Is conda installation available for qe-gipaw?

[tsitsvero]

Is conda installation available for qe-gipaw?

It seems gipaw.x is not included with default qe conda installation...

[dceresoli]

The compilation of qe-gipaw could be activated in the QE conda recipe. I've seen they use cmake, and I need to test building gipaw with cmake. If it will work, I will contact the QE conda recipe author.

[tsitsvero]

Great, thanks!

I tried to modify the conda recipe to compile qe with gipaw flags:

cmake .. \
    -DQE_ENABLE_MPI=ON \
    -DQE_ENABLE_OPENMP=ON \
    -DQE_ENABLE_SCALAPACK=ON \
    -DQE_ENABLE_ELPA=ON \
    -DQE_ENABLE_HDF5=ON \
    -DQE_ENABLE_TEST=ON \
    -DCMAKE_INSTALL_PREFIX=${PREFIX} \
    -DMPIEXEC_PREFLAGS="--oversubscribe;--bind-to;none;-mca;plm;isolated" \
    -DMPIEXEC_MAX_NUMPROCS=2  \
    -DTESTCODE_NPROCS=2 \
    -DQE_ENABLE_FOX=ON \
    -DQE_ENABLE_PLUGINS="gipaw"

It compiles okay, and executable gipaw.x is produced.

The fork for conda recipe is here: I have to change url (now points to the original repo within receipt since previous link to archive at github was old, and didn't contain proper link to qe-gipaw).

The annoying thing is that this executable isn't copied by make install for some reason to the /bin/ directory of the final conda package.

I suspect that some install target should be added at the side of qe within CMakeLists.txt

Is there anything to be changed at qe-gipaw side to make the gipaw.x file copied by make install or is it necessary to update something on their side?

As a workaround probably I can just copy the gipaw.x manually within build.sh script, but this corrupts the proper installation process.