Compiler specific flags
GNU/Linux: ifort, ifort 11.0 with netCDF and iotk/p2y 4.0 support, serial
./configure FC=ifort --with-netcdf-lib=/usr/local/libraries/netcdf/4.0.1/ifort--11.1/lib --with-netcdf-include=/usr/local/libraries/netcdf/4.0.1/ifort--11.1/include --with-iotk=/opt/espresso/4.1.2/iotk/ --with-p2y=4.0 --with-blacs=no
A typical configure command line that can be used to link the mkl BLAS, LAPACK and FFTW is (thanks to Giovanni Pizzi for this!)
./configure FC=ifort \ --with-blas="-L/opt/intel/Compiler/11.1/073/mkl/lib/em64t/ -lmkl_core -lmkl_intel_lp64 -lmkl_sequential" \ --with-lapack="-L/opt/intel/Compiler/11.1/073/mkl/lib/em64t/ -lmkl_core -lmkl_intel_lp64 -lmkl_sequential" \ --with-blacs="-L/opt/intel/Compiler/11.1/073/mkl/lib/em64t/ -lmkl_core -lmkl_intel_lp64 -lmkl_sequential" \ --with-scalapack="-L/opt/intel/Compiler/11.1/073/mkl/lib/em64t/ -lmkl_core -lmkl_intel_lp64 -lmkl_sequential" \ --with-fftw="/opt/intel/Compiler/11.1/073/mkl/lib/em64t/" \ --with-fftw-lib="-lmkl_core -lmkl_intel_lp64 -lmkl_sequential" \
Production runs
FCFLAGS='-O3 -xW -tpp7 -assume bscc -nofor_main' LDFLAGS='-xW' --with-blacs=no ./configure FC=mpif90
Debugging runs
./configure --enable-debug FC=mpif90 CFLAGS='-O0 -g' FCFLAGS='-O0 -tpp7 -C -check noarg_temp_created -w90 -w95 -assume bscc -nofor_main -g' --with-blacs=no
Debugging runs (GNU/Linux: g95)
./configure FC=g95 FCFLAGS='-O0 -fbackslash -g' CFLAGS='-O0 -g -Dextcus -Dextfus' CC=gcc --with-blacs=no
Production runs (GNU/Linux: g95)
./configure FC=g95 FCFLAGS="-O3 -fbackslash -fno-second-underscore"
Debugging runs (GNU/Linux: gfortran)
./configure --enable-debug --without-mpi FC=gfortran FCFLAGS='-O0 -g -fbounds-check' CFLAGS='-O0 -g -Dextcus -Dextfus' CC=gcc --with-blacs=no
GNU/Linux: PGI Fortran
./configure FC=pgf95
GNU/Linux: SUN Fortran
./configure FC=f95
GNU/Linux: Pathscale Fortran
./configure FC=pathf90 PFC=mpif90 FCFLAGS="-fno-second-underscore" UFFLAGS="-fno-second-underscore"
GNU/Linux: Open64 Fortran
./configure FC=openf95 FCFLAGS="-fno-second-underscore" UFFLAGS="-fno-second-underscore"
GNU/Linux using xlf, Tested on Mare nostrum (ppc64). Production runs
./configure CC=xlc F77=xlf PFC=mpif90 --with-blacs=no
with NETCDF support
./configure CC=xlc F77=xlf PFC=mpif90 \ --with-netcdf-include=/gpfs/apps/NETCDF/netcdf-3.6.0_64/include \ --with-netcdf-lib=/gpfs/apps/NETCDF/netcdf-3.6.0_64/lib --with-blacs=no
Magerit (CeSViMa). Production runs with NetCDF support
./configure PF90=xlf90_r FC=xlf90_r F77=xlf_r CC=xlc_r CPP="cpp -P" \ --with-blas=/gpfs/apps/BLAS/1.0.0/64/lib/libblas.a --with-lapack=/gpfs/apps/LAPACK/3.0/64/liblapack.a \ --with-netcdf-include=/gpfs/apps/NETCDF/3.6.0/64/include --with-netcdf-lib=/gpfs/apps/NETCDF/3.6.0/64/lib \ --with-fftw=/gpfs/apps/FFTW/3.2/64/lib
Default
./configure
ACML libraries, Production runs
./configure --with-blas=$ACMLPATH/libacml.a --with-lapack=$ACMLPATH/libacml.a
FFT in ACML not supported yet MKL libraries, Production runs
export MKLROOT=/applis/intel/mkl export MKLPATH=${MKLROOT}/lib/intel64 export MKLINCLUDE=${MKLROOT}/include export MKLLIBS="-L${MKLPATH} -I${MKLINCLUDE} -I${MKLINCLUDE}/intel64/lp64 -llapack -lmkl_blas95_lp64 -lmkl_lapack95_lp64 -Wl,--start-group ${MKLPATH}/libmkl_intel_lp64.a ${MKLPATH}/libmkl_sequential.a ${MKLPATH}/libmkl_core.a -Wl,--end-group -lpthread"
./configure FC=ifort F77=ifort --with-blas="$MKLLIBS" --with-lapack="$MKLLIBS"
use this page (link to be fixed) to determine the exact library version for your system: Intel MKL Link Line Advisor FFT in MKL are supported through the FFTW interface presents in the latest MKL packages.
--with-fftw="${MKLROOT}/interfaces/fftw3xf/" --with-fftw-lib="${MKLROOT}/interfaces/fftw3xf/libfftw3xf_intel.a $MKLLIBS"