Fes.sopt Error

Jie Zhong dynami... at gmail.com
Thu Nov 3 18:54:59 CET 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
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20161103/57c6ffe3/attachment.html>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: bulk-HNCO-1.restart
Type: application/octet-stream
Size: 122484 bytes
Desc: not available
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20161103/57c6ffe3/attachment.obj>


More information about the CP2K-user mailing list