The ABINIT Users Mailing List ( CLOSED )

[Deyu Lu <dylu@ucdavis.edu>]

Yann:
     You are right. I'm using now version 5.1.2 for my "developmental"
purpose, and indeed editing Makefile is inconvenient. I have a .ac file 
under the abinit main folder with the following options in use:

CPP="/usr/ccs/lib/cpp"
ac_cv_path_AR="ar -X64"
CC="xlc_r"
CXX="xlC_r"
with_cxx_optflags= "-O2 -g -qnoipa -q64 -qarch=pwr4 -qtune=pwr4 -qfree -
qalias=noaryovrlp"
with_cxx_ldflags="-L/usr/local/apps/mass -lmassvp4 -lmass"
FC= "mpxlf90_r"
with_fortran_optflags= "-qsuffix=cpp=F90 -O2 -g -qnoipa -q64 -qarch=pwr4
-qtune=pwr4 -qalias=noaryovrlp"
with_fortran_ldflags="-L/usr/local/apps/mass -lmassvp4 -lmass -
L/usr/lpp/ppe.poe/lib -lmpi_r"
enable_mpi="yes"
with_mpi_include="/usr/lpp/ppe.poe/include"
with_mpi_lib="/usr/lpp/ppe.poe/lib"
with_maloc="yes"
with_include_dir="/usr/lpp/ppe.poe/include"
with_mpi_prefix="/usr/lpp/ppe.poe/"
with_mpi_fc="/usr/ccs/lib/cpp"
with_mpi_cppflags="-I/usr/lpp/ppe.poe/include"
with_mpi_cc="mpcc_r"
with_mpi_cxx="mpCC_r"
with_mpi_fc="mpxlf90_r"
with_mpi_fcflags="-qsuffix=cpp=F90 -O2 -g -qnoipa -q64 -qarch=pwr4 -
qtune=pwr4 -qalias=noaryovrlp"
with_mpi_fortran_ldflags="-L/usr/local/apps/mass -lmassvp4 -lmass -
L/usr/lpp/ppe.poe/lib -lmpi_r"
MPI_LDFLAGS="-L/usr/local/apps/mass -lmassvp4 -lmass -
L/usr/lpp/ppe.poe/lib -lmpi_r"
with_mpi_run="/usr/lpp/ppe.poe/bin/poe abinip -np 2"
with_lapack_prefix="/usr/local/apps/scalapack"

Deyu

On Mon, 2006-08-28 at 10:12 +0200, Yann Pouillon wrote:
> Hi,
> 
> Please note that ABINIT 5.1.2 should only be used for development. There are
> still some bugs in the 5.1 build system, as far as compiler detection is 
> concerned.
> 
> Editing the makefile is not a good idea, as it is generated by a script and 
> will
> be overwritten each time you configure the package.
> 
> The right way to proceed with XLF and ABINIT 5.1 is to force the wrapping 
> of the
> Fortran compiler, by using the "--enable-fortran-wrapper" option to the
> "configure" script. You might also have to use some of the "*mpi*" options 
> (just
> type "./configure --help" for a complete list of available options) to have 
> the
> parallel version built.
> 
> Best regards,
> 
> Yann.
> 
> --   
> Yann Pouillon                            UCL/SE/FSA/MAPR/PCPM   
> Tel: +32 (0)10 47 8191                   Batiment Boltzmann, a+1   
> Fax: +32 (0)10 47 3452                   1 place Croix du Sud   
> Mel: pouillon@pcpm.ucl.ac.be             1348 LOUVAIN-LA-NEUVE (Belgique)   
> 
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