Dear All
I tried to install the latest trunk version 515. I successfully compiled
SIESTA, but I had problems with transiesta.
This is the error:
"...
libmpi_f90.a \
`FoX/FoX-config --libs --wcml`
/opt/intel/mkl/lib/intel64/libmkl_blas95_lp64.a
/opt/intel/mkl/lib/intel64/libmkl_lapack95_lp64.a
/opt/intel/mkl/lib/intel64/libmkl_scalapack_lp64.a -Wl,--start-group
/opt/intel/mkl/lib/intel64/libmkl_intel_lp64.a
/opt/intel/mkl/lib/intel64/libmkl_core.a
/opt/intel/mkl/lib/intel64/libmkl_sequential.a -Wl,--end-group
/opt/intel/mkl/lib/intel64/libmkl_blacs_intelmpi_lp64.a -lpthread -lm
m_ts_voltage.o: In function `ts_init_voltage':
*/home/rfaccio/siesta-trunk-515/Src/m_ts_voltage.F90:86: undefined
reference to `ts_ncdf_voltage_asassert_'*
..."
The arch.make is attached.
Thanks in advance
Best regards
Ricardo
--
-------------------------------------------------------------------------
Dr. Ricardo Faccio
Prof. Agregado de Física (Assoc. Prof.)
Mail: Cryssmat-Lab., Cátedra de Física, DETEMA
Facultad de Química, Universidad de la República
Av. Gral. Flores 2124, C.C. 1157
C.P. 11800, Montevideo, Uruguay.
E-mail: [email protected]
Phone: (+598) 2924 9859
(+598) 2929 0648
Fax: (+598) 2924 1906
Web: http://cryssmat.fq.edu.uy/ricardo/ricardo.htm
#
# This file is part of the SIESTA package.
#
# Copyright (c) Fundacion General Universidad Autonoma de Madrid:
# E.Artacho, J.Gale, A.Garcia, J.Junquera, P.Ordejon, D.Sanchez-Portal
# and J.M.Soler, 1996- .
#
# Use of this software constitutes agreement with the full conditions
# given in the SIESTA license, as signed by all legitimate users.
#
.SUFFIXES:
.SUFFIXES: .f .F .o .a .f90 .F90
#SIESTA_ARCH=x86_64-unknown-linux-gnu--Intel
SIESTA_ARCH=intel -mkl
FPP=
FPP_OUTPUT=
#FC=ifort -mkl -m64
#FC=mpiifort
FC=mpiifort -DMPI
RANLIB=ranlib
FC_SERIAL=ifort
SYS=nag
SP_KIND=4
DP_KIND=8
KINDS=$(SP_KIND) $(DP_KIND)
MKLROOT=/opt/intel/mkl
#FFLAGS=-g -mtune=core2 -O3 -ax -w -strict
FFLAGS=-I$(MKLROOT)/include/intel64/lp64 -I$(MKLROOT)/include -g -O1 -ip
-xSSE4.2 -static-intel
#FFLAGS=-I$(MKLROOT)/include/intel64/lp64 -I$(MKLROOT)/include -g -O3 -xSSE4.2
#FFLAGS=-I$(MKLROOT)/include/intel64/lp64 -I$(MKLROOT)/include -O3 -xHost -ip
-prec-div -prec-sqrt -opt-prefetch
FPPFLAGS=-DFC_HAVE_FLUSH -DFC_HAVE_ABORT
#LDFLAGS=-static -L/opt/intel/mkl/lib/intel64/
#LDFLAGS=static-intel -L$(MKLROOT)/lib/intel64/
LDFLAGS=
ARFLAGS_EXTRA=
FCFLAGS_fixed_f=
FCFLAGS_free_f90=
FPPFLAGS_fixed_F=
FPPFLAGS_free_F90=
#BLAS_LIBS=-L/opt/intel/mkl/lib/intel64/ -lmkl_blas95_lp64
#LAPACK_LIBS=-L/opt/intel/mkl/lib/intel64/ -lmkl_lapack95_lp64
-lmkl_intel_lp64 -lmkl_intel_thread -lguide -lmkl_core -lpthread
#BLACS_LIBS=
#SCALAPACK_LIBS=-L/opt/intel/mkl/lib/intel64/ -lmkl_intel_lp64
-lmkl_scalapack_lp64 -lmkl_sequential
#INTEL_LIBS=$(MKLROOT)/lib/intel64/libmkl_blas95_lp64
$(MKLROOT)/lib/intel64/libmkl_lapack95_lp64 -L$(MKLROOT)/lib/intel64
-lmkl_intel_lp64 -lmkl_core -lmkl_sequential -lpthread -lm
#INTEL_LIBS=$(MKLROOT)/lib/intel64/libmkl_blas95_lp64.a
$(MKLROOT)/lib/intel64/libmkl_lapack95_lp64.a -Wl,--start-group
$(MKLROOT)/lib/intel64/libmkl_intel_lp64.a $(MKLROOT)/lib/intel64/libmkl_core.a
$(MKLROOT)/lib/intel64/libmkl_sequential.a -Wl,--end-group -lpthread -lm
INTEL_LIBS=$(MKLROOT)/lib/intel64/libmkl_blas95_lp64.a
$(MKLROOT)/lib/intel64/libmkl_lapack95_lp64.a
$(MKLROOT)/lib/intel64/libmkl_scalapack_lp64.a -Wl,--start-group
$(MKLROOT)/lib/intel64/libmkl_intel_lp64.a $(MKLROOT)/lib/intel64/libmkl_core.a
$(MKLROOT)/lib/intel64/libmkl_sequential.a -Wl,--end-group
$(MKLROOT)/lib/intel64/libmkl_blacs_intelmpi_lp64.a -lpthread -lm
#COMP_LIBS=dc_lapack.a
NETCDF_LIBS=
NETCDF_INTERFACE=
#LIBS=$(SCALAPACK_LIBS) $(BLACS_LIBS) $(LAPACK_LIBS) $(BLAS_LIBS) $(GUIDE_LIBS)
-lpthread
LIBS=$(INTEL_LIBS)
#SIESTA needs an F90 interface to MPI
#This will give you SIESTA's own implementation
#If your compiler vendor offers an alternative, you may change
#to it here.
MPI_INTERFACE=libmpi_f90.a
MPI_INCLUDE=.
#Dependency rules are created by autoconf according to whether
#discrete preprocessing is necessary or not.
.F.o:
$(FC) -c $(FFLAGS) $(INCFLAGS) $(FPPFLAGS) $(FPPFLAGS_fixed_F) $<
.F90.o:
$(FC) -c $(FFLAGS) $(INCFLAGS) $(FPPFLAGS) $(FPPFLAGS_free_F90) $<
.f.o:
$(FC) -c $(FFLAGS) $(INCFLAGS) $(FCFLAGS_fixed_f) $<
.f90.o:
$(FC) -c $(FFLAGS) $(INCFLAGS) $(FCFLAGS_free_f90) $<
