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https://code.it4i.cz/sccs/easyconfigs-it4i.git
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177 Commits
| Author | SHA1 | Message | Date | |
|---|---|---|---|---|
easybuild
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52ca29cb49 | fix | ||
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easybuild
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3615ccafe1 | fix | ||
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Lukas Krupcik
|
74a3ff0b80 |
new file: g/GObject-Introspection/GObject-Introspection-1.74.0-GCCcore-12.2.0-Python-3.10.8.eb
modified: g/GPAW/GPAW-23.9.1-intel-2022a.eb new file: g/glibc/glibc-2.29-GCCcore-12.2.0.eb modified: m/MRCC/MRCC-2023-08-intel-2021b.eb new file: m/MRCC/mrcc.2023-08-28.tar.gz new file: m/Meson/Meson-0.64.1-GCCcore-12.2.0-Python-3.10.8.eb new file: n/NSS/NSS-3.57-GCCcore-10.2.0.eb new file: o/OpenJPEG/OpenJPEG-2.5.0-GCCcore-12.2.0.eb modified: o/OpenMPI/OpenMPI-4.1.6-NVHPC-23.5-CUDA-12.2.0.eb new file: p/pkgconfig/pkgconfig-1.5.5-GCCcore-12.2.0-Python-3.10.8.eb new file: p/pkgconfig/pkgconfig-1.8.0-GCCcore-10.2.0-Python-3.8.6.eb new file: p/pkgconfig/pkgconfig-1.9.3-GCCcore-12.2.0-Python-3.10.8.eb new file: p/poppler/poppler-0.90.1-GCCcore-10.2.0.eb new file: p/poppler/poppler-0.90.1-GCCcore-12.2.0.eb modified: p/poppler/poppler-21.06.1-GCC-10.2.0.eb modified: q/Qt5/Qt5-5.14.2-GCCcore-10.2.0.eb new file: t/texinfo/texinfo-6.7-GCCcore-10.2.0.eb new file: t/texlive/texlive-20210325-GCCcore-10.2.0-test.eb new file: t/texlive/texlive-20210325-GCCcore-10.2.0-v2.eb modified: t/texlive/texlive-20210325-GCCcore-10.2.0.eb new file: t/texlive/texlive-20210325-GCCcore-12.2.0.eb |
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Lukas Krupcik
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8a30a3c673 |
new file: a/Autoconf/Autoconf-2.69-foss-2022b.eb
new file: a/Autoconf/Autoconf-2.71-foss-2022b.eb new file: a/Automake/Automake-1.15.eb new file: a/Automake/Automake-1.16.eb new file: a/Autotools/Autotools-20180311-foss-2022b.eb new file: b/Boost/Boost-1.77.0-foss-2022b.eb new file: c/CMake/CMake-3.20.1-foss-2022b.eb new file: c/cURL/cURL-7.76.0-foss-2022b.eb new file: f/Firefox/Firefox-127.0.1.eb modified: f/Firefox/Firefox-44.0.2.eb new file: g/GCC/GCC-13.2.0-foss-2022b.eb new file: g/GCCcore/GCCcore-13.2.0-foss-2022b.eb modified: g/GMP/GMP-6.1.2.eb new file: h/HDF5/HDF5-1.14.0-iimpi-2023a.eb new file: j/JupyterLab/JupyterLab-4.2.0-GCCcore-13.2.0.eb new file: j/jupyter-server/jupyter-server-2.14.0-GCCcore-13.2.0.eb modified: l/libffi/libffi-3.2.1.eb modified: l/libreadline/libreadline-8.0.eb new file: l/libxc/libxc-6.2.2-NVHPC-24.3-CUDA-12.3.0.eb new file: n/ncurses/ncurses-6.2-foss-2022b.eb new file: o/OpenVDB/OpenVDB-11.0.0-foss-2022b-Python-3.10.8.eb new file: o/OpenVDB/OpenVDB-11.0.0-foss-2022b-Python-3.9.9.eb new file: o/OpenVDB/OpenVDB-11.0.0-foss-2022b.eb new file: p/Python/Python-3.11.5-foss-2022b.eb new file: p/Python/Python-3.9.9.eb modified: s/SQLite/SQLite-3.27.2.eb modified: t/Tcl/Tcl-8.6.9.eb new file: t/TurboVNC/TurboVNC-3.1.1-GCCcore-13.2.0.eb new file: z/zlib/zlib-1.2.10-foss-2022b.eb new file: z/zlib/zlib-1.2.11-foss-2022b.eb |
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Lukas Krupcik
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914c775b08 |
new file: b/Boost.Python-NumPy/Boost.Python-NumPy-1.83.0-gfbf-2023b.eb
modified: b/Boost/Boost-1.77.0-gompi-2021a.eb modified: c/CMake/CMake-3.16.2.eb new file: e/ELPA/ELPA-2019.11.001-intel-2021a.eb modified: e/ELPA/ELPA-2023.11.001-intel-2023b.eb modified: h/HDF5/HDF5-1.10.6-intel-2020a.eb modified: i/IOTK/IOTK-1.2.2-intel-2020a.eb modified: j/Java/Java-1.8.0_221.eb modified: n/NVHPC/NVHPC-21.9.eb modified: n/netCDF-Fortran/netCDF-Fortran-4.5.2-intel-2020a.eb modified: n/netCDF/netCDF-4.7.3-intel-2020a.eb new file: p/PETSc/PETSc-3.21.2-foss-2022b.eb new file: p/petsc4py/petsc4py-3.21.2-foss-2022b.eb modified: q/QMCPACK/QMCPACK-3.14.0-foss-2021a-Python-3.9.5.eb new file: q/QuantumESPRESSO/QuantumESPRESSO-6.7-intel-2020a-MaX.eb new file: q/QuantumESPRESSO/QuantumESPRESSO-7.2-intel-2021a.eb new file: q/QuantumESPRESSO/QuantumESPRESSO-7.3-intel-2021a.eb new file: q/QuantumESPRESSO/QuantumESPRESSO-7.3.1-intel-2023b-gpu.eb new file: s/SLEPc/SLEPc-3.21.1-foss-2022b.eb new file: s/slepc4py/slepc4py-3.21.1-foss-2022b.eb new file: s/sqsgenerator/sqsgenerator-0.3-conda.eb modified: s/sqsgenerator/sqsgenerator-0.3-foss-2023b-Python-3.11.5.eb new file: y/Yambo/Yambo-5.2.3-intel-2020a.eb |
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Lukas Krupcik
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ec79b73c4a |
new file: c/Critic2/Critic2-1.1stable-intel-2020b.eb
modified: h/HDF5/HDF5-1.10.6-intel-2020b-parallel.eb new file: l/libcint/libcint-5.5.0-gfbf-2023b.eb new file: l/libxc/libxc-4.3.4-foss-2023b.eb modified: l/libxc/libxc-4.3.4-intel-2020b.eb modified: n/netCDF-Fortran/netCDF-Fortran-4.5.3-intel-2020b.eb modified: n/netCDF/netCDF-4.7.4-intel-2020b.eb modified: o/Octopus/Octopus-11.3-intel-2020b-mpi.eb new file: o/OpenMPI/OpenMPI-4.1.6-GCC-12.2.0-CUDA-12.4.0.eb |
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Lukas Krupcik
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ba185e3268 |
modified: a/Autoconf/Autoconf-2.69.eb
new file: a/apptainer/apptainer-1.2.5.eb new file: a/apptainer/apptainer-1.3.0.eb modified: a/apptainer/apptainer-1.3.1.eb modified: d/Dakota/Dakota-6.15.0-foss-2021b.eb modified: d/Dakota/Dakota-6.15.0-intel-2021b.eb new file: g/GSL/GSL-2.7-intel-compilers-2023.2.1.eb modified: h/HDF5/HDF5-1.12.1-foss-2021b-parallel.eb new file: h/htop/htop-3.3.0.eb new file: l/libxc/libxc-6.2.2-intel-compilers-2023.2.1.eb new file: n/netCDF-Fortran/netCDF-Fortran-4.6.1-iimpi-2023b.eb new file: n/netCDF/netCDF-4.9.2-iimpi-2023b.eb new file: o/Octopus/Octopus-14.1-intel-2023b-mpi.eb new file: s/squashfs-tools/squashfs-tools-4.6.1.eb new file: u/uncertainties/uncertainties-3.1.7-foss-2023b.eb |
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Lukas Krupcik
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2f1e8aefc7 |
new file: a/AMD-uProf/AMD-uProf-4.2.850.eb
new file: a/AOCC/AOCC-4.2.0-GCCcore-12.2.0.eb new file: a/AOCL/AOCL-4.2.0-CCcore-12.2.0.eb new file: a/ASE/ASE-3.22.1-gfbf-2023b.eb new file: a/apptainer/apptainer-1.3.1.eb modified: b/BEEF/BEEF-0.1.1-intel-2020a.eb modified: d/DFT-D4/DFT-D4-3.6.0-intel-2022b-Python-3.10.8.eb new file: d/DFT-D4/DFT-D4-3.6.0-intel-2023b-Python-3.11.5.eb new file: e/ELPA/ELPA-2023.11.001-intel-2023b.eb new file: f/FFTW.MPI/FFTW.MPI-3.3.10-NVHPC-24.1-CUDA-12.4.0.eb new file: f/FFTW.MPI/FFTW.MPI-3.3.10-NVHPC-24.3-CUDA-12.3.0.eb new file: f/FFTW/FFTW-3.3.10-NVHPC-24.1-CUDA-12.4.0.eb new file: f/FFTW/FFTW-3.3.10-NVHPC-24.3-CUDA-12.3.0.eb modified: f/FFTW/FFTW-3.3.8.eb new file: f/Forge/Forge-23.1.2.eb new file: f/ffnvcodec/ffnvcodec-11.1.5.2.eb new file: f/ffnvcodec/ffnvcodec-12.0.16.0.eb new file: g/GDRCopy/GDRCopy-2.4.1-GCCcore-12.2.0.eb modified: g/GROMACS/GROMACS-2024-foss-2022a-CUDA-12.0.0-v2.eb modified: g/GROMACS/GROMACS-4.5.5-ORCA-5.0.1-OpenMPI-4.1.1.eb modified: g/gettext/gettext-0.19.4.eb new file: h/HDF5/HDF5-1.14.0-iimpi-2022b.eb new file: h/HDF5/HDF5-1.14.3-NVHPC-24.1-CUDA-12.4.0.eb new file: h/HDF5/HDF5-1.14.3-NVHPC-24.3-CUDA-12.3.0.eb new file: h/HDF5/HDF5-1.14.3-iimpi-2023b.eb new file: i/impi/impi-2021.8.0-intel-compilers-2023.0.0.eb new file: l/libxc/libxc-5.2.3-GCC-11.3.0.eb new file: m/METIS/METIS-5.1.0-GCCcore-13.2.0.eb new file: n/NCCL/NCCL-2.21.5-GCCcore-12.2.0-CUDA-12.3.0.eb new file: n/NCCL/NCCL-2.21.5-GCCcore-12.2.0-CUDA-12.4.0.eb new file: n/NVHPC/NVHPC-24.1-CUDA-12.3.0.eb new file: n/NVHPC/NVHPC-24.1-CUDA-12.4.0.eb new file: n/NVHPC/NVHPC-24.3-CUDA-12.3.0.eb modified: n/ncurses/ncurses-6.1.eb new file: n/nvompi/nvompi-2024.1.eb new file: n/nvompi/nvompi-2024.3.eb modified: o/OpenMPI/OpenMPI-4.1.6-NVHPC-23.11-CUDA-12.2.0.eb new file: o/OpenMPI/OpenMPI-4.1.6-NVHPC-24.1-CUDA-12.4.0.eb new file: o/OpenMPI/OpenMPI-4.1.6-NVHPC-24.3-CUDA-12.3.0.eb deleted: o/OpenSSL/OpenSSL-1.0.2n.eb deleted: o/OpenSSL/OpenSSL-1.1-test.eb deleted: o/OpenSSL/OpenSSL-1.1.eb new file: p/Python/Python-3.11.5-GCCcore-13.2.0-TB2J.eb new file: p/Python/Python-3.11.5-GCCcore-13.2.0.eb new file: q/QD/QD-2.3.17-NVHPC-24.1-CUDA-12.4.0.eb new file: q/QD/QD-2.3.17-NVHPC-24.3-CUDA-12.3.0.eb new file: s/ScaLAPACK/ScaLAPACK-3.0-NVHPC-24.1-CUDA-12.4.0.eb new file: s/ScaLAPACK/ScaLAPACK-3.0-NVHPC-24.3-CUDA-12.3.0.eb new file: s/Siesta/Siesta-5.0.0-beta1-foss-2023b.eb new file: s/scikit-build-core/scikit-build-core-0.5.0-GCCcore-13.2.0.eb new file: s/spglib-python/spglib-python-2.1.0-gfbf-2023b.eb modified: s/squashfs-tools/squashfs-tools-4.3.eb deleted: t/TB2J/TB2J-7.1.1-Python-3.8.6-GCCcore-10.2.0.eb new file: u/UCC-CUDA/UCC-CUDA-1.3.0-GCCcore-12.2.0-CUDA-12.3.0.eb new file: u/UCC-CUDA/UCC-CUDA-1.3.0-GCCcore-12.2.0-CUDA-12.4.0.eb new file: u/UCC-CUDA/UCC-CUDA-1.3.0_cuda_12_mem_ops.patch new file: u/UCC-CUDA/UCC-CUDA-1.3.0_link_against_existing_UCC_libs.patch new file: u/UCC/UCC-1.3.0-GCCcore-12.2.0.eb modified: u/UCX-CUDA/UCX-CUDA-1.14.1-GCCcore-11.3.0-CUDA-12.2.0.eb modified: u/UCX-CUDA/UCX-CUDA-1.14.1-GCCcore-12.2.0-CUDA-12.2.0.eb new file: u/UCX-CUDA/UCX-CUDA-1.16.0-GCCcore-12.2.0-CUDA-12.3.0.eb new file: u/UCX-CUDA/UCX-CUDA-1.16.0-GCCcore-12.2.0-CUDA-12.4.0.eb modified: u/UCX/UCX-1.14.1-GCCcore-11.3.0.eb modified: u/UCX/UCX-1.14.1-GCCcore-12.2.0.eb modified: u/UCX/UCX-1.14.1-GCCcore-12.3.0-test.eb new file: u/UCX/UCX-1.15.0-GCCcore-13.2.0.eb new file: u/UCX/UCX-1.16.0-GCCcore-12.2.0.eb modified: v/VASP/VASP-5.4.1-24Jun15-intel-2020b.eb modified: v/VASP/VASP-5.4.4-intel-2020a-mkl=sequential-BEEF-karolina.eb modified: v/VASP/VASP-5.4.4-intel-2020a-mkl=sequential-VASPsol-karolina.eb modified: v/VASP/VASP-5.4.4-intel-2020a-mkl=sequential-karolina.eb modified: v/VASP/VASP-5.4.4-intel-2020a-mkl=sequential-vtst-karolina.eb new file: v/VASP/VASP-5.4.4-intel-2022b.eb modified: v/VASP/VASP-6.3.0-intel-2020b-mkl=sequential-vtst-karolina.eb new file: v/VASP/VASP-6.4.2-NVHPC-23.11-CUDA-12.4.0.eb new file: v/VASP/VASP-6.4.2-NVHPC-24.3-CUDA-12.3.0.eb new file: v/VASP/VASP-6.4.2-intel-2022b.eb new file: v/VASP/VASP-6.4.2-intel-2023b-DFT-D4.eb new file: v/VSCode/VSCode-1.85.0.eb new file: w/Wannier90/Wannier90-3.1.0-intel-2023b-serial.eb new file: x/XALT/XALT-3.0.2.eb modified: x/XZ/XZ-5.2.5-GCCcore-9.3.0.eb |
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Lukas Krupcik
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2222b4cb88 |
new file: a/ANSYS/ANSYS-2023R2-intel-2022.12-palanti.eb
new file: c/CP2K/CP2K-2024.1-foss-2022a.eb new file: h/HDF5/HDF5-1.14.0-nvompi-2022.07.eb new file: h/HDF5/HDF5-1.14.0-nvompi-2023.03.eb new file: h/HDF5/HDF5-1.14.0-nvompi-2023.05.eb new file: h/HDF5/HDF5-1.14.0-nvompi-2023.11.eb new file: n/NCCL/NCCL-2.19.4-GCCcore-13.2.0-CUDA-12.2.0.eb new file: n/NVHPC/NVHPC-23.11.eb modified: n/NVHPC/NVHPC-23.7.eb new file: n/nvompi/nvompi-2023.03.eb new file: n/nvompi/nvompi-2023.05.eb new file: n/nvompi/nvompi-2023.11.eb modified: o/OpenMPI/OpenMPI-4.1.4-NVHPC-22.7-CUDA-11.7.0.eb new file: o/OpenMPI/OpenMPI-4.1.5-NVHPC-23.11-CUDA-12.2.0.eb new file: o/OpenMPI/OpenMPI-4.1.6-NVHPC-23.11-CUDA-12.2.0.eb new file: o/OpenMPI/OpenMPI-4.1.6-NVHPC-23.3-CUDA-12.2.0.eb new file: o/OpenMPI/OpenMPI-4.1.6-NVHPC-23.5-CUDA-12.2.0.eb new file: p/pkgconf/pkgconf-2.0.3-NVHPC-23.11.eb new file: u/UCC-CUDA/UCC-CUDA-1.2.0-GCCcore-13.2.0-CUDA-12.2.0.eb new file: u/UCX-CUDA/UCX-CUDA-1.15.0-GCCcore-13.2.0-CUDA-12.2.0.eb deleted: h/HDF5/HDF5-1.14.0-NVHPC-23.5.eb |
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Lukas Krupcik
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41d895c99c |
new file: a/ADIOS2/ADIOS2-2.9.2-gompi-2020b.eb
new file: a/ANSYS/ANSYS-2023R2-intel-2022.12-alamerini.eb new file: c/cuTENSOR/cuTENSOR-2.0.0.7-CUDA-12.2.0.eb new file: n/NWChem/NWChem-7.2.2-intel-2020a-Python-3.8.2-karolina.eb new file: n/NWChem/NWChem-7.2.2-intel-2022a.eb new file: o/OpenMPI/OpenMPI-4.1.4-GCC-10.2.0-CUDA-11.7.0.eb new file: o/openPMD-api/openPMD-api-0.15.2-gompi-2020b.eb new file: p/pkgconf/pkgconf-1.8.0-GCCcore-10.2.0.eb new file: p/pkgconfig/pkgconf-1.8.0-GCCcore-10.2.0.eb new file: s/Smilei/Smilei-5.0-intel-2020b-CUDA-12.2.0.eb new file: s/Smilei/Smilei-5.0-intel-2020b.eb new file: u/UCC/UCC-1.1.0-GCCcore-10.2.0.eb new file: u/UCX-CUDA/UCX-CUDA-1.12.1-GCCcore-10.2.0-CUDA-11.7.0.eb new file: u/UCX/UCX-1.12.1-GCCcore-10.2.0.eb |
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Lukas Krupcik
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cef77e125f |
new file: a/ANSYS/ANSYS-2022R1-intel-2020b-alamerini.eb
new file: a/AOCC/AOCC-4.1.0-GCCcore-12.2.0.eb new file: a/AOCL/AOCL-4.1.0-CCcore-12.2.0.eb new file: a/Amber/Amber-22.4-foss-2022a-AmberTools-23-CUDA-11.7.0.eb new file: c/Clang/Clang-17.0.2-GCCcore-12.2.0-CUDA-12.2.0.eb new file: c/Clang/Clang-17.0.2-GCCcore-12.2.0.eb new file: g/GROMACS/GROMACS-2023-foss-2022a-CUDA-12.0.0-PLUMED-2.9.0.eb new file: g/GROMACS/GROMACS-2023.3-foss-2022a-CUDA-12.0.0-v2.eb new file: l/LAMMPS/LAMMPS-15Jun2023-foss-2022a-kokkos-sm80.eb new file: l/LAMMPS/LAMMPS-2Aug2023-foss-2022a-kokkos-sm80.eb new file: l/LAMMPS/LAMMPS-2Aug2023-foss-2022a-kokkos.eb new file: l/LAMMPS/LAMMPS-2Aug2023_update1-foss-2021b-CUDA-12.2.0-kokkos.eb new file: l/LAMMPS/LAMMPS-2Aug2023_update1-foss-2021b-kokkos.eb new file: m/MATLAB/MATLAB-2023b.eb new file: n/NCCL/NCCL-2.18.3-GCCcore-11.3.0-CUDA-12.2.0.eb new file: o/OVITO/OVITO-3.9.2-gompi-2022a-basic.eb new file: o/OVITO/OVITO-3.9.2-gompi-2022b-basic.eb new file: o/OpenMolcas/OpenMolcas-23.06-intel-2022a-noGA.eb modified: o/OpenMolcas/OpenMolcas-23.06-intel-2022a.eb new file: p/PLUMED/PLUMED-2.9.0-foss-2022a.eb new file: q/Qt6/Qt6-6.5.3-GCCcore-12.2.0.eb new file: "q/Qt6/\\" new file: u/UCX-CUDA/UCX-CUDA-1.14.1-GCCcore-11.3.0-CUDA-12.2.0.eb |
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Lukas Krupcik
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54e9fa82d5 |
modified: g/GROMACS/GROMACS-2022-fosscuda-2020b.eb
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Lukas Krupcik
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95ef534416 |
new file: c/CheMPS2/CheMPS2-1.8.12-foss-2022b.eb
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5be8e76f44 |
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Lukas Krupcik
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8ce22eb486 |
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