OpenBLAS 0.3.24 -> 0.3.25

cp2k · Dec 19, 2023 · 7123f6c · 7123f6c
1 parent 5e85b02
commit 7123f6c
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Showing 10 changed files with 21 additions and 21 deletions.
diff --git a/arch/Darwin-gnu-arm64.psmp b/arch/Darwin-gnu-arm64.psmp
@@ -4,7 +4,7 @@
 # (https://www.cp2k.org/howto:compile_on_macos)
 #
 # Tested with: GNU 13.2.0, OpenMPI 4.1.5,,
-#              ScaLAPACK 2.2.1, OpenBLAS 0.3.24,
+#              ScaLAPACK 2.2.1, OpenBLAS 0.3.25,
 #              FFTW 3.3.10, HDF5 1.14.2,
 #              LIBINT 2.6.0, LIBXC 6.2.2,
 #              SPGLIB 1.16.2, PLUMED 2.9.0,
@@ -17,7 +17,7 @@
 #        Ensure the links in /usr/local/bin to the lastest gcc version
 #        and "brew unlink openmpi" (or mpich) if installed.
 #
-# Last update: 15.12.2023
+# Last update: 19.12.2023
 #
 # \
    if [[ "${0}" == "${BASH_SOURCE}" ]]; then \

diff --git a/arch/Darwin-gnu-arm64.ssmp b/arch/Darwin-gnu-arm64.ssmp
@@ -4,14 +4,14 @@
 # (https://www.cp2k.org/howto:compile_on_macos)
 #
 # Tested with: GNU 13.2.0, FFTW 3.3.10, LIBINT 2.6.0, LIBVORI 220621,
-#              LIBXC 6.2.2, OpenBLAS 0.3.24, SPGLIB 1.16.2,
+#              LIBXC 6.2.2, OpenBLAS 0.3.25, SPGLIB 1.16.2,
 #              LIBGRPP 20231215
 # on an Apple M1 (macOS Sonoma 14.2)
 #
 # Usage: Source this arch file and then run make as instructed.
 #        Ensure the links in /usr/local/bin to the lastest gcc version.
 #
-# Last update: 15.12.2023
+# Last update: 19.12.2023
 #
 # \
    if [[ "${0}" == "${BASH_SOURCE}" ]]; then \

diff --git a/arch/JURECA-cpu.psmp b/arch/JURECA-cpu.psmp
@@ -3,7 +3,7 @@
 # CP2K arch file for JURECA at FZ Juelich (2 AMD EPYC 7742 CPUs per node)
 #
 # Tested with: GNU 11.3.0, ParaStationMPI, 
-#              ScaLAPACK 2.2.1, OpenBLAS 0.3.24,
+#              ScaLAPACK 2.2.1, OpenBLAS 0.3.25,
 #              FFTW 3.3.10, COSMA 2.6.6,
 #              ELPA 2023.05.001, HDF5 1.14.2,
 #              LIBINT 2.6.0, LIBPEXSI 1.2.0,
@@ -15,7 +15,7 @@
 #        A full toolchain installation is performed as default.
 #        Replace or adapt the "module add" commands below if needed.
 #
-# Last update: 04.10.2023
+# Last update: 19.12.2023
 #
 # \
    if [ "${0}" = "${BASH_SOURCE}" ]; then \
@@ -64,7 +64,7 @@ USE_LIBTORCH   := 1.12.1
 USE_LIBVORI    := 220621
 USE_LIBXC      := 6.2.2
 USE_LIBXSMM    := 1.17
-USE_OPENBLAS   := 0.3.24
+USE_OPENBLAS   := 0.3.25
 USE_PLUMED     := 2.9.0
 USE_QUIP       := 0.9.10
 USE_SCALAPACK  := 2.2.1

diff --git a/arch/JURECA-gpu.psmp b/arch/JURECA-gpu.psmp
@@ -3,7 +3,7 @@
 # CP2K arch file for JURECA at FZ Juelich (2 AMD EPYC 7742 CPUs and 4 A100 GPUs per node)
 #
 # Tested with: GNU 11.3.0, ParaStationMPI, 
-#              ScaLAPACK 2.2.1, OpenBLAS 0.3.24,
+#              ScaLAPACK 2.2.1, OpenBLAS 0.3.25,
 #              FFTW 3.3.10, COSMA 2.6.6,
 #              ELPA 2023.05.001, HDF5 1.14.2,
 #              LIBINT 2.6.0, LIBPEXSI 1.2.0,
@@ -65,7 +65,7 @@ USE_LIBTORCH   := 1.12.1
 USE_LIBVORI    := 220621
 USE_LIBXC      := 6.2.2
 USE_LIBXSMM    := 1.17
-USE_OPENBLAS   := 0.3.24
+USE_OPENBLAS   := 0.3.25
 USE_PLUMED     := 2.9.0
 USE_QUIP       := 0.9.10
 USE_SCALAPACK  := 2.2.1

diff --git a/arch/Linux-gnu-aarch64-static.ssmp b/arch/Linux-gnu-aarch64-static.ssmp
@@ -3,7 +3,7 @@
 # CP2K (GNU aarch64) arch file for a serial static ARM64 binary
 #
 # Tested with: GNU 12.3.0, FFTW 3.3.10, LIBINT 2.6.0, LIBVORI 220621,
-#              LIBXC 6.2.2, OpenBLAS 0.3.24, SPGLIB 1.16.2
+#              LIBXC 6.2.2, OpenBLAS 0.3.25, SPGLIB 1.16.2
 #
 # Usage: Source this arch file and then run make as instructed.
 #
@@ -37,7 +37,7 @@ USE_FFTW       := 3.3.10
 USE_LIBINT     := 2.6.0
 USE_LIBVORI    := 220621
 USE_LIBXC      := 6.2.2
-USE_OPENBLAS   := 0.3.24
+USE_OPENBLAS   := 0.3.25
 USE_SPGLIB     := 1.16.2
 
 LMAX           := 5

diff --git a/arch/Linux-gnu-aarch64.psmp b/arch/Linux-gnu-aarch64.psmp
@@ -3,7 +3,7 @@
 # CP2K (GNU aarch64) arch file for Linux clusters
 #
 # Tested with: GNU 12.3.0, MPICH 4.0.3, 
-#              ScaLAPACK 2.2.1, OpenBLAS 0.3.24,
+#              ScaLAPACK 2.2.1, OpenBLAS 0.3.25,
 #              FFTW 3.3.10, HDF5 1.14.2,
 #              LIBINT 2.6.0, LIBXC 6.2.2,
 #              ELPA 2023.05.001, PLUMED 2.9.0,
@@ -59,7 +59,7 @@ USE_LIBPEXSI   := 1.2.0
 USE_LIBVORI    := 220621
 USE_LIBXC      := 6.2.2
 #USE_LIBXSMM    := 1.17
-USE_OPENBLAS   := 0.3.24
+USE_OPENBLAS   := 0.3.25
 USE_PLUMED     := 2.9.0
 USE_QUIP       := 0.9.10
 USE_SCALAPACK  := 2.2.1

diff --git a/arch/Linux-gnu-x86_64-static.ssmp b/arch/Linux-gnu-x86_64-static.ssmp
@@ -3,7 +3,7 @@
 # CP2K (GNU) arch file for a serial static x86_64 binary
 #
 # Tested with: GNU 13.1.0, FFTW 3.3.10, LIBINT 2.6.0, LIBVORI 220621,
-#              LIBXC 6.2.2, OpenBLAS 0.3.24, SPGLIB 1.16.2
+#              LIBXC 6.2.2, OpenBLAS 0.3.25, SPGLIB 1.16.2
 #
 # Usage: Source this arch file and then run make as instructed.
 #
@@ -37,7 +37,7 @@ USE_FFTW       := 3.3.10
 USE_LIBINT     := 2.6.0
 USE_LIBVORI    := 220621
 USE_LIBXC      := 6.2.2
-USE_OPENBLAS   := 0.3.24
+USE_OPENBLAS   := 0.3.25
 USE_SPGLIB     := 1.16.2
 
 LMAX           := 5

diff --git a/arch/Linux-gnu-x86_64.psmp b/arch/Linux-gnu-x86_64.psmp
@@ -3,7 +3,7 @@
 # CP2K (GNU x86_64) arch file for Linux clusters
 #
 # Tested with: GNU 13.1.0, MPICH 4.0.3 and OpenMPI 4.1.5,
-#              ScaLAPACK 2.2.1, OpenBLAS 0.3.24,
+#              ScaLAPACK 2.2.1, OpenBLAS 0.3.25,
 #              FFTW 3.3.10, ELPA 2023.05.001, HDF5 1.14.2,
 #              LIBINT 2.6.0, LIBXC 6.2.2, PLUMED 2.9.0,
 #              SPGLIB 1.16.2, LIBVORI 220621, GSL 2.7,
@@ -76,7 +76,7 @@ USE_LIBTORCH   := 1.12.1
 USE_LIBVORI    := 220621
 USE_LIBXC      := 6.2.2
 USE_LIBXSMM    := 1.17
-USE_OPENBLAS   := 0.3.24
+USE_OPENBLAS   := 0.3.25
 USE_PLUMED     := 2.9.0
 USE_QUIP       := 0.9.10
 USE_SCALAPACK  := 2.2.1

diff --git a/tools/toolchain/scripts/get_openblas_arch.sh b/tools/toolchain/scripts/get_openblas_arch.sh
@@ -6,8 +6,8 @@
 [ "${BASH_SOURCE[0]}" ] && SCRIPT_NAME="${BASH_SOURCE[0]}" || SCRIPT_NAME=$0
 SCRIPT_DIR="$(cd "$(dirname "$SCRIPT_NAME")" && pwd -P)"
 
-openblas_ver="0.3.24" # Keep in sync with install_openblas.sh
-openblas_sha256="ceadc5065da97bd92404cac7254da66cc6eb192679cf1002098688978d4d5132"
+openblas_ver="0.3.25" # Keep in sync with install_openblas.sh
+openblas_sha256="4c25cb30c4bb23eddca05d7d0a85997b8db6144f5464ba7f8c09ce91e2f35543"
 openblas_pkg="OpenBLAS-${openblas_ver}.tar.gz"
 
 source "${SCRIPT_DIR}"/common_vars.sh

diff --git a/tools/toolchain/scripts/stage2/install_openblas.sh b/tools/toolchain/scripts/stage2/install_openblas.sh
@@ -6,8 +6,8 @@
 [ "${BASH_SOURCE[0]}" ] && SCRIPT_NAME="${BASH_SOURCE[0]}" || SCRIPT_NAME=$0
 SCRIPT_DIR="$(cd "$(dirname "$SCRIPT_NAME")/.." && pwd -P)"
 
-openblas_ver="0.3.24" # Keep in sync with get_openblas_arch.sh
-openblas_sha256="ceadc5065da97bd92404cac7254da66cc6eb192679cf1002098688978d4d5132"
+openblas_ver="0.3.25" # Keep in sync with get_openblas_arch.sh
+openblas_sha256="4c25cb30c4bb23eddca05d7d0a85997b8db6144f5464ba7f8c09ce91e2f35543"
 openblas_pkg="OpenBLAS-${openblas_ver}.tar.gz"
 
 source "${SCRIPT_DIR}"/common_vars.sh