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fangohr / octopus-in-spack

Develop Octopus in spack (software packaging)
BSD 3-Clause "New" or "Revised" License
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Add etsf-io variant and its checks #76

Closed iamashwin99 closed 1 year ago

iamashwin99 commented 1 year ago

Fixes partly #74 Added etsf-io variant and its checks in the CI ( referred from https://github.com/fangohr/octopus-in-spack/pull/13)

iamashwin99 commented 1 year ago

etsf-io package is being picked up in both mpi and non mpi variants as seen from the CI logs :

                           Running octopus

Version                : 12.2
Commit                 :
Build time             : Mon Mar 13 11:47:59 UTC 2023
Configuration options  : maxdim3 openmp mpi sse2 avx libxc5 libxc_fxc
Optional libraries     : cgal etsf_io metis netcdf parmetis pfft nlopt
Architecture           : x86_64
C compiler             : /home/user/spack/opt/spack/linux-debian11-x86_64_v4/gcc-10.2.1/openmpi-4.1.5-hn6nfwprjx4yzno3wwixc5qecjwc4rc5/bin/mpicc (/home/user/spack/lib/spack/env/gcc/gcc)
                           Running octopus

Version                : 12.2
Commit                 :
Build time             : Mon Mar 13 11:12:23 UTC 2023
Configuration options  : maxdim3 openmp sse2 libxc5 libxc_fxc
Optional libraries     : cgal etsf_io netcdf nlopt
Architecture           : x86_64
C compiler             : /usr/bin/gcc