[CP2K-user] Build dependencies using toolchain in a cluster

Carlos Bornes cbor... at gmail.com
Fri Jan 17 18:41:27 UTC 2020

Hi there

I'm trying to compile CP2K at my university's cluster. I've decided to 
start by building all the dependencies using the toolchain provided in cp2k 
7.1 using 
 ./install_cp2k_toolchain.sh --install-all --with-mkl=system --with-openmpi=

the installation end quickly with the error 
Installing from scratch into 
ERROR: (./scripts/install_spfft.sh, line 40) Non-zero exit code detected.

I went to the ~/build/SpFFT-0.9.8/build-cpu/ and found the attached error 
and .log files. It shows this
Make Error at 
  Could NOT find MPI (missing: MPI_CXX_FOUND)

I'm not sure how to solve this problem MPI is installed and in my PATH so 
it should be available right?

Thank you

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