StartDate: 2025-07-09 09:09:21+00:00 CpuId: 32x AMD EPYC (3rd Gen) (Milan) [Zen 3], 7nm (SMT disabled) CommitSHA: d657d38fd243fb5abd309c576c424ff5d12b25b5 CommitTime: 2025-07-08 22:42:49 +0200 CommitAuthor: Matthias Krack CommitSubject: Use wget instead of curl #################### Building Image cp2k-hip-rocm-build #################### Dockerfile: /tools/docker/Dockerfile.build_hip_rocm_Mi100 Build-Path: / Build-Args: GIT_COMMIT_SHA=d657d38fd243fb5abd309c576c424ff5d12b25b5 SPACK_CACHE=gs://cp2k-spack-cache Build-Cache: Yes Populating docker build cache... done. DEPRECATED: The legacy builder is deprecated and will be removed in a future release. BuildKit is currently disabled; enable it by removing the DOCKER_BUILDKIT=0 environment-variable. Sending build context to Docker daemon 405.6MB Step 1/49 : FROM rocm/dev-ubuntu-22.04:5.3.2-complete 5.3.2-complete: Pulling from rocm/dev-ubuntu-22.04 e96e057aae67: Already exists 5aaf392dce58: Already exists 1f126d0f78e5: Already exists 9acbe3e75c55: Already exists Digest: sha256:a7b6fb55d3b7344788af9e0f69fc15cf8b66112bf2984441edfad3948b895d44 Status: Downloaded newer image for rocm/dev-ubuntu-22.04:5.3.2-complete ---> 3cc7535ba714 Step 2/49 : RUN apt-get update -qq && apt-get install -qq --no-install-recommends hipblas gfortran mpich libmpich-dev && rm -rf /var/lib/apt/lists/* ---> Using cache ---> 7c305b66bbab Step 3/49 : ENV ROCM_PATH /opt/rocm ---> Using cache ---> 00f60746864d Step 4/49 : ENV PATH ${PATH}:${ROCM_PATH}/bin ---> Using cache ---> c7691a4625c0 Step 5/49 : ENV LD_LIBRARY_PATH ${LD_LIBRARY_PATH}:${ROCM_PATH}/lib ---> Using cache ---> 71797c5053fd Step 6/49 : ENV HIP_PLATFORM amd ---> Using cache ---> 4d13be977e04 Step 7/49 : RUN hipconfig ---> Using cache ---> 48dfa2dd9ea5 Step 8/49 : WORKDIR /opt/cp2k-toolchain ---> Using cache ---> 022e1aef521d Step 9/49 : COPY ./tools/toolchain/install_requirements*.sh ./ ---> Using cache ---> 25ebf1b48855 Step 10/49 : RUN ./install_requirements.sh ubuntu ---> Using cache ---> 2869d409717b Step 11/49 : RUN mkdir scripts ---> Using cache ---> 817d8dbddef5 Step 12/49 : COPY ./tools/toolchain/scripts/VERSION ./tools/toolchain/scripts/parse_if.py ./tools/toolchain/scripts/tool_kit.sh ./tools/toolchain/scripts/common_vars.sh ./tools/toolchain/scripts/signal_trap.sh ./tools/toolchain/scripts/get_openblas_arch.sh ./scripts/ ---> Using cache ---> 0fc39aa63e99 Step 13/49 : COPY ./tools/toolchain/install_cp2k_toolchain.sh . ---> Using cache ---> e53bcba1b4fb Step 14/49 : RUN ./install_cp2k_toolchain.sh --mpi-mode=mpich --enable-hip=yes --gpu-ver=Mi100 --with-dbcsr=no --dry-run ---> Using cache ---> fe1b9f5dbe8d Step 15/49 : COPY ./tools/toolchain/scripts/stage0/ ./scripts/stage0/ ---> Using cache ---> 0d779178356a Step 16/49 : RUN ./scripts/stage0/install_stage0.sh && rm -rf ./build ---> Using cache ---> e84059fce0c3 Step 17/49 : COPY ./tools/toolchain/scripts/stage1/ ./scripts/stage1/ ---> Using cache ---> 278e2a9e1c9c Step 18/49 : RUN ./scripts/stage1/install_stage1.sh && rm -rf ./build ---> Using cache ---> 1e54e62a4a72 Step 19/49 : COPY ./tools/toolchain/scripts/stage2/ ./scripts/stage2/ ---> Using cache ---> 4fd1082810aa Step 20/49 : RUN ./scripts/stage2/install_stage2.sh && rm -rf ./build ---> Using cache ---> 15badb2a550d Step 21/49 : COPY ./tools/toolchain/scripts/stage3/ ./scripts/stage3/ ---> Using cache ---> 0e8f217e5955 Step 22/49 : RUN ./scripts/stage3/install_stage3.sh && rm -rf ./build ---> Using cache ---> 50f4f92c4125 Step 23/49 : COPY ./tools/toolchain/scripts/stage4/ ./scripts/stage4/ ---> Using cache ---> 4a2b58807bcf Step 24/49 : RUN ./scripts/stage4/install_stage4.sh && rm -rf ./build ---> Using cache ---> bbb4c53cabde Step 25/49 : COPY ./tools/toolchain/scripts/stage5/ ./scripts/stage5/ ---> Using cache ---> 914303833a75 Step 26/49 : RUN ./scripts/stage5/install_stage5.sh && rm -rf ./build ---> Using cache ---> 43112f238e47 Step 27/49 : COPY ./tools/toolchain/scripts/stage6/ ./scripts/stage6/ ---> Using cache ---> 47c5cb04839d Step 28/49 : RUN ./scripts/stage6/install_stage6.sh && rm -rf ./build ---> Using cache ---> 31ccf4e6d7c9 Step 29/49 : COPY ./tools/toolchain/scripts/stage7/ ./scripts/stage7/ ---> Using cache ---> e75efffc818d Step 30/49 : RUN ./scripts/stage7/install_stage7.sh && rm -rf ./build ---> Using cache ---> 9c693a4095f7 Step 31/49 : COPY ./tools/toolchain/scripts/stage8/ ./scripts/stage8/ ---> Using cache ---> 6d217bc691a1 Step 32/49 : RUN ./scripts/stage8/install_stage8.sh && rm -rf ./build ---> Using cache ---> 2bb68cb87bb6 Step 33/49 : COPY ./tools/toolchain/scripts/stage9/ ./scripts/stage9/ ---> Using cache ---> 732d150b70f1 Step 34/49 : RUN ./scripts/stage9/install_stage9.sh && rm -rf ./build ---> Using cache ---> 3582245d0fc3 Step 35/49 : COPY ./tools/toolchain/scripts/arch_base.tmpl ./tools/toolchain/scripts/generate_arch_files.sh ./scripts/ ---> Using cache ---> 4ad5c376bf90 Step 36/49 : RUN ./scripts/generate_arch_files.sh && rm -rf ./build ---> Using cache ---> b9735c470d06 Step 37/49 : WORKDIR /opt/cp2k ---> Using cache ---> 0f5265fc23e7 Step 38/49 : COPY ./Makefile . ---> Using cache ---> 466c1e76c1fb Step 39/49 : COPY ./src ./src ---> 53d0ba6575bc Step 40/49 : COPY ./exts ./exts ---> 2db5a0d80f13 Step 41/49 : COPY ./tools/build_utils ./tools/build_utils ---> e7c3c668a2c4 Step 42/49 : RUN /bin/bash -c " mkdir -p arch && ln -vs /opt/cp2k-toolchain/install/arch/local_hip.psmp ./arch/" ---> Running in 1a07826f0361 './arch/local_hip.psmp' -> '/opt/cp2k-toolchain/install/arch/local_hip.psmp' Removing intermediate container 1a07826f0361 ---> 379b89ece42c Step 43/49 : COPY ./data ./data ---> 88ee2b93ea41 Step 44/49 : COPY ./tests ./tests ---> c3252ce4c3d2 Step 45/49 : COPY ./tools/regtesting ./tools/regtesting ---> 64b5a0a754a1 Step 46/49 : COPY ./tools/docker/scripts/test_build.sh . ---> 9f671255be70 Step 47/49 : RUN ./test_build.sh "local_hip" "psmp" 2>&1 | tee report.log ---> Running in 179669fcdb70 Compiling cp2k... failed. WARNING: /opt/cp2k/tools/build_utils/get_revision_number failed to determine the Git commit and no REVISION file available Discovering programs ... WARNING: /opt/cp2k/tools/build_utils/get_revision_number failed to determine the Git commit and no REVISION file available WARNING: /opt/cp2k/tools/build_utils/get_revision_number failed to determine the Git commit and no REVISION file available make -C /opt/cp2k/exts/dbcsr -f /opt/cp2k/exts/build_dbcsr/Makefile \ ARCHFILE=/opt/cp2k/arch/local_hip.psmp \ LIBDIR=/opt/cp2k/lib/local_hip/psmp/exts/dbcsr \ OBJDIR=/opt/cp2k/obj/local_hip/psmp/exts/dbcsr \ USE_ACCEL="hip" \ ACC="/usr/bin/mpicxx" \ ACCFLAGS="-O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter" Removing stale archives for psmp ... Resolving dependencies for psmp ... Removing stale archives ... Resolving dependencies ... /usr/bin/env python3 /opt/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n --line-marker-format=gfortran5 /opt/cp2k/exts/dbcsr/src/base/dbcsr_kinds.F dbcsr_kinds.F90 /usr/bin/env python3 /opt/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n --line-marker-format=gfortran5 /opt/cp2k/exts/dbcsr/src/utils/dbcsr_btree.F dbcsr_btree.F90 /usr/bin/env python3 /opt/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n --line-marker-format=gfortran5 /opt/cp2k/exts/dbcsr/src/acc/hip/dbcsr_hip_profiling.F dbcsr_hip_profiling.F90 /usr/bin/env python3 /opt/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n --line-marker-format=gfortran5 /opt/cp2k/exts/dbcsr/src/mm/dbcsr_mm_types.F dbcsr_mm_types.F90 cd /opt/cp2k/exts/dbcsr/src/acc/libsmm_acc; /usr/bin/env python3 generate_parameters.py --gpu_version=Mi100 cd /opt/cp2k/exts/dbcsr/src/acc/libsmm_acc; /usr/bin/env python3 generate_kernels.py /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/hip/acc_hip.cpp /opt/rocm/hip/bin/hipcc -D__HIP -c -fPIE -D__HIP_PLATFORM_AMD__ -g --offload-arch=gfx908 -O3 --std=c++11 -Wall -Wextra -Werror -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -I/opt/rocm/include -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/calculate_norms.cpp /usr/bin/mpicc -c -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -std=c17 -Wall -Wextra -Werror -Wno-vla-parameter -Wno-deprecated-declarations -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -I/opt/rocm/include /opt/cp2k/exts/dbcsr/src/acc/opencl/acc_opencl_event.c /usr/bin/mpicc -c -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -std=c17 -Wall -Wextra -Werror -Wno-vla-parameter -Wno-deprecated-declarations -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -I/opt/rocm/include /opt/cp2k/exts/dbcsr/src/acc/opencl/acc_opencl_mem.c /usr/bin/mpicc -c -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -std=c17 -Wall -Wextra -Werror -Wno-vla-parameter -Wno-deprecated-declarations -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -I/opt/rocm/include /opt/cp2k/exts/dbcsr/src/acc/opencl/acc_opencl.c /usr/bin/mpicc -c -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -std=c17 -Wall -Wextra -Werror -Wno-vla-parameter -Wno-deprecated-declarations -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -I/opt/rocm/include /opt/cp2k/exts/dbcsr/src/acc/opencl/acc_opencl_stream.c /usr/bin/mpicc -c -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -std=c17 -Wall -Wextra -Werror -Wno-vla-parameter -Wno-deprecated-declarations -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -I/opt/rocm/include /opt/cp2k/exts/dbcsr/src/acc/opencl/smm/opencl_libsmm.c Found 7 kernel files: <- kernels/smm_acc_dnt_tiny.h <- kernels/smm_acc_common.h <- kernels/smm_acc_dnt_largeDB2.h <- kernels/smm_acc_dnt_largeDB1.h <- kernels/smm_acc_dnt_small.h <- kernels/smm_acc_transpose.h <- kernels/smm_acc_dnt_medium.h Re-write kernels as strings... Wrote kernel string to file -> smm_acc_kernels.h /usr/bin/mpifort -c -D__HIP -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -fbacktrace -ffree-form -fimplicit-none -std=f2008 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=unused-parameter -Werror=unused-label -Werror=conversion -Werror=zerotrip -Wno-maybe-uninitialized -Wuninitialized -Wuse-without-only -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -fallow-argument-mismatch -D__SHORT_FILE__="\"dbcsr_kinds.F\"" -I'/opt/cp2k/exts/dbcsr/src/base/' -I'/opt/cp2k/exts/dbcsr/src' dbcsr_kinds.F90 /usr/bin/mpifort -c -D__HIP -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -fbacktrace -ffree-form -fimplicit-none -std=f2008 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=unused-parameter -Werror=unused-label -Werror=conversion -Werror=zerotrip -Wno-maybe-uninitialized -Wuninitialized -Wuse-without-only -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -fallow-argument-mismatch -D__SHORT_FILE__="\"dbcsr_hip_profiling.F\"" -I'/opt/cp2k/exts/dbcsr/src/acc/hip/' -I'/opt/cp2k/exts/dbcsr/src' dbcsr_hip_profiling.F90 /usr/bin/mpifort -c -D__HIP -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -fbacktrace -ffree-form -fimplicit-none -std=f2008 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=unused-parameter -Werror=unused-label -Werror=conversion -Werror=zerotrip -Wno-maybe-uninitialized -Wuninitialized -Wuse-without-only -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -fallow-argument-mismatch -D__SHORT_FILE__="\"dbcsr_mm_types.F\"" -I'/opt/cp2k/exts/dbcsr/src/mm/' -I'/opt/cp2k/exts/dbcsr/src' dbcsr_mm_types.F90 GPU version: Mi100 About to process 421 kernels from file parameters/parameters_Mi100.json GPU warp size: 64 Get parameters and write to file Found 421 kernels in file parameters/parameters_Mi100.json Printing them to file parameters.h /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda/dbcsr_cuda_nvtx_cu.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/libsmm_acc/libsmm_acc.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/libsmm_acc/libsmm_acc_init.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/libsmm_acc/libsmm_acc_benchmark.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_error.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_blas.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_utils.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_init.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_event.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_dev.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_stream.cpp /usr/bin/mpicxx -c -D__HIP -DARCH_NUMBER=gfx908 -std=c++14 -O2 -fPIC -fno-omit-frame-pointer -fopenmp -g -mtune=native -std=c++17 -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -Wno-deprecated-declarations -fopenmp -Wall -Wextra -Werror -I/opt/rocm/include -Wno-error=unused-parameter -I'/opt/cp2k/exts/dbcsr/src' /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_mem.cpp /usr/bin/mpifort -c -D__HIP -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -fbacktrace -ffree-form -fimplicit-none -std=f2008 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=unused-parameter -Werror=unused-label -Werror=conversion -Werror=zerotrip -Wno-maybe-uninitialized -Wuninitialized -Wuse-without-only -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -fallow-argument-mismatch -D__SHORT_FILE__="\"dbcsr_btree.F\"" -I'/opt/cp2k/exts/dbcsr/src/utils/' -I'/opt/cp2k/exts/dbcsr/src' dbcsr_btree.F90 /usr/bin/env python3 /opt/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n --line-marker-format=gfortran5 /opt/cp2k/exts/dbcsr/src/base/dbcsr_machine_internal.F dbcsr_machine_internal.F90 /usr/bin/env python3 /opt/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n --line-marker-format=gfortran5 /opt/cp2k/exts/dbcsr/src/utils/dbcsr_string_utilities.F dbcsr_string_utilities.F90 /usr/bin/env python3 /opt/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n --line-marker-format=gfortran5 /opt/cp2k/exts/dbcsr/src/utils/dbcsr_array_sort.F dbcsr_array_sort.F90 /usr/bin/env python3 /opt/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n --line-marker-format=gfortran5 /opt/cp2k/exts/dbcsr/src/core/dbcsr_timings_base_type.F dbcsr_timings_base_type.F90 /usr/bin/mpifort -c -D__HIP -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -fbacktrace -ffree-form -fimplicit-none -std=f2008 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=unused-parameter -Werror=unused-label -Werror=conversion -Werror=zerotrip -Wno-maybe-uninitialized -Wuninitialized -Wuse-without-only -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -fallow-argument-mismatch -D__SHORT_FILE__="\"dbcsr_machine_internal.F\"" -I'/opt/cp2k/exts/dbcsr/src/base/' -I'/opt/cp2k/exts/dbcsr/src' dbcsr_machine_internal.F90 /usr/bin/mpifort -c -D__HIP -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -fbacktrace -ffree-form -fimplicit-none -std=f2008 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=unused-parameter -Werror=unused-label -Werror=conversion -Werror=zerotrip -Wno-maybe-uninitialized -Wuninitialized -Wuse-without-only -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -fallow-argument-mismatch -D__SHORT_FILE__="\"dbcsr_string_utilities.F\"" -I'/opt/cp2k/exts/dbcsr/src/utils/' -I'/opt/cp2k/exts/dbcsr/src' dbcsr_string_utilities.F90 /usr/bin/mpifort -c -D__HIP -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -fbacktrace -ffree-form -fimplicit-none -std=f2008 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=unused-parameter -Werror=unused-label -Werror=conversion -Werror=zerotrip -Wno-maybe-uninitialized -Wuninitialized -Wuse-without-only -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -fallow-argument-mismatch -D__SHORT_FILE__="\"dbcsr_timings_base_type.F\"" -I'/opt/cp2k/exts/dbcsr/src/core/' -I'/opt/cp2k/exts/dbcsr/src' dbcsr_timings_base_type.F90 /usr/bin/mpifort -c -D__HIP -fno-omit-frame-pointer -fopenmp -g -march=native -mtune=native -O3 -funroll-loops -I'/opt/cp2k-toolchain/install/openblas-0.3.29/include' -I'/opt/cp2k-toolchain/install/fftw-3.3.10/include' -I'/opt/cp2k-toolchain/install/libint-v2.6.0-cp2k-lmax-5/include' -I'/opt/cp2k-toolchain/install/libxc-7.0.0/include' -I'/opt/cp2k-toolchain/install/libxsmm-e0c4a2389afba36c453233ad7de07bd92c715bec/include' -I'/opt/cp2k-toolchain/install/COSMA-2.7.0/include' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/modules' -I'/opt/cp2k-toolchain/install/elpa-2024.05.001/cpu/include/elpa_openmp-2024.05.001/elpa' -I'/opt/cp2k-toolchain/install/gsl-2.8/include' -I/opt/cp2k-toolchain/install/hdf5-1.14.5/include -I/opt/cp2k-toolchain/install/libvdwxc-0.4.0/include -I/opt/cp2k-toolchain/install/spglib-2.5.0/include -I'/opt/cp2k-toolchain/install/pugixml-1.14/include' -I'/opt/cp2k-toolchain/install/SpFFT-1.1.0/include' -I'/opt/cp2k-toolchain/install/SpLA-1.6.1/include/spla' -I/opt/cp2k-toolchain/install/sirius-7.7.0/include/sirius -fbacktrace -ffree-form -fimplicit-none -std=f2008 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=unused-parameter -Werror=unused-label -Werror=conversion -Werror=zerotrip -Wno-maybe-uninitialized -Wuninitialized -Wuse-without-only -D__LIBXSMM -D__parallel -D__FFTW3 -D__LIBINT -D__LIBXC -D__LIBGRPP -D__parallel -D__COSMA -D__ELPA -D__GSL -D__HDF5 -D__LIBVDWXC -D__SPGLIB -D__LIBVORI -D__SPFFT -D__OFFLOAD_GEMM -D__SPLA -D__SIRIUS -D__HIP_PLATFORM_AMD__ -D__OFFLOAD_HIP -D__DBCSR_ACC -fallow-argument-mismatch -D__SHORT_FILE__="\"dbcsr_array_sort.F\"" -I'/opt/cp2k/exts/dbcsr/src/utils/' -I'/opt/cp2k/exts/dbcsr/src' dbcsr_array_sort.F90 /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_error.cpp: In function 'void c_dbcsr_acc_clear_errors()': /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_error.cpp:30:63: error: ignoring returned value of type 'hipError_t', declared with attribute 'nodiscard' [-Werror=unused-result] 30 | extern "C" void c_dbcsr_acc_clear_errors() { ACC(GetLastError)(); } In file included from /opt/rocm/include/hip/hip_runtime.h:113, from /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/../hip/acc_hip.h:13, from /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_error.cpp:13: /opt/rocm/include/hip/hip_runtime_api.h:1833:12: note: in call to 'hipError_t hipGetLastError()', declared here 1833 | hipError_t hipGetLastError(void); | ^~~~~~~~~~~~~~~ In file included from /opt/rocm/include/hip/hip_runtime.h:113, from /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/../hip/acc_hip.h:13, from /opt/cp2k/exts/dbcsr/src/acc/cuda_hip/acc_error.cpp:13: /opt/rocm/include/hip/hip_runtime_api.h:320:3: note: 'hipError_t' declared here 320 | } hipError_t; | ^~~~~~~~~~ cc1plus: all warnings being treated as errors make[4]: *** [/opt/cp2k/exts/build_dbcsr//Makefile:274: acc_error.o] Error 1 make[4]: *** Waiting for unfinished jobs.... make[3]: *** [/opt/cp2k/exts/build_dbcsr/Makefile:184: libdbcsr] Error 2 make[2]: *** [/opt/cp2k/exts/Makefile.inc:38: dbcsr] Error 2 make[1]: *** [/opt/cp2k/Makefile:130: psmp] Error 2 make: *** [Makefile:125: all] Error 2 Summary: Compilation failed. Status: FAILED Removing intermediate container 179669fcdb70 ---> 872899e7b92f Step 48/49 : CMD cat $(find ./report.log -mmin +10) | sed '/^Summary:/ s/$/ (cached)/' ---> Running in b37ead47892f Removing intermediate container b37ead47892f ---> 1f9eee50fc53 Step 49/49 : ENTRYPOINT [] ---> Running in 285cd9ed34e5 Removing intermediate container 285cd9ed34e5 ---> c57f65fce20a [Warning] One or more build-args [SPACK_CACHE GIT_COMMIT_SHA] were not consumed Successfully built c57f65fce20a Successfully tagged us-central1-docker.pkg.dev/cp2k-org-project/cp2kci/img_cp2k-hip-rocm-build:master Pushing new image... done. #################### Running Image cp2k-hip-rocm-build #################### Uploading artifacts... done EndDate: 2025-07-09 09:12:11+00:00