The ABINIT Users Mailing List ( CLOSED )

[Masao ARAI <ARAI.Masao@nims.go.jp>]

Dear Pio Baettig,

For my case, the compiler on sr 11000 emits warning messages when 
compiling  CCHI0.F90.

  KCHF249K  08               CCHI0
            the name of a procedure containing an interface block is 
declared
            in the same interface block.

But, the severity code is 8 (not 12) and the compiled binary works fine.
What error message did you get? If possible, please send me the compile log.

Best regards,
Masao Arai

> Dear Abinit-users,
>
> I am trying to compile Abinit on SR11000.
> I read the older messages on the forum (Jan2007) and tried to use the 
> options suggested there, but without success so far.
>
> I tried to use the flags suggested by Prof. Arai (see attached 
> forum-post below, and also tried to enhance them with the 
> compiler-flags  we are using for another code. So far, 'make abinip' 
> always failed.
>
> The compilers that are available are mpixf90 and mpixf90_r (and xf90 
> for serial compilation). Apparently the compilers vary also from 
> SR11000 to SR11000...
>
> The flags I normally used for parallel compilation (HiLAPW) are:
>
> ---
> FC= mpixf90
> FFLAGS= -Os -64 -precexp=4 -nompi -noparallel
> LFLAGS= -64 -noparallel
> LIB= -L/usr/local/lib -lblas_s -llapack_s -noparallel
> ---
>
> So I tried with:
> ./configure --disable-smart-config --enable-64bit-flags \
> --with-mpi-fc="mpixf90 -nohugeary -Os -64 -precexp=4 -nompi \
> -noparallel" --with-mpi-fcflags="-Os -nohugeary -64 -precexp=4 \
> -nompi -noparallel" FC="xf90 -nohugeary -O -64 -precexp=4" FCFLAGS="-O \
> -nohugeary -64 -precexp=4"
>
>
> or some shorter variant (also the original suggestion of Prof. Arai, 
> with the compilers replaced by mpixf90/mpixf90_r and xf90) , and then
>
> make abinip
>
> but the compilation always broke. Unfortunately, the error-messages 
> are not all too helpful.
>
> ------
> *program name = CCHI0
> *program units = 0001, 0013  diagnostics generated, highest severity 
> code is  12
> make: The error code from the last command is 12.
>
>
> Stop.
> make: The error code from the last command is 2.
>
>
> Stop.
> ------
>
> I would be very grateful if someone has an idea on how to get abinip 
> running.
>
>
>
>
>
>
> So far, I tried mostly with abinit 5.3.4.
>
> Abinit 5.4.2 seems to be easier,
> >./configure --with-mpi-fc="mpixf90" FC="xf90"
> >make abinip
> runs (nearly) through, but there seems to be a problem just at the end 
> of the compilation:
> ----
> *program name = WRITE_MOLDYNVALUENETCDF
> *end of compilation : WRITE_MOLDYNVALUENETCDF
> *program units = 0001, 0011  diagnostics generated, highest severity 
> code is  00
>         rm -f lib21drive.a
>         /usr/bin/ar cru lib21drive.a afterscfloop.o brdmin.o 
> delocint.o diisrelax.o driver.o  drivergw.o elpolariz.o gstate.o 
> handle_err_netcdf.o isotemp.o  loop3dte.o moldyn.o move.o  nonlinear.o 
> outscfcv.o scfcv.o  screening.o sigma.o testfi.o  timana.o vtorhotf.o 
> wannier.o  write_header_moldynnetcdf.o  write_moldynvaluenetcdf.o
>         ranlib lib21drive.a
>         cd src/main && make abinip
>         xf90     -o  abinip
> ----
> and it finishes, but there is no abinip in src/main.
>
>
>
>
>
> Thank you very much for any hints.
>
> Best regards,
>
> Pio Baettig
>
> P.S. if further information or a logfile is needed, I can provide 
> them. I did not want to stuff this mail too much.
>
>
>
>
>
>
> ------------------- Original Mail
>
> Thank you for your suggestions.
>
> Now, I succeded in compiling abinit-5.2.4 without any ad hoc hacks.
>
> I used the following configure options.
>
> ../configure --disable-smart-config --enable-64bit-flags \
> --enable-mpi --with-mpi-fc="mpif90_r -nohugeary -O" \
> --with-mpi-fcflags="-O -nohugeary" \
> FC="f90 -nohugeary -O" FCFLAGS="-O -nohugeary"
>
> The option " --disable-smart-config" solves the problem I met at the
> configuration.
>
> In addition, two modification is necessary to compile on sr11000.
>
> (1) The compile option "-nohugeary" must be used. Without this option,
> some intrinsic functions such as "size" return long integer. (This is an
> extension of Hitachi Fortran. I think such extention violates the 
> Fortran90
> standard.) It causes the compile error at several points.
>
> (2) The source code must be corrected as I pointed out in my e-mail 
> sent to
> abinit mailing list on 2006-12-27.