[CP2K-user] Error when parsing the CP2K input file

[Torstein Fjermestad]

Dear all, 

I just tried to run a CP2K calculation on a new cluster. The version is 7.1 
and the executable is cp2k.psmp
The job is a geometry optimization, and I use the same input file as I 
routinely use (running version 6.1 and executable cp2k.popt)
This time, however, I get the following error message:

 INPP_ at SET: Invalid variable name in @SET directive in file:
system.inp  Line:     1
input/cp_parser_inpp_methods.F:307

The slurm output file (slurm-61201.out) with this message as well as the 
input file (system.inp) are attached. 

Do you have any idea of what is going on, or what I should do to fix the 
problem?

Thanks in advance for your help. 

Regards,
Torstein Fjermestad
 




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