4 Commits

Author SHA1 Message Date
Lukas Krupcik
a2bb6c8760 new file: d/DFT-D4/DFT-D4-3.2.0-remove_module_id.patch
new file:   d/DFT-D4/DFT-D4-3.6.0-intel-2022b-Python-3.10.8.eb
	modified:   d/DFTB+/DFTB+-21.1-intel-2020b-Python-3.8.6-karolina.eb
	modified:   d/DFTB+/DFTB+-21.2-intel-2020b-TB.eb
	new file:   f/Forge/Forge-23.0.2.eb
	new file:   l/LAPACK/LAPACK-3.10.0-GCC-12.2.0.eb
	modified:   p/PyTorch/PyTorch-1.11.0-fosscuda-2020b.eb
	modified:   v/VASP/VASP-6.2.0-intel-2020b.eb
	new file:   v/VASP/VASP-6.4.2-intel-2022b-DFT-D4.eb
	new file:   w/Wannier90/Wannier90-3.1.0-intel-2022b-serial.eb
2023-09-27 09:23:34 +02:00
Jakub Kropacek
29773993aa new file: l/LAPACK/LAPACK-3.10.0-gompi-2021a.eb
new file:   m/Mmg/Mmg-5.6.0-gompi-2021a.eb
	new file:   m/mpi4py/mpi4py-3.1.3-foss-2021a.eb
	new file:   p/PETSc/PETSc-3.17.4-foss-2021a.eb
	new file:   p/PETSc/webclient-3.17.0.patch
	new file:   s/SuiteSparse/SuiteSparse-5.13.0-foss-2021a-METIS-5.1.0.eb
	deleted:    p/PETSc/PETSc-3.17.2-foss-2021a.eb
2022-09-24 14:26:55 +02:00
easybuild
536c92481f new file: a/aria2/aria2-1.35.0-GCCcore-10.3.0.eb
new file:   b/BLIS/BLIS-0.8.1_fix_dgemm-fpe-signalling-on-broadwell.patch
	new file:   b/BLIS/BLIS-2.2-GCCcore-10.2.0.eb
	new file:   b/BLIS/BLIS-2.2-amd_fix-undefined-reference-blist-abort.patch
	new file:   b/BLIS/BLIS-3.0.1-GCCcore-10.2.0.eb
	new file:   b/Biopython/Biopython-1.72-foss-2020b-Python-2.7.18.eb
	new file:   c/Cordax/Cordax-1.0-Python-2.7.18.eb
	new file:   d/DFTB+/DFTB+-21.2-intel-2020b-Python-3.8.6.eb
	new file:   d/DFTB+/DFTB+-21.2-intel-2020b-TB.eb
	new file:   d/Dakota/Dakota-6.15.0-fix_lapack_detection.patch
	new file:   d/Dakota/Dakota-6.15.0-foss-2021b.eb
	new file:   d/Dakota/Dakota-6.15.0-intel-2021b.eb
	new file:   e/ELPA/ELPA-2020.11.001-fosscuda-2020b.eb
	new file:   f/FoldX/FoldX-5.0.eb
	new file:   f/Forge/Forge-21.1.3.eb
	new file:   g/GROMACS/GROMACS-2018.8-fosscuda-2020b-PLUMED-2.5.6-switch.eb
	new file:   g/GROMACS/GROMACS-2021.4-foss-2020b-PLUMED-2.7.3.eb
	new file:   h/HDF5/HDF5-1.12.1-NVHPC-21.11.eb
	new file:   h/HDF5/HDF5-1.12.1-foss-2021b-parallel.eb
	new file:   h/HDF5/HDF5-1.12.1-iimpi-2021b.eb
	new file:   h/HDF5/HDF5-1.12.1-intel-2021b-parallel.eb
	new file:   h/HyperQueue/HyperQueue-0.8.0.eb
	new file:   h/Hypre/Hypre-2.23.0-intel-2020b.eb
	new file:   h/h5py/h5py-3.6.0-intel-2021b.eb
	new file:   l/LAPACK/LAPACK-3.10.0-GCC-11.2.0.eb
	new file:   l/libFLAME/libFLAME-5.2.0-GCCcore-10.2.0.eb
	new file:   m/MaSuRCA/MaSuRCA-4.0.7-foss-2020a-Perl-5.30.2.eb
	new file:   m/Molpro/Molpro-mpp-2022.1.1.linux_x86_64_mpipr.eb
	new file:   m/Molpro/Molpro-mpp-2022.1.1.linux_x86_64_sockets.eb
	new file:   n/nompi/nompi-2022a.eb
	new file:   o/ORCA/ORCA-5.0.3-OpenMPI-4.1.1.eb
	modified:   o/Octopus/Octopus-11.3-intel-2020b-mpi.eb
	new file:   o/OpenCV/OpenCV-4.5.3-foss-2021a-CUDA-11.3.1-contrib.eb
	new file:   o/OpenCV/OpenCV-4.5.5-foss-2021a-CUDA-11.4.1-contrib.eb
	new file:   o/OpenMPI/OpenMPI-4.1.1-GCC-11.2.0.eb
	new file:   o/OpenMPI/OpenMPI-4.1.2-GCC-11.2.0-Java-1.8.0_221.eb
	new file:   o/OpenMPI/OpenMPI-4.1.2-GCC-11.2.0.eb
	modified:   p/PETSc/PETSc-3.14.4-intel-2020b.eb
	modified:   p/PLUMED/PLUMED-2.5.6-fosscuda-2020b-patch.eb
	new file:   p/PLUMED/PLUMED-2.5.6-fosscuda-2020b-switch.eb
	new file:   p/PLUMED/PLUMED-2.7.3-foss-2020b.eb
	modified:   p/phonopy/phonopy-2.12.0-conda.eb
	modified:   q/QMCPACK/QMCPACK-3.11.0-intel-2020b-Python-3.8.6.eb
	new file:   q/QMCPACK/QMCPACK-3.12.0-intel-2020b-Python-3.8.6.eb
	new file:   q/QMCPACK/QMCPACK-3.12.0-intel-2021b-Python-3.9.6-lowopt.eb
	new file:   q/QMCPACK/QMCPACK-3.13.0-intel-2020b-Python-3.8.6.eb
	new file:   q/QuantumESPRESSO/QuantumESPRESSO-6.7-intel-2021a.eb
	new file:   q/QuantumESPRESSO/QuantumESPRESSO-7.0-NVHPC-21.9.eb
	new file:   r/rocm-cuda2hip/rocm-cuda2hip-4.3.1-gcccuda-2020b.eb
	new file:   s/ScaLAPACK/ScaLAPACK-2.2-NVHPC-21.11.eb
	new file:   t/Tango/Tango.eb
	new file:   t/Tensorflow/TensorFlow-2.5.0-fosscuda-2020b.eb
	new file:   v/VASP/VASP-5.4.1-24Jun15-intel-2020b.eb
	new file:   w/Waltz/Waltz.eb
	new file:   y/Yambo/Yambo-5.0.4-intel-2020a.eb
2022-03-04 13:14:37 +01:00
Lukáš Krupčík
910c5ea86a new file: d/Doris/Doris-5.0beta-foss-2017a.eb
new file:   d/Doris/core_configure.patch
	new file:   d/Doris/envisat_Makefile.patch
	new file:   d/Doris/sartools_Makefile.patch
	new file:   l/LAPACK/LAPACK-3.7.1-gompi-2017a.eb
	modified:   p/Python/Python-2.7.9-intel-2015b.eb
	new file:   p/phonopy/phonopy-1.11.12.5-intel-2015b-Python-2.7.9.eb
	modified:   t/Trilinos/Trilinos-12.10.1-intel-2017a-Python-2.7.11.eb
	modified:   t/Trilinos/Trilinos-12.4.2-intel-2017a-Python-2.7.11.eb
	modified:   t/Trilinos/Trilinos-12.8.1-intel-2017a-Python-2.7.11.eb
2017-07-04 08:09:07 +02:00