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Hi
If you are using a recent GNU compiler version like 10.2 then adding the compiler flag “–fallow-argument-mismatch” might help.
HTH
Matthias
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Add the flag to CFLAGS in the CP2K arch file which you are using to compile CP2K.
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In that arch file, add the flag to FCFLAGS.
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Try to remove the compiler flag “–ffast-math” from FCFLAGS.
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Hi
It seems that the location of the cp2k.sopt executable is not in your path. Either type the full path or add the folder to your PATH variable.
HTH
Matthias
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