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FIX: load new cmake for q-e GPU A100 build to work
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germann_e 2025-05-12 10:52:26 +02:00
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commit 1aa2b07d17
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pages/merlin7/05-Software-Support/quantum-espresso.md
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@ -106,7 +106,7 @@ make [-jN]
module purge module purge
module use Spack module use Spack
module use unstable module use unstable
module load nvhpc/25.3 openmpi/main-6bnq-A100-gpu fftw/3.3.10.6-qbxu-omp hdf5/develop-2.0-rjgu netlib-scalapack/2.2.2-3hgw module load nvhpc/25.3 openmpi/main-6bnq-A100-gpu fftw/3.3.10.6-qbxu-omp hdf5/develop-2.0-rjgu netlib-scalapack/2.2.2-3hgw cmake/3.31.6-oe7u
cd <path to QE source directory> cd <path to QE source directory>
mkdir build mkdir build