[Sax-project-users] A Install problem

Tue Jul 14 11:40:14 CEST 2009

It seems that the ptk library is not properly compiled.

As a quick fix try to add to the DFLAGS in the make.sys "-D__INTEL"

I know that you are using gfortran and not intel, but presently there
is no preset for gfortran in the ptk/include/ptk_config.h file, and I
guess that gfortran *could* be compatible with the intel preset.

Try and let me know!

Giovanni

PS please use "reply-to-all" so that the email is also sent to the
sax-project-users list, and other people can see it

On Tue, Jul 14, 2009 at 11:31 AM, onionys<onionys at gmail.com> wrote:
> Dear Giovanni:
>
> After I edited the make.sys file, chang "-r8" into "-fdefault-real-8"
>
> To complie the ffti package has been ok.
>
> But to complie the ptk package still encounter the same problem, and shows
> the message as follow:
>
> ( It seems that the complier can't find the subroutine "
> ptk_bcast(buffer,root,comm,ierr) ",
>
> which is mentioned in the README file in the directory /ptk )
>
> ==========================================================
> mpif90 -O3 -fdefault-real-8 -x f95-cpp-input -D__LINUX64 -D__FFTW -D__MPI
> -D__PARA -I. -I../../sax/include -I../../lasi/src/   -I../../lasi/include
> -I../../ffti/src/   -I../../ffti/include -I../../lapack/src/
> -I../../lapack/include -I../../ptk/src/   -I../../ptk/include
> -I../../numrec/src/   -I../../numrec/include -I../../iotk/src/
> -I../../iotk/include -I../../fftw/src/   -I../../fftw/include
> -I../../blas/src/   -I../../blas/include      -c bse_options_module.f90
> bse_options_module.f90:158.44:
>
>   call ptk_bcast(options%nbandmin,root,comm)
>                                            1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> bse_options_module.f90:159.44:
>
>   call ptk_bcast(options%nbandmax,root,comm)
>                                            1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> bse_options_module.f90:160.57:
>
>   call ptk_bcast(options%cutoff_polarizability,root,comm)
>                                                         1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> bse_options_module.f90:161.47:
>
>   call ptk_bcast(options%cutoff_fock,root,comm)
>                                               1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> bse_options_module.f90:165.48:
>
>   call ptk_bcast(options%energy_shift,root,comm)
>                                                1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> bse_options_module.f90:166.44:
>
>   call ptk_bcast(options%bse_emin,root,comm)
>                                            1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> bse_options_module.f90:167.44:
>
>   call ptk_bcast(options%bse_emax,root,comm)
>                                            1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> bse_options_module.f90:168.44:
>
>   call ptk_bcast(options%bse_spin,root,comm)
>                                            1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> bse_options_module.f90:169.54:
>
>   call ptk_bcast(options%convert_from_pwscf,root,comm)
>                                                      1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> bse_options_module.f90:172.43:
>
>     call ptk_bcast(options%nelec,root,comm)
>                                           1
> Error: There is no specific subroutine for the generic 'ptk_bcast' at (1)
> make[1]: *** [bse_options_module.o] Error 1
> make[1]: Leaving directory `/cluster/node00/sax-1.0.0/sax/src'
> make: *** [all] Error 2
> ==========================================================
>
>
> Regards
>
> ======
> Song Yang
> Ph.D student
> Department of Photonics and
> Institute of Electro-Optical Engineering
> National Chiao Tung University
> 1001 Tahsueh Rd., Hsinchu 30050, Taiwan
> Tel.: +886-3-5712121 ext.56310
> Fax: +886-3-5716631
> e-mail: onionys at gmail.com
>
>
>
> 2009/7/14 Giovanni Bussi <giovanni.bussi at gmail.com>
>>
>> Dear onionys,
>>
>> it seems that the compiler is complaining:
>> gfortran: unrecognized option '-r8'
>>
>> First fix this, then retry. You should edit the make.sys file,
>> changing "-r8" into "-fdefault-real-8"
>>
>> Giovanni
>>
>> On Tue, Jul 14, 2009 at 4:35 AM, onionys<onionys at gmail.com> wrote:
>> > Dear developers:
>> >
>> >     I have download the sax-1.0.0.tar.gz, Bug_fixed_1.0.0.1.tar.gz, and
>> > workaround_1.0.0.2.tar.gz to my computer.
>> >
>> > And I meet some problem while I am installing it into my system:
>> >
>> > ================================
>> > while I install SAX
>> > ----
>> > ./configure
>> >
>> > make allmake
>> >
>> > cd sax/src
>> >
>> > make all
>> > ----
>> > Then I encountered some problem.
>> >
>> > it showed the message:
>> > ---------------------------------------------------
>> > mpif90 -O3 -r8  -x f95-cpp-input -D__LINUX64 -D__FFTW -D__MPI -D__PARA
>> > -I.
>> > -I../../ffti/include -I../../fftw/src/   -I../../fftw/include
>> > -I../../blas/src/   -I../../blas/include      -c ffti_external.f90
>> > gfortran: unrecognized option '-r8'
>> > ffti_external.f90:615.24:
>> >
>> >   call ffti_singleton3d(f,nr1,nr2,nr3,idir)
>> >                        1
>> > Error: Type mismatch in argument 'f' at (1); passed COMPLEX(8) to
>> > COMPLEX(4)
>> > make[1]: *** [ffti_external.o] Error 1
>> > make[1]: Leaving directory `/cluster/node00/sax-1.0.0/ffti/src'
>> > make: *** [all] Error 2
>> > ---------------------------------------------------
>> >
>> > After modified the file "ffti_singleton.f90" at line 15
>> >
>> > complex, intent(inout) :: f(:)
>> >
>> > to
>> >
>> > complex(kind=8), intent(inout) :: f(:)
>> >
>> > it seemed to pass the complie.
>> >
>> > But tehn It showed the next message as:
>> > ---------------------------------------------------
>> > mpif90 -O3 -r8  -x f95-cpp-input -D__LINUX64 -D__FFTW -D__MPI -D__PARA
>> > -I.
>> > -I../../ptk/include   -c test.f90
>> > gfortran: unrecognized option '-r8'
>> > test.f90:14.44:
>> >
>> > call ptk_bcast(i,root=0,comm=ptk_comm_world)
>> >                                            1
>> > Error: There is no specific subroutine for the generic 'ptk_bcast' at
>> > (1)
>> > make[1]: *** [test.o] Error 1
>> > make[1]: Leaving directory `/cluster/node00/sax-1.0.0/ptk/src'
>> > make: *** [all] Error 2
>> > ---------------------------------------------------
>> >
>> > I am sorry that I don't know how to fix this problem...
>> >
>> > And this is the information of my computer system:
>> > (The culster fabricated by two same computers.)
>> >
>> > CPU:  Intel(R) Core(TM)2 Quad  CPU   Q8200  @ 2.33GHz
>> > OS:  Linux Debian 2.6.26-1-amd64 SMP x86_64 GNU/Linux
>> > MPI:  MPICH2
>> > fortran complier: gfortran-4.3
>> > gcc complier: gcc-4.3
>> > The BLAS ALTAS LAPACK are installed
>> >
>> > Regards.
>> >
>> > ======
>> > Song Yang
>> > Ph.D student
>> > Department of Photonics and
>> > Institute of Electro-Optical Engineering
>> > National Chiao Tung University
>> > 1001 Tahsueh Rd., Hsinchu 30050, Taiwan
>> > Tel.: +886-3-5712121 ext.56310
>> > Fax: +886-3-5716631
>> > e-mail: onionys at gmail.com
>> >
>> > _______________________________________________
>> > Sax-project-users mailing list
>> > Sax-project-users at qe-forge.org
>> > http://qe-forge.org/mailman/listinfo/sax-project-users
>> >
>> >
>
>