[Nek5000] [package list]

Nek5000/19.0-cpeGNU-21.12 (Nek5000-19.0-cpeGNU-21.12.eb)

Install with the EasyBuild-user module:

eb Nek5000-19.0-cpeGNU-21.12.eb -r

To access module help after installation and get reminded for which stacks and partitions the module is installed, use module spider Nek5000/19.0-cpeGNU-21.12.

EasyConfig:

easyblock = 'PackedBinary'

name = 'Nek5000'
version = '19.0'

homepage = 'https://nek5000.mcs.anl.gov/'

whatis = [
    'Description: Nek5000 is a fast and scalable high-order solver for computational fluid dynamics'
]

description = """
Nek5000 is a spectral element solver for computational fluid dynamics.
It features state-of-the-art, scalable algorithms that are fast and 
efficient on platforms ranging from laptops to the world’s fastest 
computers. Applications span a wide range of fields, including fluid 
flow, thermal convection, combustion and magnetohydrodynamics. 
The user community includes hundreds of scientists and engineers in 
academia, laboratories and industry.

This module provides the necessary tools to build your Nek5000
binary.
"""

toolchain = {'name': 'cpeGNU', 'version': '21.12'}
toolchainopts = {'pic': True, 'usempi': True}

source_urls = ['https://github.com/Nek5000/Nek5000/archive/']
sources = ['v%(version)s.tar.gz']
#patches = [
#    '%(name)s-%(version)s_hypre_blas.patch',
#    '%(name)s-%(version)s_sundials.patch',
#]

#checksums = [
#    '4d8d4793ce3c926c54e09a5a5968fa959fe0ba46bd2e6b8043e099528ee35a60',  # v17.0.tar.gz
#    'b3820a9e141a1c3087aaabbb140ecf11756b552a175619f9e12d913afd850794',  # Nek5000-17.0_hypre_blas.patch
#    'af9e3771483d9a1732135ca1fd25f902706bf6e8f9c8552bc4bdf24d9a1c0244',  # Nek5000-17.0_sundials.patch
#]

#builddependencies = [('CMake', '3.10.2')]

dependencies = [(
    'X11', '%(toolchain_version)s')
]

buildininstalldir = True

install_cmd = (
    'mv %(name)s-%(version)s/{*,.[^.]*} . && rmdir %(name)s-%(version)s && cd tools && env CC=cc FC=ftn && ' 
    './maketools genmap gencon genbox n2to3 reatore2 nekmerge prenek postnek nekamg_setup gmsh2nek cgns2nek'
    #'cd ../3rd_party/gslib && env GSLIB_OPT="USREXIT=1 BLAS=2 PREFIX=gslib_ FPREFIX=fgslib_" ./install && '
    #'cd ../cvode && ./install'
)

postinstallcmds = [
    'sed -i -e "s|^#FC=.*|FC=$FC|" bin/makenek',
    'sed -i -e "s|^#CC=.*|CC=$CC|" bin/makenek',
    'sed -i -e "s|^#FFLAGS=.*|FFLAGS=<dquote>$FFLAGS<dquote>|" bin/makenek',
    'sed -i -e "s|^#CFLAGS=.*|CFLAGS=<dquote>$CFLAGS<dquote>|" bin/makenek',
    """sed -i -e 's|<dquote>|"|g' bin/makenek""",
]

sanity_check_paths = {
    'files': ['bin/genmap', 'bin/nekmerge', 'bin/prex', 'bin/genbox', 'bin/n2to3', 'bin/postx',
              'bin/reatore2', 'bin/re2torea'],
    'dirs': []
}

modextravars = {'NEK_SOURCE_ROOT': '%(installdir)s'}

moduleclass = 'cae'

[Nek5000] [package list]