Size: 880 bytes
Desc: OpenPGP digital signature
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20160801/7f8473a9/attachment.asc>


More information about the Wien mailing list