Merge pull request #22024 from bedroge/20241213141055_new_pr_HeFFTe241

{lib}[foss/2023b] HeFFTe v2.4.1 w/ CUDA 12.4.0

easybuild/easyconfigs/h/HeFFTe/HeFFTe-2.4.1-foss-2023b-CUDA-12.4.0.eb

@@ -0,0 +1,40 @@
+easyblock = 'CMakeMake'
+
+name = 'HeFFTe'
+version = '2.4.1'
+versionsuffix = '-CUDA-%(cudaver)s'
+
+homepage = 'https://icl.utk.edu/fft'
+description = "Highly Efficient FFT for Exascale (HeFFTe) library"
+
+toolchain = {'name': 'foss', 'version': '2023b'}
+
+source_urls = ['https://github.com/icl-utk-edu/heffte/archive/']
+sources = ['v%(version)s.tar.gz']
+checksums = ['de2cf26df5d61baac7841525db3f393cb007f79612ac7534fd4757f154ba3e6c']
+
+builddependencies = [
+    ('CMake', '3.27.6'),
+]
+
+dependencies = [
+    ('CUDA', '12.4.0', '', SYSTEM),
+    ('UCX-CUDA', '1.15.0', versionsuffix),
+]
+
+build_shared_libs = True
+
+configopts = "-DHeffte_ENABLE_FFTW=ON -DFFTW_ROOT=$EBROOTFFTW -DHeffte_ENABLE_MKL=OFF "
+configopts += "-DHeffte_ENABLE_CUDA=ON -DCUDAToolkit_ROOT=$EBROOTCUDA -DHeffte_ENABLE_GPU_AWARE_MPI=ON"
+
+# allow oversubscription of MPI ranks to cores, tests are hardcoded to use up to 12 MPI ranks
+pretestopts = "export OMPI_MCA_rmaps_base_oversubscribe=true && "
+
+runtest = 'test'
+
+sanity_check_paths = {
+    'files': ['lib/libheffte.%s' % SHLIB_EXT],
+    'dirs': ['include', 'lib/cmake/Heffte', 'share/heffte/examples'],
+}
+
+moduleclass = 'lib'