[Wien] vol-opt prob of spin-pol hematite again

Nilton nilton at ufba.br
Sat Mar 22 19:32:49 CET 2008


Dear Wien users,

I am facing troubles with compilation of wien2k8 in parallel mode. Below is
the specification  of my system  as well as  the error mensages I  have
got.
My system is a little cluster compound by 7 quad core, 64 bits hardware in
which have 8 GB of RAM, runnning  rocks 4.3 system. I am using ifort
8.0with mkl
9.0, mpich-1.2.7, scalapack-1.8, and blacs. Below you can see the part of my
Makefile where I set the compiler/library, and after the error mensage I
have got. If some one have some suggestion I thanks in advance. On this
same system I have  the serial version of wien2k8 and parallel version of
vasp too.
with best,
Nilton

-----------------------------section of Makefile
------------------------------------

FC = /opt/intel_fce_80/bin/ifort
MPF = /opt/mpich-1.2.1/bin/mpif90
CC = cc
FOPT =  -FR -mp1 -w -xP -prec_div -pc80 -pad -parallel -DINTEL_VML
FPOPT = -FR -mp1 -w -xP -prec_div -pc80 -pad DINTEL_VML
DParallel = '-DParallel'
FGEN = $(PARALLEL)
LDFLAGS = -L/opt/intel_fce_80/lib -lguide -lpthread
R_LIBS = -L/opt/intel/mkl/9.0/lib/em64t -lmkl_lapack -lmkl_em64t
C_LIBS = $(R_LIBS)
RP_LIBS = $(R_LIBS)  -L/usr/local/blacs-wien/lib -lscalapack
-lblacsCinit_MPI-LINUX-0 \
-lblacsF77init_MPI-LINUX-0 -lblacs_MPI-LINUX-0 -L/opt/mpich-1.2.1/lib


---------------------section of error mensages -------------------------
/opt/mpich-1.2.1/bin/mpif90  -o ./lapw1_mpi abc.o atpar.o bandv1.o calkpt.o
cbcomb.o coors.o cputim.o dblr2k.o dgeqrl.o dgewy.o dgewyg.o dlbrfg.o
dsbein1.o dscgst.o dstebz2.o dsyevx2.o dsymm2.o dsyr2m.o dsyrb4.o dsyrb5l.o
dsyrdt4.o dsytrd2.o dsywyv.o dsyxev4.o dvbes1.o eisps.o errclr.o errflg.o
forfhs.o gaunt1.o gaunt2.o gbass.o gtfnam.o hamilt.o hns.o horb.o inikpt.o
inilpw.o lapw1.o latgen.o lmsort.o locdef.o lohns.o lopw.o matmm.o modules.o
nn.o outerr.o outwin.o pdsyevx16.o prtkpt.o prtres.o pzheevx16.o rdswar.o
rint13.o rotate.o rotdef.o seclit.o seclr4.o seclr5.o select.o service.o
setkpt.o setwar.o sphbes.o stern.o tapewf.o ustphx.o vectf.o warpin.o
wfpnt.o wfpnt1.o ylm.o zhcgst.o zheevx2.o zhemm2.o zher2m.o zhetrd2.o
pdsyr2m.o pzher2m.o jacdavblock.o make_albl.o global2local.o par_syrk.o
my_dsygst.o refblas_dtrsm.o seclit_par.o pdgetrf_my.o pzgetrf_my.o
-L/opt/intel_fce_80/lib -lguide -lpthread  -L/opt/intel/mkl/9.0/lib/em64t
-lmkl_lapack -lmkl_em64t   -L/usr/local/blacs-wien/lib -lscalapack
-lblacsCinit_MPI-LINUX-0 -lblacsF77init_MPI-LINUX-0 -lblacs_MPI-LINUX-0
-L/opt/mpich-1.2.1/lib
modules.o(.text+0xfe): In function `parallel_mp_init_parallel_':
: undefined reference to `sl_init_'
modules.o(.text+0x13c): In function `parallel_mp_init_parallelmatrices_':
: undefined reference to `blacs_gridinfo_'
..
...
...
...
..
/usr/local/blacs-wien/lib/libblacs_MPI-LINUX-0.a(bi_f77_get_constants.o)(.data+0x10):
undefined reference to `mpi_null_copy_fn__'
make[1]: *** [lapw1_mpi] Error 1
make[1]: Leaving directory `/state/partition1/wien2k8/sources/SRC_lapw1'
make: *** [rp] Error 2
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