Skip to content

Commit

Permalink
Merge pull request #20163 from Micket/20240320134424_new_pr_libxc434
Browse files Browse the repository at this point in the history 
Switch libxc sources to gitlab
  • Loading branch information
@jfgrimm
jfgrimm authored Mar 20, 2024
2 parents 53b6708 + 988432e commit 2ac5b43
Show file tree
Hide file tree
Showing 22 changed files with 88 additions and 66 deletions.
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-4.3.4-GCC-10.2.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,21 +3,22 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '4.3.4'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '10.2.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
patches = [
'libxc-%(version)s_lm-fix.patch',
'libxc-%(version)s_fix-CMakeLists.patch',
'libxc-%(version)s_fix-timeout.patch',
]
checksums = [
'a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337', # libxc-4.3.4.tar.gz
('a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337',
'83aba38dfa03f34cc74f84c14c83bf501a43493c818c797e2d0682647569b147'), # libxc-4.3.4.tar.gz
'f2cae17533d3527e11cfec958a7f253872f7c5fcd104c3cffc02382be0ccfb9c', # libxc-4.3.4_lm-fix.patch
'5a5e7d69729326e0d44e60b554ba6d8650a28958ec54b27a98757dc78a040946', # libxc-4.3.4_fix-CMakeLists.patch
'd44d4a35ae22542c3086e57638e0e2b6b1ad8e98d0898036972a0248cf8778e8', # libxc-4.3.4_fix-timeout.patch
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-4.3.4-GCC-10.3.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,21 +3,22 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '4.3.4'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '10.3.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
patches = [
'libxc-%(version)s_lm-fix.patch',
'libxc-%(version)s_fix-CMakeLists.patch',
'libxc-%(version)s_fix-timeout.patch',
]
checksums = [
'a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337', # libxc-4.3.4.tar.gz
('a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337',
'83aba38dfa03f34cc74f84c14c83bf501a43493c818c797e2d0682647569b147'), # libxc-4.3.4.tar.gz
'f2cae17533d3527e11cfec958a7f253872f7c5fcd104c3cffc02382be0ccfb9c', # libxc-4.3.4_lm-fix.patch
'5a5e7d69729326e0d44e60b554ba6d8650a28958ec54b27a98757dc78a040946', # libxc-4.3.4_fix-CMakeLists.patch
'd44d4a35ae22542c3086e57638e0e2b6b1ad8e98d0898036972a0248cf8778e8', # libxc-4.3.4_fix-timeout.patch
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-4.3.4-GCC-11.2.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,21 +3,22 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '4.3.4'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '11.2.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
patches = [
'libxc-%(version)s_lm-fix.patch',
'libxc-%(version)s_fix-CMakeLists.patch',
'libxc-%(version)s_fix-timeout.patch',
]
checksums = [
'a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337', # libxc-4.3.4.tar.gz
('a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337',
'83aba38dfa03f34cc74f84c14c83bf501a43493c818c797e2d0682647569b147'), # libxc-4.3.4.tar.gz
'f2cae17533d3527e11cfec958a7f253872f7c5fcd104c3cffc02382be0ccfb9c', # libxc-4.3.4_lm-fix.patch
'5a5e7d69729326e0d44e60b554ba6d8650a28958ec54b27a98757dc78a040946', # libxc-4.3.4_fix-CMakeLists.patch
'd44d4a35ae22542c3086e57638e0e2b6b1ad8e98d0898036972a0248cf8778e8', # libxc-4.3.4_fix-timeout.patch
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-4.3.4-GCC-9.3.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,21 +3,22 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '4.3.4'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '9.3.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
patches = [
'libxc-%(version)s_lm-fix.patch',
'libxc-%(version)s_fix-CMakeLists.patch',
'libxc-%(version)s_fix-timeout.patch',
]
checksums = [
'a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337', # libxc-4.3.4.tar.gz
('a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337',
'83aba38dfa03f34cc74f84c14c83bf501a43493c818c797e2d0682647569b147'), # libxc-4.3.4.tar.gz
'f2cae17533d3527e11cfec958a7f253872f7c5fcd104c3cffc02382be0ccfb9c', # libxc-4.3.4_lm-fix.patch
'5a5e7d69729326e0d44e60b554ba6d8650a28958ec54b27a98757dc78a040946', # libxc-4.3.4_fix-CMakeLists.patch
'd44d4a35ae22542c3086e57638e0e2b6b1ad8e98d0898036972a0248cf8778e8', # libxc-4.3.4_fix-timeout.patch
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-4.3.4-iccifort-2020.1.217.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,13 +3,13 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '4.3.4'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'iccifort', 'version': '2020.1.217'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
patches = [
'libxc-%(version)s_rename-F03.patch',
Expand All @@ -18,7 +18,8 @@ patches = [
'libxc-%(version)s_fix-timeout.patch',
]
checksums = [
'a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337', # libxc-4.3.4.tar.gz
('a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337',
'83aba38dfa03f34cc74f84c14c83bf501a43493c818c797e2d0682647569b147'), # libxc-4.3.4.tar.gz
'e494be3ca2026998f2dd7c6b03a4e662f204fd3d963271e588f9f0d5739e76b5', # libxc-4.3.4_rename-F03.patch
'f2cae17533d3527e11cfec958a7f253872f7c5fcd104c3cffc02382be0ccfb9c', # libxc-4.3.4_lm-fix.patch
'5a5e7d69729326e0d44e60b554ba6d8650a28958ec54b27a98757dc78a040946', # libxc-4.3.4_fix-CMakeLists.patch
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-4.3.4-iccifort-2020.4.304.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,13 +3,13 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '4.3.4'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'iccifort', 'version': '2020.4.304'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
patches = [
'libxc-%(version)s_rename-F03.patch',
Expand All @@ -18,7 +18,8 @@ patches = [
'libxc-%(version)s_fix-timeout.patch',
]
checksums = [
'a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337', # libxc-4.3.4.tar.gz
('a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337',
'83aba38dfa03f34cc74f84c14c83bf501a43493c818c797e2d0682647569b147'), # libxc-4.3.4.tar.gz
'e494be3ca2026998f2dd7c6b03a4e662f204fd3d963271e588f9f0d5739e76b5', # libxc-4.3.4_rename-F03.patch
'f2cae17533d3527e11cfec958a7f253872f7c5fcd104c3cffc02382be0ccfb9c', # libxc-4.3.4_lm-fix.patch
'5a5e7d69729326e0d44e60b554ba6d8650a28958ec54b27a98757dc78a040946', # libxc-4.3.4_fix-CMakeLists.patch
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-4.3.4-intel-compilers-2021.2.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,13 +3,13 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '4.3.4'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'intel-compilers', 'version': '2021.2.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
patches = [
'libxc-%(version)s_rename-F03.patch',
Expand All @@ -18,7 +18,8 @@ patches = [
'libxc-%(version)s_fix-timeout.patch',
]
checksums = [
'a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337', # libxc-4.3.4.tar.gz
('a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337',
'83aba38dfa03f34cc74f84c14c83bf501a43493c818c797e2d0682647569b147'), # libxc-4.3.4.tar.gz
'e494be3ca2026998f2dd7c6b03a4e662f204fd3d963271e588f9f0d5739e76b5', # libxc-4.3.4_rename-F03.patch
'f2cae17533d3527e11cfec958a7f253872f7c5fcd104c3cffc02382be0ccfb9c', # libxc-4.3.4_lm-fix.patch
'5a5e7d69729326e0d44e60b554ba6d8650a28958ec54b27a98757dc78a040946', # libxc-4.3.4_fix-CMakeLists.patch
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-4.3.4-intel-compilers-2021.4.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,13 +3,13 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '4.3.4'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'intel-compilers', 'version': '2021.4.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
patches = [
'libxc-%(version)s_rename-F03.patch',
Expand All @@ -18,7 +18,8 @@ patches = [
'libxc-%(version)s_fix-timeout.patch',
]
checksums = [
'a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337', # libxc-4.3.4.tar.gz
('a8ee37ddc5079339854bd313272856c9d41a27802472ee9ae44b58ee9a298337',
'83aba38dfa03f34cc74f84c14c83bf501a43493c818c797e2d0682647569b147'), # libxc-4.3.4.tar.gz
'e494be3ca2026998f2dd7c6b03a4e662f204fd3d963271e588f9f0d5739e76b5', # libxc-4.3.4_rename-F03.patch
'f2cae17533d3527e11cfec958a7f253872f7c5fcd104c3cffc02382be0ccfb9c', # libxc-4.3.4_lm-fix.patch
'5a5e7d69729326e0d44e60b554ba6d8650a28958ec54b27a98757dc78a040946', # libxc-4.3.4_fix-CMakeLists.patch
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-5.1.2-GCC-10.2.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,15 +3,16 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '5.1.2'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '10.2.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
checksums = ['180d52b5552921d1fac8a10869dd30708c0fb41dc202a3bbee0e36f43872718a']
checksums = [('180d52b5552921d1fac8a10869dd30708c0fb41dc202a3bbee0e36f43872718a',
'3fe05ccf7033622112f7d6ab28ac82301f5840b8d1bbe8b6df1022dbc732883f')]

builddependencies = [
('CMake', '3.18.4'),
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-5.1.3-GCC-10.2.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,15 +3,16 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '5.1.3'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '10.2.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
checksums = ['0350defdd6c1b165e4cf19995f590eee6e0b9db95a6b221d28cecec40f4e85cd']
checksums = [('0350defdd6c1b165e4cf19995f590eee6e0b9db95a6b221d28cecec40f4e85cd',
'53cbccae4227794c4f4e042d0c20c3171894d8eacd13fd78aab376d5971a966c')]

builddependencies = [
('CMake', '3.18.4'),
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-5.1.5-GCC-10.3.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -6,15 +6,16 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '5.1.5'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '10.3.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
checksums = ['02e4615a22dc3ec87a23efbd3d9be5bfad2445337140bad1720699571c45c3f9']
checksums = [('02e4615a22dc3ec87a23efbd3d9be5bfad2445337140bad1720699571c45c3f9',
'f2b428838536bcf2009af6a753f7314a069eed6a55bf1d1af4d4dcbcdd1c3697')]

builddependencies = [
('CMake', '3.20.1'),
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-5.1.5-intel-compilers-2021.2.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,15 +3,16 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '5.1.5'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'intel-compilers', 'version': '2021.2.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
checksums = ['02e4615a22dc3ec87a23efbd3d9be5bfad2445337140bad1720699571c45c3f9']
checksums = [('02e4615a22dc3ec87a23efbd3d9be5bfad2445337140bad1720699571c45c3f9',
'f2b428838536bcf2009af6a753f7314a069eed6a55bf1d1af4d4dcbcdd1c3697')]

builddependencies = [
('CMake', '3.20.1'),
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-5.1.6-GCC-11.2.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,15 +3,16 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '5.1.6'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '11.2.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
checksums = ['0d0496513114ed84987c32649912f9a65d234696dab13a4b00ce8c420bfc0a1d']
checksums = [('0d0496513114ed84987c32649912f9a65d234696dab13a4b00ce8c420bfc0a1d',
'1f752b2cf65c8145c1830f2d666181649c27bc0dd9685893d172822afade29f6')]

builddependencies = [
('CMake', '3.21.1'),
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-5.1.6-intel-compilers-2021.4.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,15 +3,16 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '5.1.6'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'intel-compilers', 'version': '2021.4.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
checksums = ['0d0496513114ed84987c32649912f9a65d234696dab13a4b00ce8c420bfc0a1d']
checksums = [('0d0496513114ed84987c32649912f9a65d234696dab13a4b00ce8c420bfc0a1d',
'1f752b2cf65c8145c1830f2d666181649c27bc0dd9685893d172822afade29f6')]

builddependencies = [
('CMake', '3.21.1'),
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-5.2.3-GCC-11.3.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,15 +3,16 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '5.2.3'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '11.3.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
checksums = ['7b7a96d8eeb472c7b8cca7ac38eae27e0a8113ef44dae5359b0eb12592b4bcf2']
checksums = [('7b7a96d8eeb472c7b8cca7ac38eae27e0a8113ef44dae5359b0eb12592b4bcf2',
'38b60ed552b46367175b370e1ad5409fcf45c49b71ed13706a65b485f06a5417')]

builddependencies = [
('CMake', '3.23.1'),
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-5.2.3-intel-compilers-2022.1.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,15 +3,16 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '5.2.3'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'intel-compilers', 'version': '2022.1.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
checksums = ['7b7a96d8eeb472c7b8cca7ac38eae27e0a8113ef44dae5359b0eb12592b4bcf2']
checksums = [('7b7a96d8eeb472c7b8cca7ac38eae27e0a8113ef44dae5359b0eb12592b4bcf2',
'38b60ed552b46367175b370e1ad5409fcf45c49b71ed13706a65b485f06a5417')]

builddependencies = [
('CMake', '3.23.1'),
Expand Down
7 changes: 4 additions & 3 deletions easybuild/easyconfigs/l/libxc/libxc-6.1.0-GCC-12.2.0.eb
View file
Original file line number Diff line number Diff line change
Expand Up @@ -3,15 +3,16 @@ easyblock = 'CMakeMake'
name = 'libxc'
version = '6.1.0'

homepage = 'https://www.tddft.org/programs/libxc'
homepage = 'https://libxc.gitlab.io'
description = """Libxc is a library of exchange-correlation functionals for density-functional theory.
The aim is to provide a portable, well tested and reliable set of exchange and correlation functionals."""

toolchain = {'name': 'GCC', 'version': '12.2.0'}

source_urls = ['https://www.tddft.org/programs/libxc/down.php?file=%(version)s/']
source_urls = ['https://gitlab.com/libxc/libxc/-/archive/%(version)s/']
sources = [SOURCE_TAR_GZ]
checksums = ['a3aa16915942543031a5d9c4a92c439ce54249bdcda8c91c4e69e65329dc9a54']
checksums = [('a3aa16915942543031a5d9c4a92c439ce54249bdcda8c91c4e69e65329dc9a54',
'f593745fa47ebfb9ddc467aaafdc2fa1275f0d7250c692ce9761389a90dd8eaf')]

builddependencies = [
('CMake', '3.24.3'),
Expand Down
Loading

0 comments on commit 2ac5b43

Please sign in to comment.