Install Yambo on Ubuntu/LinuxMint with Intel compiler: Difference between revisions
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The Intel compiler are freely available on Linux machines. | The Intel compiler are freely available on Linux machines.<br> | ||
From the Intel oneAPI page, download and install: [https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html#fortran Intel Fortran Compiler] | From the Intel oneAPI page, download and install:<br> | ||
- [https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html#fortran Intel Fortran Compiler] | |||
- [https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html#inpage-nav-5-undefined Intel C++ Compiler] | |||
- [https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html#inpage-nav-10-undefined Intel MPI libraries] | |||
- [https://software.intel.com/content/www/us/en/develop/articles/oneapi-standalone-components.html#inpage-nav-11-5 Intel MKL libraries]. | |||
Revision as of 09:18, 12 April 2021
The Intel compiler are freely available on Linux machines.
From the Intel oneAPI page, download and install:
- Intel Fortran Compiler
- Intel C++ Compiler
- Intel MPI libraries
- Intel MKL libraries.
source /opt/intel/oneapi/setvars.sh
export MKL_LIBS="-Wl,--start-group ${MKLROOT}/lib/intel64/libmkl_intel_lp64.a ${MKLROOT}/lib/intel64/libmkl_intel_thread.a ${MKLROOT}/lib/intel64/libmkl_core.a -Wl,--end-group -liomp5 -lpthread -lm -ldl"
export MKL_INCLUDE="-I${MKLROOT}/include"
export MKL_SCALAPACK=" ${MKLROOT}/lib/intel64/libmkl_scalapack_lp64.a -Wl,--start-group ${MKLROOT}/lib/intel64/libmkl_intel_lp64.a ${MKLROOT}/lib/intel64/libmkl_intel_thread.a
${MKLROOT}/lib/intel64/libmkl_core.a ${MKLROOT}/lib/intel64/libmkl_blacs_intelmpi_lp64.a -Wl,--end-group -liomp5 -lpthread -lm -ldl"
./configure FC=mpiifort F77=mpiifort --enable-open-mp --enable-par-linalg --enable-hdf5-par-io \ --with-blas-libs="$MKL_LIBS" --with-lapack-libs="$MKL_LAPACK" \ --with-fft-libs="$MKL_LIBS" --with-fft-includedir="$MKL_INCLUDE" \ --with-scalapack-libs="$MKL_SCALAPACK" --with-blacs-libs="$MKL_SCALAPACK" \ --enable-slepc-linalg