66 lines
1.9 KiB
Bash
Executable File
66 lines
1.9 KiB
Bash
Executable File
#!/bin/bash -e
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cd /opt
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source environment.sh
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apt install -y wget make pkg-config
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which icx \
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&& export CC=icx \
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|| (apt install -y gcc libmkl-rt ; \
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cp /lib/x86_64-linux-gnu/libblas.so.3 /lib/x86_64-linux-gnu/libblas.so; \
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cp /lib/x86_64-linux-gnu/liblapack.so.3 /lib/x86_64-linux-gnu/liblapack.so)
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which ifort \
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&& export FC=ifort \
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|| apt install -y gfortran
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if [ $CC = icx ] ; then
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export CFLAGS="-Ofast -g -qmkl=sequential -fma -march=core-avx2 -finline"
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export FCFLAGS="-Ofast -g -qmkl=sequential -ftz -fma -march=core-avx2 -ip"
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else
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export CFLAGS="-Ofast -g -march=core-avx2"
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export FCFLAGS="-Ofast -g -march=core-avx2"
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fi
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wget https://github.com/TREX-CoE/qmckl/releases/download/v1.0.0/qmckl-1.0.0.tar.gz
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tar -zxvf qmckl-1.0.0.tar.gz
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cd qmckl-1.0.0
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mkdir _build_sequential
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cd _build_sequential
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../configure --prefix=/usr --disable-python --disable-doc --enable-hpc --without-openmp
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make -j 8
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make -j 8 check
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# make install
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/usr/bin/install -c src/.libs/libqmckl.so.0.0.0 /usr/lib/libqmckl-sequential.so.0.0.0
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(cd /usr/lib \
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&& { ln -s -f libqmckl-sequential.so.0.0.0 libqmckl-sequential.so.0 \
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|| { rm -f libqmckl-sequential.so.0 \
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&& ln -s libqmckl-sequential.so.0.0.0 libqmckl-sequential.so.0; }; })
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(cd /usr/lib \
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&& { ln -s -f libqmckl-sequential.so.0.0.0 libqmckl-sequential.so \
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|| { rm -f libqmckl-sequential.so \
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&& ln -s libqmckl-sequential.so.0.0.0 libqmckl-sequential.so; }; })
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/usr/bin/install -c src/.libs/libqmckl.lai /usr/lib/libqmckl-sequential.la
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sed -i "s/libqmckl/libqmckl-sequential/g" /usr/lib/libqmckl-sequential.la
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/usr/bin/install -c src/.libs/libqmckl.a /usr/lib/libqmckl-sequential.a
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chmod 644 /usr/lib/libqmckl-sequential.a
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ranlib /usr/lib/libqmckl-sequential.a
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cd ..
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mkdir _build_parallel
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cd _build_parallel
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../configure --prefix=/usr --disable-python --disable-doc --enable-hpc --with-openmp
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make -j 8
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make -j 8 check
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make install
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cd ..
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cd ..
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rm -rf qmckl-1.0.0 qmckl-1.0.0.tar.gz
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