spack/share/spack/gitlab/cloud_pipelines/stacks/e4s-oneapi/spack.yaml
2025-03-12 19:41:43 +01:00

264 lines
8.0 KiB
YAML

spack:
view: false
concretizer:
reuse: false
unify: false
static_analysis: false
packages:
all:
require:
- target=x86_64_v3
- '%oneapi'
providers:
blas: [openblas]
tbb: [intel-tbb]
variants: +mpi
gl:
require: osmesa
elfutils:
variants: ~nls
gcc-runtime:
require: "target=x86_64_v3 %gcc"
hdf5:
variants: +fortran +hl +shared
libfabric:
variants: fabrics=sockets,tcp,udp,rxm
libunwind:
variants: +pic +xz
ncurses:
variants: +termlib
openblas:
variants: threads=openmp
trilinos:
variants: +amesos +amesos2 +anasazi +aztec +belos +boost +epetra +epetraext
+ifpack +ifpack2 +intrepid +intrepid2 +isorropia +kokkos +ml +minitensor +muelu
+nox +piro +phalanx +rol +rythmos +sacado +stk +shards +shylu +stokhos +stratimikos
+teko +tempus +tpetra +trilinoscouplings +zoltan +zoltan2 +superlu-dist gotype=long_long
xz:
variants: +pic
mpi:
require: intel-oneapi-mpi
intel-oneapi-mpi:
buildable: false
externals:
- spec: intel-oneapi-mpi@2021.13.1
prefix: /opt/intel/oneapi
unzip:
require:
- 'target=x86_64_v3 %gcc'
binutils:
require:
- 'target=x86_64_v3 %gcc'
variants: +ld +gold +headers +libiberty ~nls
llvm:
require:
- 'target=x86_64_v3 %gcc'
ruby:
require:
- 'target=x86_64_v3 %gcc'
rust:
require:
- 'target=x86_64_v3 %gcc'
krb5:
require:
- 'target=x86_64_v3 %gcc'
openssh:
require:
- 'target=x86_64_v3 %gcc'
dyninst:
require:
- 'target=x86_64_v3 %gcc'
bison:
require:
- 'target=x86_64_v3 %gcc'
paraview:
require:
- +examples target=x86_64_v3
specs:
# CPU
- adios
- alquimia
- aml
- amrex
- arborx
- argobots
- axom
- bolt
- boost
- bricks ~cuda
- butterflypack
- cabana
- caliper
- chai
- charliecloud
- conduit
- datatransferkit
- dealii ~vtk ~taskflow cflags=-O0 cxxflags=-O0 # +vtk +taskflow: ^taskflow: CMake Error at CMakeLists.txt:81 (message): Taskflow currently supports the following compilers: g++ v7.0 or above, clang++ v6.0 or above; use -O0 to work around compiler failure
- drishti
- dxt-explorer
- ecp-data-vis-sdk ~cuda ~rocm +adios2 ~ascent +cinema +darshan +faodel +hdf5 +paraview +pnetcdf +sz +unifyfs +veloc ~visit +vtkm +zfp # +ascent: fides: fides/xgc/XGCCommon.cxx:233:10: error: no member named 'iota' in namespace 'std'; +visit: visit_vtk/lightweight/vtkSkewLookupTable.C:32:10: error: cannot initialize return object of type 'unsigned char *' with an rvalue of type 'const unsigned char *'
- exaworks
- flecsi
- flit
- flux-core
- fortrilinos
- gasnet
- ginkgo
- globalarrays
- glvis ^llvm
- gmp
- gotcha
- gptune ~mpispawn
- gromacs
- h5bench
- hdf5-vol-async
- hdf5-vol-cache
- hdf5-vol-log
- heffte +fftw
- hpx networking=mpi
- hypre
- kokkos +openmp
- kokkos-kernels +openmp
- laghos
- lammps
- legion
- libceed
- libnrm
- libpressio +bitgrooming +bzip2 ~cuda ~cusz +fpzip +hdf5 +libdistributed +lua +openmp +python +sz +sz3 +unix +zfp
- libquo
- libunwind
- loki
- mercury
- metall
- mfem
- mgard +serial +openmp +timing +unstructured ~cuda
- mpark-variant
- mpifileutils ~xattr
- nccmp
- nco
- netlib-scalapack
- nrm ^py-scipy cflags="-Wno-error=incompatible-function-pointer-types" # py-scipy@1.8.1 fails without cflags here
- nwchem
- omega-h
- openfoam
- openmpi
- openpmd-api
- papi
- papyrus
- parsec ~cuda
- pdt
- petsc
- phist
- plumed
- precice
- pruners-ninja
- pumi
- py-amrex ~ipo # oneAPI 2024.2.0 builds do not support IPO/LTO says CMake, even though pybind11 strongly encourages it
- py-h5py
- py-jupyterhub
- py-libensemble
- py-petsc4py
- qthreads scheduler=distrib
- raja
- rempi
- scr
- slate ~cuda
- slepc
- stc
- strumpack ~slate
- sundials
- superlu
- superlu-dist
- swig@4.0.2-fortran
- sz3
- tasmanian
- tau +mpi +python +syscall
- trilinos +amesos +amesos2 +anasazi +aztec +belos +boost +epetra +epetraext +ifpack +ifpack2 +intrepid +intrepid2 +isorropia +kokkos +ml +minitensor +muelu +nox +piro +phalanx +rol +rythmos +sacado +stk +shards +shylu +stokhos +stratimikos +teko +tempus +tpetra +trilinoscouplings +zoltan +zoltan2 +superlu-dist gotype=long_long
- turbine
- umap
- umpire
- upcxx
- variorum
- wannier90
- wrf
- xyce +mpi +shared +pymi +pymi_static_tpls
# INCLUDED IN ECP DAV CPU
- adios2
- ascent
- darshan-runtime
- darshan-util
- faodel
- hdf5
- libcatalyst
- parallel-netcdf
- paraview
- py-cinemasci
- sz
- unifyfs
- veloc
# - visit # visit: +visit: visit_vtk/lightweight/vtkSkewLookupTable.C:32:10: error: cannot initialize return object of type 'unsigned char *' with an rvalue of type 'const unsigned char *'
- vtk-m ~openmp
- warpx +python ~python_ipo ^py-amrex ~ipo # oneAPI 2024.2.0 builds do not support IPO/LTO says CMake, even though pybind11 strongly encourages it
- zfp
# --
# - chapel ~cuda ~rocm # llvm: closures.c:(.text+0x305e): undefined reference to `_intel_fast_memset'
# - cp2k +mpi # dbcsr: dbcsr_api.F(973): #error: incomplete macro call DBCSR_ABORT.
# - fftx # fftx: https://github.com/spack/spack/issues/47048
# - geopm-runtime # libelf: configure: error: installation or configuration problem: C compiler cannot create executables.
# - hpctoolkit # dyninst@13.0.0%gcc: libiberty/./d-demangle.c:142: undefined reference to `_intel_fast_memcpy'
# - lbann # 2024.2 internal compiler error
# - plasma # 2024.2 internal compiler error
# - quantum-espresso # quantum-espresso: external/mbd/src/mbd_c_api.F90(392): error #6645: The name of the module procedure conflicts with a name in the encompassing scoping unit. [F_C_STRING]
# - wps # wps: InstallError: Compiler not recognized nor supported.
# PYTHON PACKAGES
- opencv +python3
- py-jupyterlab
- py-mpi4py
- py-notebook
- py-numba
- py-numpy
- py-openai
- py-pandas
- py-plotly
- py-pooch
- py-pytest
- py-scikit-learn
- py-scipy
- py-seaborn
# - py-horovod # error
# - py-jax # error
# - py-matplotlib # error
# - py-tensorflow # error
# - py-torch # error
# GPU
- aml +level_zero
- amrex +sycl
- arborx +sycl ^kokkos +sycl +openmp cxxstd=17 +examples
- cabana +sycl ^kokkos +sycl +openmp cxxstd=17 +examples
- ginkgo +sycl
- heffte +sycl
- kokkos +sycl +openmp cxxstd=17 +examples
- kokkos-kernels build_type=Release %oneapi ^kokkos +sycl +openmp cxxstd=17 +examples
- petsc +sycl
- sundials +sycl cxxstd=17 +examples-install
- tau +mpi +opencl +level_zero ~pdt +syscall # requires libdrm.so to be installed
- upcxx +level_zero
- warpx ~qed +python ~python_ipo compute=sycl ^py-amrex ~ipo # qed for https://github.com/ECP-WarpX/picsar/pull/53 prior to 24.09 release; ~ipo for oneAPI 2024.2.0 GPU builds do not support IPO/LTO says CMake, even though pybind11 strongly encourages it
# --
# - hpctoolkit +level_zero # dyninst@12.3.0%gcc: /usr/bin/ld: libiberty/./d-demangle.c:142: undefined reference to `_intel_fast_memcpy'; can't mix intel-tbb@%oneapi with dyninst%gcc
# - slate +sycl # slate: ifx: error #10426: option '-fopenmp-targets' requires '-fiopenmp'
ci:
pipeline-gen:
- build-job:
image: ghcr.io/spack/spack/ubuntu22.04-runner-amd64-oneapi-2024.2:2024.09.06
cdash:
build-group: E4S OneAPI