Commit graph

33726 commits

Author SHA1 Message Date
Brian Van Essen
7a4df732e1
DiHydrogen, Hydrogen, and Aluminum CachedCMakePackage (#39714) 2023-11-09 19:08:37 +01:00
George Young
7e6aaf9458
py-macs3: adding zlib dependency (#40979) 2023-11-09 16:44:24 +01:00
Cody Balos
2d35d29e0f
sundials: add v6.6.2 (#40920) 2023-11-09 07:38:40 -06:00
Scott Wittenburg
1baed0d833
buildcache: skip unrecognized metadata files (#40941)
This commit improves forward compatibility of Spack with newer build cache metadata formats.

Before this commit, invalid or unrecognized metadata would be fatal errors, now they just cause
a mirror to be skipped.

Co-authored-by: Harmen Stoppels <me@harmenstoppels.nl>
2023-11-09 13:30:41 +00:00
Harmen Stoppels
cadc2a1aa5
Set version to 0.22.0.dev0 (#40975) 2023-11-09 10:02:29 +01:00
Satish Balay
78449ba92b
intel-oneapi-mkl: do not set __INTEL_POST_CFLAGS env variable (#40947)
This triggers warnings from icx compiler - that breaks petsc configure

$ I_MPI_CC=icx /opt/intel/oneapi/mpi/2021.7.0/bin/mpiicc -E a.c > /dev/null
$ __INTEL_POST_CFLAGS=-Wl,-rpath,/opt/intel/oneapi/mkl/2022.2.0/lib/intel64 I_MPI_CC=icx /opt/intel/oneapi/mpi/2021.7.0/bin/mpiicc -E a.c > /dev/null
icx: warning: -Wl,-rpath,/opt/intel/oneapi/mkl/2022.2.0/lib/intel64: 'linker' input unused [-Wunused-command-line-argument]
2023-11-09 08:40:12 +01:00
Massimiliano Culpo
26d6bfbb7f
modules: remove deprecated code and test data (#40966)
This removes a few deprecated attributes from the
schema of the "modules" section. Test data for
deprecated options is removed as well.
2023-11-09 08:15:46 +01:00
Sergio Sánchez Ramírez
3405fe60f1
libgit2: add python as test dependency (#40863)
Libgit2 requires python as build dependency. I was getting an error because it was falling back to system Python which is compiled with Intel compilers and thus, `libgit2` was failing because it couldn't find `libimf.so` (which doesn't make sense).

Co-authored-by: Harmen Stoppels <harmenstoppels@gmail.com>
2023-11-08 23:20:55 +01:00
Harmen Stoppels
53c266b161
modules: restore exclude_implicits (#40958) 2023-11-08 22:56:55 +01:00
Thomas Madlener
ed8ecc469e
podio: Add the latest tag (0.17.2) (#40956)
* podio: Add myself as maintainer
* podio: Add 0.17.2 tag
2023-11-08 14:53:23 -07:00
Harmen Stoppels
b2840acd52
Revert "defaults/modules.yaml: hide implicits (#40906)" (#40955)
This reverts commit a2f00886e9.
2023-11-08 14:33:50 -07:00
Tom Vander Aa
c35250b313
libevent: always autogen.sh (#40945)
The libevent release tarballs ship with a `configure` script generated by an old `libtool`. The `libtool` generated by `configure` is not compatible with `MACOSX_DEPLOYMENT_VERSION` > 10. Regeneration of the `configure` scripts fixes build on macOS. 

Original configure contains:
```
    case $host_os in
    rhapsody* | darwin1.[012])
      _lt_dar_allow_undefined='$wl-undefined ${wl}suppress' ;;
    darwin1.*)
      _lt_dar_allow_undefined='$wl-flat_namespace $wl-undefined ${wl}suppress' ;;
    darwin*) # darwin 5.x on
      # if running on 10.5 or later, the deployment target defaults
      # to the OS version, if on x86, and 10.4, the deployment
      # target defaults to 10.4. Don't you love it?
      case ${MACOSX_DEPLOYMENT_TARGET-10.0},$host in
        10.0,*86*-darwin8*|10.0,*-darwin[91]*)
          _lt_dar_allow_undefined='$wl-undefined ${wl}dynamic_lookup' ;;
        10.[012][,.]*)
          _lt_dar_allow_undefined='$wl-flat_namespace $wl-undefined ${wl}suppress' ;;
        10.*)
          _lt_dar_allow_undefined='$wl-undefined ${wl}dynamic_lookup' ;;
      esac
```

After re-running `autogen.sh`:
```
    case $host_os in
    rhapsody* | darwin1.[012])
      _lt_dar_allow_undefined='$wl-undefined ${wl}suppress' ;;
    darwin1.*)
      _lt_dar_allow_undefined='$wl-flat_namespace $wl-undefined ${wl}suppress' ;;
    darwin*)
      case $MACOSX_DEPLOYMENT_TARGET,$host in
        10.[012],*|,*powerpc*-darwin[5-8]*)
          _lt_dar_allow_undefined='$wl-flat_namespace $wl-undefined ${wl}suppress' ;;
        *)
          _lt_dar_allow_undefined='$wl-undefined ${wl}dynamic_lookup' ;;
      esac
```
2023-11-08 22:33:09 +01:00
Adam J. Stewart
e114853115
py-lightning: add v2.1.1 (#40957) 2023-11-08 13:15:23 -08:00
Cameron Smith
89fc9a9d47
lcov: add version2, embed perl path in binaries (#39342)
* lcov: add version2, perl dep at build and runtime
* lcov: add runtime deps
* namespace-autoclean: new perl package
* datetime: dep on autoclean
* formatting
2023-11-08 11:23:23 -08:00
Massimiliano Culpo
afc693645a
tcl: filter compiler wrappers to avoid pointing to Spack (#40946) 2023-11-08 19:38:41 +01:00
downloadico
4ac0e511ad
abinit: add v9.10.3 (#40919)
* abinit:	add v9.10.3
Changed	configure arguments for specfying how to use Wannier90 for versions
after 9.8.
When the mpi variant is requested, set the F90 environment variable to point
to the MPI Fortran wrapper when building versions after 9.8 instead of FC.
---------

Co-authored-by: Alec Scott <hi@alecbcs.com>
2023-11-08 10:15:49 -08:00
Henri Menke
b0355d6cc0
ScaFaCoS 1.0.4 (#40948) 2023-11-08 10:17:58 -07:00
Konstantinos Parasyris
300d53d6f8
Add new tag on AMS (#40949) 2023-11-08 08:52:53 -08:00
Greg Becker
0b344e0fd3
tutorial stack: update for changes to the basics section for SC23 (#40942) 2023-11-07 23:46:57 -08:00
Peter Scheibel
15adb308bf
RAJA package: find libs (#40885) 2023-11-08 08:33:04 +01:00
Michael Kuhn
050d565375
julia: constrain patchelf version (#40938)
* julia: constrain patchelf version

patchelf@0.18 breaks (at least) `libjulea-internal.so`, leading to
errors like:
```
$ julia --version
ERROR: Unable to load dependent library $SPACK/opt/spack/linux-centos8-x86_64_v3/gcc-12.3.0/julia-1.9.2-6hf5qx2q27jth2fkm6kgqmfdlhzzw6pl/bin/../lib/julia/libjulia-internal.so.1
Message:$SPACK/opt/spack/linux-centos8-x86_64_v3/gcc-12.3.0/julia-1.9.2-6hf5qx2q27jth2fkm6kgqmfdlhzzw6pl/bin/../lib/julia/libjulia-internal.so.1: ELF load command address/offset not properly aligned
```

* patchelf: prefer v0.17.x since v0.18 breaks libraries
2023-11-08 08:13:54 +01:00
Matthew Thompson
f6ef2c254e
mapl: add v2.41 and v2.42 (#40870)
* mapl: add 2.41 and 2.42

* Conflict MPICH 3
2023-11-07 17:36:11 -08:00
Freifrau von Bleifrei
62c27b1924
discotec: add compression variant (#40925) 2023-11-07 14:58:48 -08:00
SWAT Team (JSC)
2ff0766aa4
adds cubew 4.8.1, cubelib 4.8.1 and cubegui 4.8.1, 4.8.2 (#40612)
* exago: fix v1.5.1 tag; only allow python up to 3.10 for for @:1.5 (#40676)
* exago: fix v1.5.1 tag; only allow python up to 3.10 for for @:1.5 due to pybind error with py 3.11
* hiop@:1.0 +cuda: constrain to cuda@:11.9
* fixes syntax of maintainers

---------

Co-authored-by: eugeneswalker <38933153+eugeneswalker@users.noreply.github.com>
2023-11-07 14:40:36 -08:00
Mark W. Krentel
dc245e87f9
intel-xed: fix git hash for mbuild, add version 2023.10.11 (#40922)
* intel-xed: fix git hash for mbuild, add version 2023.10.11
   Fixes #40912
* Fix the git commit hash for mbuild 2022.04.17.  This was broken in
   commit eef9939c21 by mixing up the hashes for xed versus mbuild.
* Add versions 2023.08.21 and 2023.10.11.
* fix style
2023-11-07 14:36:42 -08:00
Harmen Stoppels
c1f134e2a0
tutorial: use lmod@8.7.18 because @8.7.19: has bugs (#40939) 2023-11-07 23:04:45 +01:00
Mosè Giordano
391940d2eb
julia: Add v1.9.3 (#40911) 2023-11-07 22:06:12 +01:00
Adam J. Stewart
8c061e51e3
sleef: build shared libs (#40893) 2023-11-07 21:48:59 +01:00
Richarda Butler
5774df6b7a
Propagate variant across nodes that don't have that variant (#38512)
Before this PR, variant were not propagated to leaf nodes that could accept 
the propagated value, if some intermediate node couldn't accept it.

This PR fixes that issue by marking nodes as "candidate" for propagation
and by setting the variant only if it can be accepted by the node.

Co-authored-by: Massimiliano Culpo <massimiliano.culpo@gmail.com>
2023-11-07 21:04:41 +01:00
Harmen Stoppels
3a5c1eb5f3
tutorial pipeline: force gcc@12.3.0 (#40937) 2023-11-07 20:53:44 +01:00
Harmen Stoppels
3a2ec729f7
Ensure global command line arguments end up in args like before (#40929) 2023-11-07 20:35:56 +01:00
Jacob King
a093f4a8ce
superlu-dist: add +parmetis variant. (#40746)
* Expose ability to make parmetis an optional superlu-dist dependency to
spack package management.

* rename parmetis variant: Enable ParMETIS library

---------

Co-authored-by: eugeneswalker <eugenesunsetwalker@gmail.com>
2023-11-07 10:21:38 -08:00
Scott Wittenburg
b8302a8277
ci: do not retry timed out build jobs (#40936) 2023-11-07 17:44:28 +00:00
Massimiliano Culpo
32f319157d
Update the branch for the tutorial command (#40934) 2023-11-07 16:59:48 +00:00
Harmen Stoppels
75dfad8788
catch exceptions in which_string (#40935) 2023-11-07 17:17:31 +01:00
Vanessasaurus
f3ba20db26
fix configure args for darshan-runtime (#40873)
Problem: the current configure arguments are added lists to a list,
and this needs to be adding strings to the same list.
Solution: ensure we add each item (string) separately.

Signed-off-by: vsoch <vsoch@users.noreply.github.com>
Co-authored-by: vsoch <vsoch@users.noreply.github.com>
2023-11-07 07:00:28 -08:00
Rob Falgout
6301edbd5d
Update package.py for new release 2.30.0 (#40907) 2023-11-07 07:58:00 -07:00
Massimiliano Culpo
c232bf435a
Change container labeling so that "latest" is the latest tag (#40593)
* Use `major.minor.patch`, `major.minor`, `major` in tags

* Ensure `latest` is the semver largest version, and not "latest in time"

* Remove Ubuntu 18.04 from the list of images
2023-11-07 11:53:36 +01:00
Massimiliano Culpo
f3537bc66b
ASP: targets, compilers and providers soft-preferences are only global (#31261)
Modify the packages.yaml schema so that soft-preferences on targets,
compilers and providers can only be specified under the "all" attribute.
This makes them effectively global preferences.

Version preferences instead can only be specified under a package
specific section.

If a preference attribute is found in a section where it should
not be, it will be ignored and a warning is printed to screen.
2023-11-07 07:46:06 +01:00
Massimiliano Culpo
4004f27bc0
archspec: update to v0.2.2 (#40917)
Adds support for Neoverse V2
2023-11-07 07:44:52 +01:00
Todd Gamblin
910190f55b
database: optimize query() by skipping unnecessary virtual checks (#40898)
Most queries will end up calling `spec.satisfies(query)` on everything in the DB, which
will cause Spack to ask whether the query spec is virtual if its name doesn't match the
target spec's. This can be expensive, because it can cause Spack to check if any new
virtuals showed up in *all* the packages it knows about. That can currently trigger
thousands of `stat()` calls.

We can avoid the virtual check for most successful queries if we consider that if there
*is* a match by name, the query spec *can't* be virtual. This PR adds an optimization to
the query loop to save any comparisons that would trigger a virtual check for last.

- [x] Add a `deferred` list to the `query()` loop.
- [x] First run through the `query()` loop *only* checks for name matches.
- [x] Query loop now returns early if there's a name match, skipping most `satisfies()` calls.
- [x] Second run through the `deferred()` list only runs if query spec is virtual.
- [x] Fix up handling of concrete specs.
- [x] Add test for querying virtuals in DB.
- [x] Avoid allocating deferred if not necessary.

---------

Co-authored-by: Harmen Stoppels <me@harmenstoppels.nl>
2023-11-07 01:00:37 +00:00
Harmen Stoppels
4ce80b95f3
spack compiler find --[no]-mixed-toolchain (#40902)
Currently there's some hacky logic in the AppleClang compiler that makes
it also accept `gfortran` as a fortran compiler if `flang` is not found.

This is guarded by `if sys.platform` checks s.t. it only applies to
Darwin.

But on Linux the feature of detecting mixed toolchains is highly
requested too, cause it's rather annoying to run into a failed build of
`openblas` after dozens of minutes of compiling its dependencies, just
because clang doesn't have a fortran compiler.

In particular in CI where the system compilers may change during system
updates, it's typically impossible to fix compilers in a hand-written
compilers.yaml config file: the config will almost certainly be outdated
sooner or later, and maintaining one config file per target machine and
writing logic to select the correct config is rather undesirable too.

---

This PR introduces a flag `spack compiler find --mixed-toolchain` that
fills out missing `fc` and `f77` entries in `clang` / `apple-clang` by
picking the best matching `gcc`.

It is enabled by default on macOS, but not on Linux, matching current
behavior of `spack compiler find`.

The "best matching gcc" logic and compiler path updates are identical to
how compiler path dictionaries are currently flattened "horizontally"
(per compiler id). This just adds logic to do the same "vertically"
(across different compiler ids).

So, with this change on Ubuntu 22.04:

```
$ spack compiler find --mixed-toolchain
==> Added 6 new compilers to /home/harmen/.spack/linux/compilers.yaml
    gcc@13.1.0  gcc@12.3.0  gcc@11.4.0  gcc@10.5.0  clang@16.0.0  clang@15.0.7
==> Compilers are defined in the following files:
    /home/harmen/.spack/linux/compilers.yaml

```

you finally get:

```
compilers:
- compiler:
    spec: clang@=15.0.7
    paths:
      cc: /usr/bin/clang
      cxx: /usr/bin/clang++
      f77: /usr/bin/gfortran
      fc: /usr/bin/gfortran
    flags: {}
    operating_system: ubuntu23.04
    target: x86_64
    modules: []
    environment: {}
    extra_rpaths: []
- compiler:
    spec: clang@=16.0.0
    paths:
      cc: /usr/bin/clang-16
      cxx: /usr/bin/clang++-16
      f77: /usr/bin/gfortran
      fc: /usr/bin/gfortran
    flags: {}
    operating_system: ubuntu23.04
    target: x86_64
    modules: []
    environment: {}
    extra_rpaths: []
```

The "best gcc" is automatically default system gcc, since it has no
suffixes / prefixes.
2023-11-06 15:17:31 -08:00
Sinan
8f1f9048ec
package/qgis: add latest ltr (#40752)
* package/qgis: add latest ltr

* fix bug

* [@spackbot] updating style on behalf of Sinan81

* make flake happy

---------

Co-authored-by: sbulut <sbulut@3vgeomatics.com>
Co-authored-by: Sinan81 <Sinan81@users.noreply.github.com>
2023-11-06 15:55:20 -07:00
Harmen Stoppels
e7372a54a1
docs: expand section about relocation, suggest padding (#40909) 2023-11-06 14:49:54 -08:00
Michael Kuhn
5074b7e922
Add support for aliases (#17229)
Add a new config section: `config:aliases`, which is a dictionary mapping aliases
to commands.

For instance:


```yaml
config:
    aliases:
        sp: spec -I
```

will define a new command `sp` that will execute `spec` with the `-I`
argument. 

Aliases cannot override existing commands, and this is ensured with a test.

We cannot currently alias subcommands. Spack will warn about any aliases
containing a space, but will not error, which leaves room for subcommand
aliases in the future.

---------

Co-authored-by: Todd Gamblin <tgamblin@llnl.gov>
2023-11-06 14:37:46 -08:00
Harmen Stoppels
461eb944bd
Don't let runtime env variables of compiler like deps leak into the build environment (#40916)
* Test that setup_run_environment changes to CC/CXX/FC/F77 are dropped in build env

* compilers set in run env shouldn't impact build

Adds `drop` to EnvironmentModifications courtesy of @haampie, and uses
it to clear modifications of CC, CXX, F77 and FC made by
`setup_{,dependent_}run_environment` routines when producing an
environment in BUILD context.

* comment / style

* comment

---------

Co-authored-by: Tom Scogland <scogland1@llnl.gov>
2023-11-06 14:30:27 -08:00
Harmen Stoppels
4700108b5b
fix prefix_inspections keys in example (#40904) 2023-11-06 13:22:13 -08:00
Harmen Stoppels
3384181868
docs: mention public build cache for GHA (#40908) 2023-11-06 13:21:16 -08:00
Vicente Bolea
f0f6e54b29
adios2: add v2.9.2 release (#40832) 2023-11-06 12:15:29 -08:00
Harmen Stoppels
a2f00886e9
defaults/modules.yaml: hide implicits (#40906) 2023-11-06 10:37:29 -08:00