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Update NERSC perlmutter recipe #5281

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merged 2 commits into from
Jan 15, 2025
Merged

Update NERSC perlmutter recipe #5281

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c0a6d13
Update NERSC perlmutter recipe
ye-luo Jan 14, 2025
8872b17
Merge branch 'develop' into perlmutter-offload-recipe
prckent Jan 14, 2025
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14 changes: 3 additions & 11 deletions config/build_nersc_perlmutter_Clang.sh
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Original file line number Diff line number Diff line change
@@ -1,7 +1,7 @@
#!/bin/bash
# This recipe is intended for NERSC Perlmutter https://docs.nersc.gov/systems/perlmutter
# It builds all the varaints of QMCPACK in the current directory
# last revision: Mar 18th 2024
# last revision: Jan 14th 2025
#
# How to invoke this script?
# build_nersc_perlmutter_Clang.sh # build all the variants assuming the current directory is the source directory.
Expand Down Expand Up @@ -47,7 +47,7 @@ else
exit
fi

for name in offload_cuda_real_MP offload_cuda_real offload_cuda_cplx_MP offload_cuda_cplx \
for name in gpu_real_MP gpu_real gpu_cplx_MP gpu_cplx \
cpu_real_MP cpu_real cpu_cplx_MP cpu_cplx
do

Expand All @@ -61,18 +61,10 @@ if [[ $name == *"_MP"* ]]; then
CMAKE_FLAGS="$CMAKE_FLAGS -DQMC_MIXED_PRECISION=ON"
fi

if [[ $name == *"offload"* || $name == *"cuda"* ]]; then
if [[ $name == *"gpu"* ]]; then
CMAKE_FLAGS="$CMAKE_FLAGS -DQMC_GPU_ARCHS=sm_80"
fi

if [[ $name == *"offload"* ]]; then
CMAKE_FLAGS="$CMAKE_FLAGS -DENABLE_OFFLOAD=ON"
fi

if [[ $name == *"cuda"* ]]; then
CMAKE_FLAGS="$CMAKE_FLAGS -DENABLE_CUDA=ON"
fi

folder=build_${Machine}_${Compiler}_${name}

if [[ -v install_folder ]]; then
Expand Down
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