[DFTB-Plus-User] DFTB+ compilation error in mpifx_send.f90

Ben Hourahine benjamin.hourahine at strath.ac.uk
Thu Dec 8 10:55:24 CET 2016


Hello Biswajit,

the issue is due to open MPI becoming more strictly typed on its
interfaces, but the intel compilers not using this correctly. Either
earlier tools (the development machine I use is with ifort 15.0.3 and
open MPI 1.6) or later (open MPI >= 1.10.1) should work.

Regards

Ben

On 01/12/16 21:27, Biswajit Santra wrote:
> Dear Ben,
>
> I am using Open MPI 1.8.8. Do you any version which compiles the code
> without much trouble?
>
> Best wishes,
> Biswajit
>
> Biswajit Santra
> Mobile: +1-609-227-9202
> http://www.princeton.edu/~bsantra/ <http://www.princeton.edu/%7Ebsantra/>
>
> On Thu, Dec 1, 2016 at 7:01 AM, Ben Hourahine
> <benjamin.hourahine at strath.ac.uk
> <mailto:benjamin.hourahine at strath.ac.uk>> wrote:
>
>     Dear Biswajit,
>
>
>     Which MPI version do you have installed?
>
>     It looks like it might be a variant of the issue here:
>
>     https://software.intel.com/en-us/forums/intel-fortran-compiler-for-linux-and-mac-os-x/topic/594261
>     <https://software.intel.com/en-us/forums/intel-fortran-compiler-for-linux-and-mac-os-x/topic/594261>
>
>     in which case, if you have Open MPI 1.10, can you try a different mpi
>     version or library
>
>     Regards
>
>     Ben
>
>     On 01/12/16 06:28, Biswajit Santra wrote:
>     > Hello,
>     >
>     > I am using ifort version 16.0.2 and trying to compile the parallel
>     > version dftb+.mpi-r4473. The compilation stops at mpifx_send.f90.
>     >
>     > ARCH = x86_64-linux-ifort
>     >
>     > I am sending the log of the make till the error. Please let me
>     know what
>     > could be the issue or if you need any further information.
>     >
>     > Thanks in advance.
>     >
>     > Best wishes,
>     > Biswajit
>
>     --
>           Dr. B. Hourahine, SUPA, Department of Physics,
>         University of Strathclyde, John Anderson Building,
>                 107 Rottenrow, Glasgow G4 0NG, UK.
>         +44 141 548 2325 <tel:%2B44%20141%20548%202325>,
>     benjamin.hourahine at strath.ac.uk
>     <mailto:benjamin.hourahine at strath.ac.uk>
>
>     2013/14 THE Awards Entrepreneurial University of the Year
>           2012/13 THE Awards UK University of the Year
>
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>             registered in Scotland, number SC015263
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-- 
      Dr. B. Hourahine, SUPA, Department of Physics,
    University of Strathclyde, John Anderson Building,
            107 Rottenrow, Glasgow G4 0NG, UK.
    +44 141 548 2325, benjamin.hourahine at strath.ac.uk

2013/14 THE Awards Entrepreneurial University of the Year
      2012/13 THE Awards UK University of the Year

   The University of Strathclyde is a charitable body,
        registered in Scotland, number SC015263

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