Fes.sopt Error

Jie Zhong dynami... at gmail.com
Thu Nov 3 17:54:59 UTC 2016


Hi all,

I am trying to use fes.sopt on a restart but I get the following error

fes.sopt -cp2k -ndim 1 -ndw 1 -file bulk-HNCO-1.restart

**********************************************************************
FES|  Parsing file:   <bulk-HNCO-1.restart>

At line 185 of file 
/opt/programs/cp2k-2.4.0/makefiles/../tools/metadyn/graph_utils.F
Fortran runtime error: Bad real number in item 1 of list input

The restart file has been attached.

Any thoughts is appreciated.

Thanks!

JieZhong
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