{math,phys,chem}[foss/2024] Meep 1.29.0

easybuild/easyconfigs/h/Harminv/Harminv-1.4.2-gfbf-2023b.eb

@@ -0,0 +1,30 @@
+easyblock = 'ConfigureMake'
+
+name = 'Harminv'
+version = '1.4.2'
+
+homepage = 'https://github.com/stevengj/harminv'
+description = """Harminv is a free program (and accompanying library) to solve the problem of harmonic inversion -
+ given a discrete-time, finite-length signal that consists of a sum of finitely-many sinusoids (possibly exponentially
+ decaying) in a given bandwidth, it determines the frequencies, decay constants, amplitudes, and phases of those
+ sinusoids."""
+
+toolchain = {'name': 'gfbf', 'version': '2023b'}
+toolchainopts = {'opt': True, 'unroll': True, 'pic': True, 'cstd': 'c99'}
+
+source_urls = ['https://github.com/stevengj/harminv/releases/download/v%(version)s/']
+sources = [SOURCELOWER_TAR_GZ]
+checksums = ['5a9a1bf710972442f065d0d62c62d0c4ec3da4a3696d7160a35602c9470bc7a2']
+
+builddependencies = [
+    ('pkgconfig', '1.5.5', '-python'),
+]
+
+configopts = "--with-pic --with-blas=flexiblas --with-lapack=flexiblas --enable-shared"
+
+sanity_check_paths = {
+    'files': ['bin/harminv', 'include/harminv.h', 'lib/libharminv.a', 'lib/libharminv.%s' % SHLIB_EXT],
+    'dirs': []
+}
+
+moduleclass = 'math'

easybuild/easyconfigs/h/Harminv/Harminv-1.4.2-gfbf-2024a.eb

@@ -0,0 +1,30 @@
+easyblock = 'ConfigureMake'
+
+name = 'Harminv'
+version = '1.4.2'
+
+homepage = 'https://github.com/stevengj/harminv'
+description = """Harminv is a free program (and accompanying library) to solve the problem of harmonic inversion -
+ given a discrete-time, finite-length signal that consists of a sum of finitely-many sinusoids (possibly exponentially
+ decaying) in a given bandwidth, it determines the frequencies, decay constants, amplitudes, and phases of those
+ sinusoids."""
+
+toolchain = {'name': 'gfbf', 'version': '2024a'}
+toolchainopts = {'opt': True, 'unroll': True, 'pic': True, 'cstd': 'c99'}
+
+source_urls = ['https://github.com/stevengj/harminv/releases/download/v%(version)s/']
+sources = [SOURCELOWER_TAR_GZ]
+checksums = ['5a9a1bf710972442f065d0d62c62d0c4ec3da4a3696d7160a35602c9470bc7a2']
+
+builddependencies = [
+    ('pkg-config', '0.29.2'),
+]
+
+configopts = "--with-pic --with-blas=flexiblas --with-lapack=flexiblas --enable-shared"
+
+sanity_check_paths = {
+    'files': ['bin/harminv', 'include/harminv.h', 'lib/libharminv.a', 'lib/libharminv.%s' % SHLIB_EXT],
+    'dirs': []
+}
+
+moduleclass = 'math'

easybuild/easyconfigs/l/libGDSII/libGDSII-0.21-GCCcore-13.3.0.eb

@@ -0,0 +1,26 @@
+easyblock = 'ConfigureMake'
+
+name = 'libGDSII'
+version = '0.21'
+
+homepage = 'https://github.com/HomerReid/libGDSII'
+description = """libGDSII is a C++ library for working with GDSII binary data files,
+ intended primarily for use with the computational electromagnetism codes
+ scuff-em and meep but sufficiently general-purpose to allow other uses as well."""
+
+toolchain = {'name': 'GCCcore', 'version': '13.3.0'}
+
+source_urls = ['https://github.com/HomerReid/libGDSII/releases/download/v%(version)s/']
+sources = [SOURCELOWER_TAR_GZ]
+checksums = ['31c90a4fb699746d051c0c597ef0543889c9f17b2a711fed398756ac4f1b1f4c']
+
+builddependencies = [
+    ('binutils', '2.42'),
+]
+
+sanity_check_paths = {
+    'files': ['bin/GDSIIConvert', 'include/libGDSII.h', 'lib/libGDSII.a', 'lib/libGDSII.%s' % SHLIB_EXT],
+    'dirs': [],
+}
+
+moduleclass = 'data'

easybuild/easyconfigs/l/libctl/libctl-4.5.1-GCCcore-13.3.0.eb

@@ -0,0 +1,33 @@
+easyblock = 'ConfigureMake'
+
+name = 'libctl'
+version = '4.5.1'
+
+homepage = 'https://libctl.readthedocs.io/en/latest/'
+description = """libctl is a free Guile-based library implementing flexible control files for scientific simulations."""
+
+toolchain = {'name': 'GCCcore', 'version': '13.3.0'}
+toolchainopts = {'pic': True}
+
+source_urls = ['https://github.com/NanoComp/libctl/releases/download/v%(version)s/']
+sources = [SOURCE_TAR_GZ]
+checksums = ['fcfeb2f13dda05b560f0ec6872757d9318fdfe8f4bc587eb2053a29ba328ae25']
+
+builddependencies = [
+    ('binutils', '2.42'),
+    ('Autotools', '20231222'),  # required for libtool
+]
+
+dependencies = [
+    ('Guile', '3.0.10'),
+]
+
+configopts = '--with-pic --enable-shared'
+
+sanity_check_paths = {
+    'files': ['bin/gen-ctl-io', 'lib/libctl.a', 'lib/libctlgeom.a',
+              'lib/libctlgeom.%s' % SHLIB_EXT, 'lib/libctl.%s' % SHLIB_EXT],
+    'dirs': ['include'],
+}
+
+moduleclass = 'chem'

easybuild/easyconfigs/m/MPB/MPB-1.11.1-foss-2024a.eb

@@ -0,0 +1,48 @@
+easyblock = 'ConfigureMake'
+
+name = 'MPB'
+version = '1.11.1'
+
+homepage = 'https://mpb.readthedocs.io/en/latest/'
+description = """MPB is a free and open-source software package for computing
+ the band structures, or dispersion relations, and electromagnetic
+ modes of periodic dielectric structures, on both serial
+ and parallel computers. MPB is an acronym for MIT Photonic Bands."""
+
+toolchain = {'name': 'foss', 'version': '2024a'}
+toolchainopts = {'usempi': True, 'pic': True}
+
+source_urls = ['https://github.com/NanoComp/mpb/releases/download/v%(version)s/']
+sources = [SOURCELOWER_TAR_GZ]
+checksums = ['dc55b081c56079727dac92d309f8e4ea84ca6eea9122ec24b7955f8c258608e1']
+
+builddependencies = [
+    ('Autotools', '20231222'),
+]
+
+dependencies = [
+    ('Python', '3.12.3'),
+    ('HDF5', '1.14.5'),
+    ('libctl', '4.5.1'),
+    ('Guile', '3.0.10'),
+    ('libreadline', '8.2'),
+]
+
+local_common_configopts = "--with-pic --with-blas=flexiblas --with-lapack=flexiblas "
+local_common_configopts += "--with-libctl=$EBROOTLIBCTL/share/libctl --enable-shared "
+
+configopts = [
+    local_common_configopts + " ",
+    local_common_configopts + " --with-inv-symmetry",
+    local_common_configopts + " --with-mpi ",
+    local_common_configopts + " --with-mpi --with-inv-symmetry",
+]
+
+sanity_check_paths = {
+    'files': ['bin/mpb%s' % x for x in ['', '-data', 'i', 'i-data', 'i-mpi', 'i-split', '-mpi', '-split']] +
+             ['lib/libmpb.a', 'lib/libmpbi_mpi.a', 'lib/libmpbi.a', 'lib/libmpb_mpi.a', 'lib/libmpb.%s' % SHLIB_EXT,
+              'lib/libmpbi_mpi.%s' % SHLIB_EXT, 'lib/libmpbi.%s' % SHLIB_EXT, 'lib/libmpb_mpi.%s' % SHLIB_EXT],
+    'dirs': ['include'],
+}
+
+moduleclass = 'phys'

easybuild/easyconfigs/m/Meep/Meep-1.29.0-foss-2024a.eb

@@ -0,0 +1,52 @@
+easyblock = 'ConfigureMake'
+
+name = 'Meep'
+version = '1.29.0'
+
+homepage = 'https://meep.readthedocs.io/en/latest/'
+description = """Meep (or MEEP) is a free finite-difference time-domain (FDTD) simulation software package
+ developed at MIT to model electromagnetic systems."""
+
+toolchain = {'name': 'foss', 'version': '2024a'}
+toolchainopts = {'usempi': True, 'opt': True, 'unroll': True, 'pic': True}
+
+source_urls = ['https://github.com/NanoComp/%(namelower)s/releases/download/v%(version)s/']
+sources = ['%(namelower)s-%(version)s.tar.gz']
+checksums = ['68279f862cf9342a6e0f2023667d6a6ac7c1eafe46663705519772f312412194']
+
+builddependencies = [
+    ('Autotools', '20231222'),
+    ('pkgconfig', '1.5.5', '-python'),
+    ('SWIG', '4.2.1')
+]
+
+dependencies = [
+    ('Python', '3.12.3'),
+    ('SciPy-bundle', '2024.05'),
+    ('matplotlib', '3.9.2'),
+    ('MPB', '1.11.1'),
+    ('Harminv', '1.4.2'),
+    ('HDF5', '1.14.5'),
+    ('libctl', '4.5.1'),
+    ('libGDSII', '0.21'),
+    ('GSL', '2.8'),
+    ('Guile', '3.0.10'),
+]
+
+configopts = "--with-pic --with-mpi --with-blas=flexiblas --with-lapack=flexiblas --without-gcc-arch "
+configopts += "--with-libctl=$EBROOTLIBCTL/share/libctl --enable-shared "
+
+sanity_check_paths = {
+    'files': ['bin/meep', 'include/meep.hpp', 'lib/libmeep.a', 'lib/libpympb.a',
+              'lib/libmeep.%s' % SHLIB_EXT, 'lib/libpympb.%s' % SHLIB_EXT],
+    'dirs': ['include/meep', 'lib/python%(pyshortver)s/site-packages/meep', 'share/meep'],
+}
+
+sanity_check_commands = [
+    "meep --help",
+    "python -c 'import meep'",
+]
+
+modextrapaths = {'PYTHONPATH': ['lib/python%(pyshortver)s/site-packages']}
+
+moduleclass = 'phys'

easybuild/easyconfigs/p/pkg-config/pkg-config-0.29.2-GCCcore-13.3.0.eb

@@ -0,0 +1,36 @@
+# pkgconf should be used in preference to pkg-config
+# This is included for use only in software that fails to build when using pkgconf
+easyblock = 'ConfigureMake'
+
+name = 'pkg-config'
+version = '0.29.2'
+
+homepage = 'https://www.freedesktop.org/wiki/Software/pkg-config/'
+
+description = """
+ pkg-config is a helper tool used when compiling applications and libraries.
+ It helps you insert the correct compiler options on the command line so an
+ application can use gcc -o test test.c `pkg-config --libs --cflags glib-2.0`
+ for instance, rather than hard-coding values on where to find glib (or other
+ libraries).
+"""
+
+toolchain = {'name': 'GCCcore', 'version': '13.3.0'}
+
+source_urls = ['https://pkg-config.freedesktop.org/releases/']
+sources = [SOURCELOWER_TAR_GZ]
+checksums = ['6fc69c01688c9458a57eb9a1664c9aba372ccda420a02bf4429fe610e7e7d591']
+
+builddependencies = [('binutils', '2.42')]
+
+# don't use PAX, it might break.
+tar_config_opts = True
+
+configopts = " --with-internal-glib"
+
+sanity_check_paths = {
+    'files': ['bin/pkg-config'],
+    'dirs': [],
+}
+
+moduleclass = 'devel'