[CP2K:2529] fes.sopt error

Teodoro Laino teodor... at gmail.com
Tue Jan 26 22:17:00 CET 2010


could you please attach as well your restart file (please gzip first).
Thanks
Teo

Lekpa Duukori wrote:
> Hi all,
>
> I am trying to use fes.sopt on a restart but I get the following error
>
> fes.sopt -cp2k -ndim 3 -ndw 1 3 -file 2hno3_dftb_mtd_3cv-1.restart
>
> **********************************************************************
> FES|  Parsing file:   <2hno3_dftb_mtd_3cv-1.restart>
>
> At line 374 of file 
> /opt/cp2k_gfortran/makefiles/../tools/metadyn/graph.F (unit = 10, file 
> = '2hno3_dftb_mtd_3cv-1.restart')
> Fortran runtime error: End of file
>
> fes.sopt  was compiled using make fes.sopt ARCH=Linux-x86-64-gfortran 
> VERSION=sopt  on a cp2k gfortran compilation from the CVS snapshot of 
> 2010-01-21
>
> Using several other intermediate restart files does not help, so I am 
> guessing that somehow fes.sopt was not properly compiled or maybe my 
> cp2k compilation is not writing what fes.sopt expects.
>
> Any thoughts is appreciated.
>
> Thanks!
>
> Lekpa
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