[DFTB-Plus-User] Have you received this post, Installing DFTB+

[Jacek Jakowski]

Well,... the message  from you says that you do not have available  intel
fortran compiler (ifort).
If you are sure that intel compiler  is installed on this machine then you
just need to  run a script (provided by intel, comes with compiler) that
would set all environment variable.

Jacek


On Wed, Nov 9, 2011 at 7:51 AM, Mogus Mochena <mogus.mochena at famu.edu>wrote:

> The system I am trying to install on is a blade-based system. Each node is
> a
> SunBlade x6420 blade running a 2.6.18.8 Linux kernel. Each node contains
> four AMD Opteron Quad-Core 64-bit processors (16 cores in all) on a single
> board, as an SMP unit.
>
> So I chose the make.x86_64-linux-ifort in sysmakes directory. The compiler
> is intel/11.1.
>
> I copied Makefile.user.template Makefile.user. I set the
> ARCH = x86_64-linux-ifort
>
> Then I switched to prg_dftb directory and invoked the command make.
>
> The compilation did not complete. It finished _dependencies.
>
>
> Then, the following error message appears:
>
> make[1]: Leaving directory
>
> `/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/_obj_x86_64-l
> inux-ifort'
> make[1]: Entering directory
>
> `/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/_obj_x86_64-l
> inux-ifort'
> cpp -traditional -DDEBUG=0
>
> -I/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_commo
> n/
> -I/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../includes
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_common/
> accuracy.F90 |
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../utils/fpp/f
> pp.sh nocntln > accuracy.f90
> ifort -O2 -xW -openmp -ip -o accuracy.o -c accuracy.f90
> make[1]: ifort: Command not found
> make[1]: *** [accuracy.o] Error 127
>
>
> MDM
>
>
> The complete compilation message is below:
>
> make[1]: Entering directory
>
> `/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/_obj_x86_64-l
> inux-ifort'
> echo "" > _dependencies
> for dep in
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_common/
> Makefile.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_dftb/Ma
> kefile.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_geoopt/
> Makefile.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_io/Make
> file.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_math/Ma
> kefile.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_md/Make
> file.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_mixer/M
> akefile.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_type/Ma
> kefile.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../includes/Ma
> kefile.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../ext_xmlf90/
> Makefile.dep
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/Makefile.dep
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_math/Ma
> kefile.local; do cpp -traditional -DDEBUG=0 $dep >> _dependencies; done
> make[1]: Leaving directory
>
> `/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/_obj_x86_64-l
> inux-ifort'
> make[1]: Entering directory
>
> `/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/_obj_x86_64-l
> inux-ifort'
> cpp -traditional -DDEBUG=0
>
> -I/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_commo
> n/
> -I/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../includes
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../lib_common/
> accuracy.F90 |
>
> /work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/../utils/fpp/f
> pp.sh nocntln > accuracy.f90
> ifort -O2 -xW -openmp -ip -o accuracy.o -c accuracy.f90
> make[1]: ifort: Command not found
> make[1]: *** [accuracy.o] Error 127
> rm accuracy.f90
> make[1]: Leaving directory
>
> `/work/00898/tg459335/dftb+/dftb+_snapshot-081217_src/prg_dftb/_obj_x86_64-l
> inux-ifort'
> Mogus D Mochena, Ph. D.
> Professor of Physics
> Florida A & M University
> Tallahassee, Fl 32307
> Office: 850-412-5740    FAX: 850:599-3577
>
>
> _______________________________________________
> DFTB-Plus-User mailing list
> DFTB-Plus-User at dftb-plus.info
> http://www.dftb-plus.info/mailman/listinfo/dftb-plus-user
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://mailman.zfn.uni-bremen.de/pipermail/dftb-plus-user/attachments/20111109/875c6cd3/attachment.htm>