[CP2K-user] Compilation problems: mpiifort not found, even though is perfectly installed

[Evelyn Navarro]

.

On Sunday, November 29, 2020 at 10:18:06 AM UTC+8 gue... at gmail.com 
wrote:

> *Hi everyone, I'm trying a compilation with intel compilers with the 
> following archtecture:*
>
> ------------------------------
> CC        = mpiicc
> FC        = mpiifort
> LD        = mpiifort
> AR        = ar -r
>
> CFLAGS    = -O3 -xAVX -g -traceback -xHost
>
> DFLAGS    = -D__FFTW3 -D__MKL -D__MPI_VERSION=3
> DFLAGS   += -D__parallel -D__SCALAPACK
>
> FCFLAGS   = $(CFLAGS) $(DFLAGS)
> FCFLAGS  += -fpp -fp-model precise -free -funroll-loops
> FCFLAGS  += -I${MKLROOT}/include -I${MKLROOT}/include/fftw
>
> LDFLAGS   = $(FCFLAGS) -static-intel -static_mpi
> LDFLAGS_C = -nofor_main
>
> MKL_LIB   = ${MKLROOT}/lib/intel64
>
> LIBS      = $(MKL_LIB)/libmkl_scalapack_lp64.a
> LIBS     += -Wl,--start-group
> LIBS     += $(MKL_LIB)/libmkl_intel_lp64.a
> LIBS     += ${MKL_LIB}/libmkl_sequential.a
> LIBS     += $(MKL_LIB)/libmkl_core.a
> LIBS     += ${MKL_LIB}/libmkl_blacs_intelmpi_lp64.a
> LIBS     += -Wl,--end-group
>
> # Required due to memory leak that occurs if high optimisations are used
> mp2_optimize_ri_basis.o: mp2_optimize_ri_basis.F
>         $(FC) -c $(subst O2,O0,$(FCFLAGS)) $<
> ----------------------
>
> *After following command *
>
> make -j 6 ARCH=Linux-x86-64-intel-minimal_changed VERSION=popt
>
> *I got the following error message:*
>
> /bin/sh: 1: mpiifort: not found
> /home/dgs/Downloads/cp2k-7.1/cp2k-7.1_parallel/cp2k-7.1/exts/dbcsr/Makefile:428: 
> recipe for target 'dbcsr_kinds.o' failed
> make[4]: *** [dbcsr_kinds.o] Error 127
> Makefile:129: recipe for target 'libdbcsr' failed
> make[3]: *** [libdbcsr] Error 2
> /home/dgs/Downloads/cp2k-7.1/cp2k-7.1_parallel/cp2k-7.1/exts/Makefile.inc:16: 
> recipe for target 'dbcsr' failed
> make[2]: *** [dbcsr] Error 2
> make[2]: ** Esperando que outros processos terminem.
> /home/dgs/Downloads/cp2k-7.1/cp2k-7.1_parallel/cp2k-7.1/Makefile:123: 
> recipe for target 'popt' failed
> make[1]: *** [popt] Error 2
> Makefile:118: recipe for target 'all' failed
> make: *** [all] Error 2
>
> *mpiifort is installed, such as others codes can be compiled with the 
> intel set.*
> *By setting explicity the path for mpiifort and mpiicc, e. g.*
>
> CC        = 
> /opt/intel/compilers_and_libraries_2020.4.304/linux/mpi/intel64/bin/mpiicc
> FC        = 
> /opt/intel/compilers_and_libraries_2020.4.304/linux/mpi/intel64/bin/mpiifort
> LD        = 
> /opt/intel/compilers_and_libraries_2020.4.304/linux/mpi/intel64/bin/mpiifort
>
> *the compilation error change to *
>
> /opt/intel/compilers_and_libraries_2020.4.304/linux/mpi/intel64/bin/mpiifort: 
> 1: eval: ifort: not found
> /home/dgs/Downloads/cp2k-7.1/cp2k-7.1_parallel/cp2k-7.1/exts/dbcsr/Makefile:428: 
> recipe for target 'dbcsr_kinds.o' failed
> make[4]: *** [dbcsr_kinds.o] Error 127
> Makefile:129: recipe for target 'libdbcsr' failed
> make[3]: *** [libdbcsr] Error 2
> /home/dgs/Downloads/cp2k-7.1/cp2k-7.1_parallel/cp2k-7.1/exts/Makefile.inc:16: 
> recipe for target 'dbcsr' failed
> make[2]: *** [dbcsr] Error 2
> make[2]: ** Esperando que outros processos terminem.
> /home/dgs/Downloads/cp2k-7.1/cp2k-7.1_parallel/cp2k-7.1/Makefile:123: 
> recipe for target 'popt' failed
> make[1]: *** [popt] Error 2
> Makefile:118: recipe for target 'all' failed
> make: *** [all] Error 2
>
> *Anyone would know how to solve this?*
> *Thanks in advance.*
>
>
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