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

[Glenn Wolosh]

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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