[Pw_forum] Problem installing espresso-5.1

[Mohamad Moadeli]

Dear Rajdeep Banerjee,

Try this:

./configure --enable-parallel -with-scalapack=no
make all

Regards,

M.M

Mohammad Moaddeli
Shahid Chamran University of Ahvaz, Ahvaz, Iran

On Mon, Jan 19, 2015 at 1:48 AM, Ari P Seitsonen <Ari.P.Seitsonen at iki.fi>
wrote:

>
> Dear Rajdeep Banerjee,
>
>   Are you sure that you use a consistent version of OpenMPI in the
> compilation? I have previously managed a compilation with gfortran-OpenMPI
> and MKL, I do not remember that it would have been very difficult. If
> nothing else works, you might want to email more information, namely output
> like 'mpif90 -show' and the created "make.sys" file.
>
>     Greetings,
>
>        apsi
>
> -=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=
> -=*=-=*=-=*=-=*=-
>   Ari Paavo Seitsonen / Ari.P.Seitsonen at iki.fi / http://www.iki.fi/~apsi/
>   Ecole Normale Supérieure (ENS), Département de Chimie, Paris
>   Mobile (F) : +33 789 37 24 25    (CH) : +41 79 71 90 935
>
>
>
> On Sat, 17 Jan 2015, Rajdeep Banerjee wrote:
>
>  Dear all,
>>              I am facing error while installing espresso-5.1. Following
>> are the steps I followed:
>>
>> ./configure --enable-parallel
>> make all
>>
>> Following are the last lines of the error message:
>>
>> /opt/intel/composer_xe_2013.0.079/mkl/lib/intel64/libmkl_
>> blacs_openmpi_lp64.a(BI_MPI_F77_to_c_trans_comm.o): In function
>> `BI_MPI_F77_to_c_trans_comm':
>> ../../../../scalapack/BLACS/SRC/MPI/INTERNAL/BI_MPI_F77_to_c_trans_comm.c:(.text+0x6):
>> undefined reference to `MPI_Comm_f2c'
>> collect2: error: ld returned 1 exit status
>> make[2]: *** [pw.x] Error 1
>> make[2]: Leaving directory `/home/rajdeep/soft/espresso-5.1/PW/src'
>> make[1]: *** [pw] Error 1
>> make[1]: Leaving directory `/home/rajdeep/soft/espresso-5.1/PW'
>> make: *** [pw] Error 1
>>
>>  (I have a 64-bit machine and a gfortran compiler)
>>
>>             I can provide more information if you want. Please help.
>>
>> Thanks and regards,
>> Rajdeep Banerjee
>> PhD student
>> JNCASR
>> Bangalore, India
>>
>>
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