[Wien] Problem with wien2k 11

Ghosh SUDDHASATTWA ssghosh at igcar.gov.in
Fri Jun 29 05:31:50 CEST 2012


You can see the OPTIONS file. It works very well for me. 

 

current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback

current:FPOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback

current:LDFLAGS:$(FOPT) -L/opt/intel/Compiler/11.1/080/mkl/lib/em64t
-pthread

current:DPARALLEL:'-DParallel'

current:R_LIBS:-lmkl_scalapack_lp64 -lmkl_intel_lp64 -lmkl_intel_thread
-lmkl_co

re -lmkl_blacs_intelmpi_lp64 -openmp -lpthread

current:RP_LIBS:-L$(MKLROOT)/lib/em64t -lmkl_scalapack_lp64 -lmkl_intel_lp64
-lm

kl_intel_thread -lmkl_core -lmkl_blacs_intelmpi_lp64 -openmp -lpthread
-L/opt/en

glibs/fftw-2.1.5/lib -lfftw_mpi -lfftw $(R_LIBS)

current:MPIRUN:mpirun -np _NP_ -machinefile _HOSTS_ _EXEC_

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