[CP2K-user] [CP2K:21531] cuda cuInit error

[jerryt...@gmail.com]

Dear Forum,
I have built 2025.1 via the toolchain using the following input:

--install-all -j36 --with-openmpi=system --with-gcc=system --with-sirius=no 
--with-libtorch=no --enable-cuda --gpu-ver=A100 --no-check-certificate 
--with-quip=no --with-sirius=no --with-spfft=no --with-spla=no 
--with-pexsi=no --with-superlu=no --with-cusolvermp=no --with-dftd4=no 
--with-deepmd=no --with-elpa=no --with-cosma=no

The code compiled without an error.  When I try to run a job, the job 
crashes with the following error:

ERROR: cuInit failed with error:  100 
/cluster/home/tanoury/CP2K/cp2k-2025.1/src/offload/offload_library.c 57

My cuda version and the version supported by the GPUs are the same (12.3.0).

Thank you so much for any help you can provide,
Jerry

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