prefix="/data/shared/apps/abinit/10.6.3/build" CC="icx" CXX="mpicxx" FC="mpifort" with_mpi="/opt/ohpc/pub/mpi/openmpi5-intel/5.0.3" with_mpi_flavor="native" enable_mpi_gpu_aware="no" enable_mpi_inplace="yes" enable_mpi_io="auto" with_mpi_level="2" # with_linalg_flavor="mkl" LINALG_CPPFLAGS="-I${MKLROOT}/include" LINALG_FCFLAGS="-I${MKLROOT}/include" LINALG_LIBS="-L${MKLROOT}/lib/intel64 -lmkl_intel_lp64 -lmkl_core -lmkl_sequential -lpthread -lm -ldl" with_fft_flavor="dfti" FFT_CPPFLAGS="-I${MKLROOT}/include" FFT_FCFLAGS="-I${MKLROOT}/include" FFT_LIBS="-L${MKLROOT}/lib/intel64 -lmkl_intel_lp64 -lmkl_core -lmkl_sequential -lpthread -lm -ldl" # with_libxc="/data/shared/apps/abinit/10.6.3/libs" # with_hdf5="/data/shared/apps/abinit/10.6.3/libs" # with_netcdf_fortran="/data/shared/apps/abinit/10.6.3/libs" with_netcdf_c="/data/shared/apps/abinit/10.6.3/libs" # with_xmlf90="/data/shared/apps/abinit/10.6.3/xmlf90-1.6.3/build" # XMLF90_LIBS="-L/data/shared/apps/abinit/10.6.3/xmlf90-1.6.3/build/lib64 -lxmlf90" # XMLF90_FCFLAGS="-I/data/shared/apps/abinit/10.6.3/xmlf90-1.6.3/build/include/xmlf90/Intel-2021.0.0.20231010" # with_libpsml="/data/shared/apps/abinit/10.6.3/libpsml-2.1.0/build" LIBPSML_FCFLAGS="-I/data/shared/apps/abinit/10.6.3/libpsml-2.1.0/build/include/libpsml/Intel-2021.0.0.20231010" LIBPSML_LIBS="-L/data/shared/apps/abinit/10.6.3/libpsml-2.1.0/build/lib64 -lpsml" # with_wannier90="/data/shared/apps/abinit/10.6.3/libs" WANNIER90_LIBS="-L/data/shared/apps/abinit/10.6.3/libs/libi -lwannier -qmkl=sequential" # with_python_includes="-I/home/bbruzzo/.local/share/mamba/envs/myenv/include/python3.10" with_python_libs="-L/home/bbruzzo/.local/share/mamba/envs/myenv/lib -lpython3.10" PYTHON_CPPFLAGS="-I/home/bbruzzo/.local/share/mamba/envs/myenv/include/python3.10" PYTHON_CFLAGS="-O2" PYTHON_LDFLAGS="-L/home/bbruzzo/.local/share/mamba/envs/myenv/lib -lpython3.10"