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* lammps: add new stable version 20230802.1
* lammps: add missing potential download for +mesont
* lammps: fix python package install
* Update var/spack/repos/builtin/packages/lammps/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* lammps: py-numpy and py-mpi4py should be build and run deps
* lammps: add new 20231121 release
- MPIIO package has been removed -> disable mpiio variant
- LAMMPS_EXCEPTIONS is now always on -> disable exceptions variant
- CMake 3.16+ is now required
- Kokkos 4.1.0 is now supported
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Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
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Co-authored-by: LydDeb <lyderic.debusschere@eolen.com>
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Co-authored-by: LydDeb <lyderic.debusschere@eolen.com>
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Co-authored-by: LydDeb <lyderic.debusschere@eolen.com>
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* [add] py-sphinx-jinja2-compat: new package
* py-whey-pth: new package, dependence of py-sphinx-jinja2-compat
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Co-authored-by: LydDeb <lyderic.debusschere@eolen.com>
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* py-sphinx-removed-in: new package
* py-sphinx-removed-in: fix dependence
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Co-authored-by: LydDeb <lyderic.debusschere@eolen.com>
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* Add missing runtime dependency on py-colorama to py-ansimarkup
* Add py-metomi-isodatetime@3.1.0
* New package py-graphql-relay
* Update py-cylc-flowi, add version 8.2.3
* Fix merge conflict
* Revert mistake in var/spack/repos/builtin/packages/py-cylc-flow/package.py
* Update py-metomi-isodatetime dependencies for py-cylc-flow
* Add 'climbfuji' to list of maintainers for py-cylc-flow
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* py-beartype: new package with version 0.15.0
* Update var/spack/repos/builtin/packages/py-beartype/package.py
Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
* py-beartype: depend on python 3.8 or higher
* py-beartype: add new version 0.16.2
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Co-authored-by: Adam J. Stewart <ajstewart426@gmail.com>
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* py-mpi4py: fix build with Apple Clang
* [@spackbot] updating style on behalf of adamjstewart
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Co-authored-by: adamjstewart <adamjstewart@users.noreply.github.com>
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* vtk-m: bump vtk-m 2.1.0
* Update package.py
* Update package.py
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* Add new versions to TFEL and MGIS
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* Add R license and missing versions
* Fix rmath build directory
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* mochi-thallium: added a few newer versions
* mochi-thallium: added constraint on the version of margo required
* removed thallium 0.12 which needs updating
* mochi-thallium: fixed hash for version 0.12.0
* removed thallium 0.12 which needs updating (again)
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* singularity-eos: deprecate v1.6 versions and remove unused code
* singularity-eos: add v1.8.0
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* perl-carp-assert: add new package with version 0.22
* fix style
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When using `spack external find acfl`, we get the full version string
with 4 components in `packages.yaml`. This PR truncates the version
nubmer when finding the `armpl` component to be able to run without
intervention.
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* developer tools stack try 2
This version is actually in use locally and has largely stabilized, at
least on x86. Some packages are still a challenge on ppc64le, but maybe
worth keeping this working as a set.
* add packages, try to get container with newer gcc
* remove reuse: true
* try to get cmake to build on medium, 25 minutes is too long
* add lsd package and add to dev tools stack
* clean up fzf dependency and sorting
* Update share/spack/gitlab/cloud_pipelines/stacks/developer_tools/spack.yaml
* cuda: add 12.3.0 (#40827)
* Switch to dashes
* yet more underscores
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Co-authored-by: Paul R. C. Kent <kentpr@ornl.gov>
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* Update SIRIUS version for CP2K master
* Update var/spack/repos/builtin/packages/cp2k/package.py
Co-authored-by: Rocco Meli <r.meli@bluemail.ch>
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Co-authored-by: Rocco Meli <r.meli@bluemail.ch>
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Replace last release due to build issues on windows. Tag was applied incorrectly
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Also fix netcdf-c zlib reference
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* py-numba: add v0.58.1
* Passing tests
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* py-pygeos: add v0.14
* Python is also a link dep
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* Kokkos: adding version 4.2.00 to the package
* Kokkos: adding AMD GPU arch
* kokkos@4.2.00 +sycl: patch numeric traits unit test
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Co-authored-by: eugeneswalker <eugenesunsetwalker@gmail.com>
Co-authored-by: Todd Gamblin <tgamblin@llnl.gov>
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* gipaw.x installed by cmake if version >= 5c4a4ce.
gipaw.x will only be installed with cmake if the qe-gipaw version
is >= 5c4a4ce. Currently, QE source uses the older f5823521 one.
Here a patch to the submodule_commit_hash_records to use a newer
qe-gipaw version.
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* added new packages
* align release with ccl patch
* revert version on compiler classics
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* dla-future: Add conflict for pedantic warnings turning into errors
* dla-future: Add conflicts for nvcc/fmt/Umpire compilation issues
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* initial commit to update hipblas rocalution, rocsolver, rocsparse to new syntax
* add rocblas test changes and fixes for hipblas and rocsolver tests
* fix styling
* remove updates for rocblas
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* Initial commit to fix hip tests and bump hip-examples to 5.6.1
* fix styling
* add installation of hip samples to share folder
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* apple-libuuid: update installation directory
Copy design of Apple GL
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The changes in patch xdmf2-hdf51.13.2.patch have effectively
been added to vtk@9.2.3 (commit e81a2fe)
So restrict application of patch fo @9:9.2
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* root: add a webgui patch
* Update var/spack/repos/builtin/packages/root/package.py
Co-authored-by: Massimiliano Culpo <massimiliano.culpo@gmail.com>
* Add also the versions that don't need the webgui patch
* Fix hash
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Co-authored-by: jmcarcell <jmcarcell@users.noreply.github.com>
Co-authored-by: Massimiliano Culpo <massimiliano.culpo@gmail.com>
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Setting CFLAGS/FCFLAGS overrides the default optimization flags.
This commit brings them back.
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Co-authored-by: Tom Scogland <scogland1@llnl.gov>
Co-authored-by: Wouter Deconinck <wdconinc@gmail.com>
Co-authored-by: Massimiliano Culpo <massimiliano.culpo@gmail.com>
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* qt-*: new versions 6.6.1
* qt-quick3d: fixup
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