[CP2K-user] [CP2K:14307] Re: Compilation problems: mpiifort not found, even though is perfectly installed

[Diego Guedes-Sobrinho]

Glenn

That's not the case.
The compilers are charged, even into ~/.bashed.rc

As I said, compiling others codes with intel works perfectly.

Em dom, 29 de nov de 2020 01:06, Glenn Wolosh <gwo... at njit.edu> escreveu:

> Oops, that should be
>
> source
> /opt/intel/compilers_and_libraries_2020.4.304/linux/bin/compilervars.sh
> intel64
>
> --Glenn
>
>
> On Saturday, November 28, 2020 at 11:04:51 PM UTC-5 Glenn Wolosh wrote:
>
>> You need to source the intel compilers prior to compiling:
>>
>> source
>> /opt/intel/compilers_and_libraries_2020.4.304/linux/compilervars.sh intel64
>>
>> --Glenn
>>
>> On Saturday, November 28, 2020 at 9:18:06 PM UTC-5 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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