Merge branch 'atompaw' into '2022'

Atompaw for gcc

See merge request hps-public/easybuild-repository!1150

Golden_Repo/a/AtomPAW/AtomPAW-4.1.1.0-gpsmkl-2021b.eb

+##
+# This version of AtomPAW is lastest version to be used with ABINIT 8.10.x
+##
+
+easyblock = 'ConfigureMake'
+
+name = 'AtomPAW'
+version = '4.1.1.0'
+
+homepage = 'http://users.wfu.edu/natalie/papers/pwpaw/man.html'
+description = """
+AtomPAW is a Projector-Augmented Wave Dataset Generator that
+can be used both as a standalone program and a library.
+"""
+
+
+toolchain = {'name': 'gpsmkl', 'version': '2021b'}
+
+source_urls = ['http://users.wfu.edu/natalie/papers/pwpaw/']
+sources = [SOURCELOWER_TAR_GZ]
+checksums = ['b1ee2b53720066655d98523ef337e54850cb1e68b3a2da04ff5a1576d3893891']
+
+dependencies = [
+    ('libxc', '5.1.7'),
+]
+
+configopts = '--enable-libxc'
+configopts += ' --with-libxc-incs="-I$EBROOTLIBXC/include"'
+configopts += ' --with-libxc-libs="-L$EBROOTLIBXC/lib -lxc"'
+
+configopts += ' --with-linalg-libs="-L$EBROOTIMKL/lib/intel64 -Wl,--start-group'
+configopts += '  -lmkl_intel_lp64 -lmkl_sequential -lmkl_core -Wl,--end-group -lpthread -lm -ldl" '
+
+sanity_check_paths = {
+    'files': ['bin/atompaw', 'bin/graphatom'],
+    'dirs': ['bin'],
+}
+
+moduleclass = 'chem'