[CPMD-list] I can compiling in a cluster

César Carlos Díaz Torrejón ccdiazt at kaliman.iimatercu.unam.mx
Thu May 23 01:29:03 CEST 2002


Hello All:

	Finally I can compiling de cpmdv3.5 using MPI libraries, the change was
using lam-6.5.6 with pgf90 and the next Makefile:

# Author: cluster.iimatercu.unam.mx!ccdiazt
#----------------------------------------------------------------------------
#
SHELL = /bin/sh
#
#--------------- Default Configuration for PC-PGI-MPI ---------------
SRC  = .
DEST = .
BIN  = .
#QMMM_FLAGS = -D__QMECHCOUPL
#QMMM_LIBS  = -L. -lmm
FFLAGS = -Mr8 -pc64 -byteswapio -Msignextend -Msecond_underscore
LFLAGS = -L/usr/pgi/linux86/lib -llapack \
         -L/usr/local/lib/ATLAS -lf77blas -latlas -byteswapio
CFLAGS =
CPP = /lib/cpp -P -C -traditional
CPPFLAGS = -D__Linux -D__PGI -DLAPACK -DFFT_DEFAULT \
               -DPARALLEL -DMP_LIBRARY=__MPI
CC = mpicc -O2 -Wall
FC = mpif77 -c -fast
LD = mpif77 -fast
AR =
#----------------------------------------------------------------------------

and the result is very good. The compilation was very clean.

The libraries liblamf77mpi.a of lam have the mpi_init__ that is a old
problem.

Best Regards

Saludos

C.C.Díaz 
-- 

      _________________________________________________________
 		   Fís. César Carlos Díaz Torrejón
                   Administrador de Sistemas Unix
            Instituto de Investigaciones en Materiales, UNAM
            Oficina: A-007
            e-mail:  ccdiazt at kaliman.iimatercu.unam.mx
            tel:     (5)6224611 (oficina)
       ________________________________________________________





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