[molpro-user] Compiling molpro Solaris 9

Fri Aug 4 14:53:06 BST 2006

Dear Martin,

It seems that the default in getmachine for sun4u is to use f77
compiler, which is probably a wrapper and simply calls 'f90 -f77'.
Somehow this seems to be incompatible. I will report this as a bug. In
the meantime, you could try to change 'f77' to 'f90' in
utilities/getmachine:340  . Please let me know if this helps.

Cheers,

Sasha

-- 
Dr. Alexander O. Mitrushchenkov

Universitaet Stuttgart
Institut fuer Theoretische Chemie
Pfaffenwaldring 55
D-70569 Stuttgart
Germany

Tel +49 (0)711 / 685-64409
Fax +49 (0)711 / 685-64442
e-mail: sasha at theochem.uni-stuttgart.de

On Fri, 2006-08-04 at 15:34 +0200, Martin Weise wrote: 
> Hello Sascha
> 
> I tried it to compile with '-i8', but configure produces an error message (see
> below):
> 
> ./configure -f90 -i8 -f '' 
> getmachine was unable to identify your operating system correctly.
> NOTICE: Invoking /opt/SUNWspro/bin/f90 -f77 -ftrap=%none -o machine.exe
> machine.f mctype.o
> machine.f:
>  MAIN machine:
> 	fehler:
> 	save_all_files:
> gmake: Nothing to be done for `default'.
> Setting up integer*8 version; if you want integer*4, use configure -i4
> NOTICE: Invoking /opt/SUNWspro/bin/f90 -f77 -fast -ftrap=%none
> -xtypemap=real:64,double:64,integer:64 -xarch=v9a -o machine.exe machine.f mctype.o
> machine.f:
>  MAIN machine:
> 	fehler:
> 	save_all_files:
> ld: elf error: file /opt/SUNWspro/prod/lib/libfsu.a(__xargc.o): elf_getshdr:
> Request error: class file/memory mismatch
> ld: elf error: file /opt/SUNWspro/prod/lib/libfsu.a(__xargv.o): elf_getshdr:
> Request error: class file/memory mismatch
> ld: warning: file /opt/SUNWspro/prod/lib/libfsu.a(f90_init.o): wrong ELF class:
> ELFCLASS32
> ld: fatal: File processing errors. No output written to machine.exe
> ln: cannot access ./machine.exe
> gmake: *** [machine.exe] Error 2
> gmake: Nothing to be done for `default'.
> ./configure: utilities/machine.exe: not found
> If you believe the error is not your fault,
> then email the molpro mailing list at molpro-user at molpro.net, specifying operating
> system type and version, compiler type and version and any other
> information which would be useful. Exiting ...
> 
> 
> This is the output of uname an my compiler version:
> 
> 'f90 -V' ==> f90: Sun Fortran 95 7.1 2003/03/12
> 'uname -a' ==> SunOS kopernikus 5.9 Generic_117171-12 sun4u sparc
> 
> 
> When I tried to compile the mctype.c by hand, I realized that the '-f77' causes
> the error, but I don't know where to change the flags, so that it compiles
> correctly.
> 
> Regards
>  Martin Weise
> 
> Quoting Alexander Mitrushenkov <sasha at theochem.uni-stuttgart.de>:
> 
> > Hello Matrin,
> > 
> > As you can see on molpro webpage, Solaris 9 is a supported architecture
> > for molpro, provided the compiler is recent enough. It seems that you
> > have UltraSparcIII architecture, is this correct? Why don't you compile
> > 64-bit version of molpro (./configure -i8)? Can you specify your
> > compiler version so we could look at the problem? It seems that your
> > compiler does not like 'SIZE' intrinsic, which is required in molpro
> > code.
> > 
> > Thanks,
> > 
> > Sasha
> > -- 
> > Dr. Alexander O. Mitrushchenkov
> > 
> > Universitaet Stuttgart
> > Institut fuer Theoretische Chemie
> > Pfaffenwaldring 55
> > D-70569 Stuttgart
> > Germany
> > 
> > Tel +49 (0)711 / 685-64409
> > Fax +49 (0)711 / 685-64442
> > e-mail: sasha at theochem.uni-stuttgart.de
> > 
> > 
> > On Thu, 2006-08-03 at 11:45 +0200, Martin Weise wrote:
> > > Hello 
> > > 
> > > I have a problem compiling molpro2006.1 on Solaris 9.
> > > I use the Solaris f90 compiler, and configured molpro with
> > > the following flags: -f90 -i4
> > > 
> > > I had to use the i4-flags, as I was not able to get it configured and
> > > the compile to run.
> > > 
> > > Furthermore I had to add the following entry 
> > > 
> > >     NO_OPT="blas/lapack1.f basis/basis_contract.f"
> > > 
> > > to the CONFIG file, as I do not have 10GB of swap. (basis/basis_contract.f
> > was
> > > added)
> > > 
> > > So when compiling these settings I get the following error:
> > > 
> > > sapt.f90: preprocessing ... compiling ... failed:
> > > f90 -dalign -c -I. -M../global -fast -ftrap=%none -xarch=v8plusb -fsimple=2
> > sapt.f90
> > > 
> > >   use dmmult
> > >       ^      
> > > "sapt.f90", Line = 9, Column = 7: ERROR: No specific intrinsic exists for
> > the
> > > intrinsic call "SIZE".
> > > 
> > >   use dmmult
> > >       ^      
> > > "sapt.f90", Line = 75, Column = 7: ERROR: No specific intrinsic exists for
> > the
> > > intrinsic call "SIZE".
> > > 
> > >   use dmmult
> > >       ^      
> > > "sapt.f90", Line = 291, Column = 7: ERROR: No specific intrinsic exists for
> > the
> > > intrinsic call "SIZE".
> > > 
> > >   use dmmult
> > >       ^      
> > > "sapt.f90", Line = 480, Column = 7: ERROR: No specific intrinsic exists for
> > the
> > > intrinsic call "SIZE".
> > > 
> > >   use dmmult
> > >       ^      
> > > "sapt.f90", Line = 894, Column = 7: ERROR: No specific intrinsic exists for
> > the
> > > intrinsic call "SIZE".
> > > 
> > >   use dmmult
> > >       ^      
> > > "sapt.f90", Line = 986, Column = 7: ERROR: No specific intrinsic exists for
> > the
> > > intrinsic call "SIZE".
> > > 
> > > f90comp: 1292 SOURCE LINES
> > > f90comp: 6 ERRORS, 0 WARNINGS, 0 OTHER MESSAGES, 0 ANSI
> > > gmake[3]: *** [sapt.o] Error 1
> > > sapt_driver.f90: preprocessing ... compiling ... done
> > > utils_sapt.f90: preprocessing ... compiling ... done
> > > gmake[3]: Leaving directory
> > > `sources/molpro2006.1/molpro2006.1/src/sapt'
> > > gmake[2]: *** [objects] Error 2
> > > gmake[2]: Leaving directory
> > > `sources/molpro2006.1/molpro2006.1/src/sapt'
> > > gmake[1]: *** [sapt] Error 2
> > > gmake[1]: Leaving directory
> > > `sources/molpro2006.1/molpro2006.1/src'
> > > gmake: *** [src] Error 2
> > > 
> > > 
> > > Actually I have no idea what to do what that error message. Is something
> > missing
> > > or wrong? 
> > > 
> > > Regards
> > >  Martin Weise
> > > 
> > > -------------------------------------------------
> > > This mail sent through IMP: http://horde.org/imp/
> > > 
> > 
> > 
> > 
> 
> 
> 
> 
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