[QE-users] Building QE 6.5 with MKL static link

[Caleb Ho]

Hi all,

I'm trying to build 6.5 (specifically, I'm at the "qe-6.5" tag) with Intel MKL statically linked. I've attached the output and settings I put into MKL Link Line Advisor. Here's the beginning output of configure which fails to find dgemm:

$ ./configure
checking build system type... x86_64-pc-linux-gnu
checking ARCH... x86_64
checking setting AR... ... ar
checking setting ARFLAGS... ... ruv
checking for gfortran... gfortran
checking whether the Fortran compiler works... yes
checking for Fortran compiler default output file name... a.out
checking for suffix of executables...
checking whether we are cross compiling... no
checking for suffix of object files... o
checking whether we are using the GNU Fortran compiler... yes
checking whether gfortran accepts -g... yes
checking for mpif90... mpif90
checking whether we are using the GNU Fortran compiler... yes
checking whether mpif90 accepts -g... yes
checking version of mpif90... gfortran 5.3
checking for Fortran flag to compile .f90 files... none
setting F90... gfortran
setting MPIF90... mpif90
checking whether we are using the GNU C compiler... yes
checking whether /public/apps/gcc/5.3.0/bin/gcc accepts -g... yes
checking for /public/apps/gcc/5.3.0/bin/gcc option to accept ISO C89... none needed
setting CC... /public/apps/gcc/5.3.0/bin/gcc
setting CFLAGS... -O3
checking for gfortran... gfortran
checking whether we are using the GNU Fortran 77 compiler... yes
checking whether gfortran accepts -g... yes
setting F77... gfortran
using F90... gfortran
setting FFLAGS... -O3 -g
setting F90FLAGS... $(FFLAGS) -x f95-cpp-input
setting FFLAGS_NOOPT... -O0 -g
setting CPP... cpp
setting CPPFLAGS... -P -traditional -Uvector
setting LD... mpif90
setting LDFLAGS... /public/apps/intel/mkl/2019.5.281/compilers_and_libraries_2019.5.281/linux/mkl/lib/intel64/libmkl_scalapack_lp64.a -Wl,--start-group /public/apps/intel/mkl/2019.5.281/compilers_and_libraries_2019.5.281/linux/mkl/lib/intel64/libmkl_gf_lp64.a /public/apps/intel/mkl/2019.5.281/compilers_and_libraries_2019.5.281/linux/mkl/lib/intel64/libmkl_sequential.a /public/apps/intel/mkl/2019.5.281/compilers_and_libraries_2019.5.281/linux/mkl/lib/intel64/libmkl_core.a /public/apps/intel/mkl/2019.5.281/compilers_and_libraries_2019.5.281/linux/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a -Wl,--end-group -lpthread -lm -ldl
checking whether make sets $(MAKE)... yes
checking whether Fortran files must be preprocessed... no
checking for library containing dgemm... no
MKL not found
in /public/apps/intel/mkl/2019.5.281/compilers_and_libraries_2019.5.281/linux/mkl/lib/intel64: checking for library containing dgemm... no
MKL not found
in /public/apps/intel/mkl/2019.5.281/compilers_and_libraries_2019.5.281/linux/tbb/lib/intel64_lin/gcc4.7: checking for library containing dgemm... no
MKL not found
in /public/apps/intel/mkl/2019.5.281/compilers_and_libraries_2019.5.281/linux/compiler/lib/intel64_lin: checking for library containing dgemm... no
MKL not found

Best,
Caleb Ho
Facebook, Inc.

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