[Wien] Problem to run Wien2k in parallel mode
Matheus Lessa .
lessa_matheus at hotmail.com
Tue May 15 21:00:08 CEST 2012
Hello fellows,I've been trying to run Wien2k in parallel mode and, after finally succeed, inadvertently I delete the .Machines file and since then, I think because of that, I haven't more achieved run the application in parallel mode. In serial mode it usually occurs without errors.Does anyone have any idea what might be happening?Below is some information that may be important.
OPTIONS File: current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback -I/opt/ intel/Compiler/11.1/080/mkl/lib/em64t -i-static current:FPOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback -I/opt /intel/Compiler/11.1/080/mkl/include -i-static current:LDFLAGS:$(FOPT) -L/opt/intel/Compiler/11.1/080/mkl/lib/em64t -pthread -i -static current:DPARALLEL:'-DParallel' current:R_LIBS:-lmkl_lapack95_lp64 -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_cor e -openmp -lpthread -i-static current:RP_LIBS:-lmkl_scalapack_lp64 -lmkl_solver_lp64 -lmkl_blacs_lp64 -L/home/ admin/libs/fftw/lib/ -lfftw_mpi -lfftw $(R_LIBS) current:MPIRUN:mpirun -np _NP_ -machinefile _HOSTS_ _EXEC_
.machines file: granularity:1 1:zumbi:4 1:no0:4 residue:zumbi
The system is formed by two identical machines with: Intel Quad-Core processor, 8GB RAM Memory, Oracle Grid Engine,MPICH2 1.4 with MPD, Ifort 11.1 with MKL and FFTW, BLAS,BLACS,Lapack and Scalapack libraries.The Zumbi node is the main node.
The error exit is:
[admin at zumbi gaas]$ run_lapw -p LAPW0 END gaas.scf1_1: FNo such file or directory FERMI - Error cp: impossible to get state of ".in.tmp": No such file or directory rm: wasn't possible to remove ".in.tmp":No such file or directory rm: wasn't possible to remove ".in.tmp1": No such file or directory
> stop error
lapw2.error file Error in LAPW2 'LAPW2' - can't open unit: 30 'LAPW2' - filename: gaas.energy_1 ** testerror: Error in Parallel LAPW2
P.S: The compilation occurs without errors or warningsThanks for everyone's attention.
MLessaComputer Science StudentFederal University of Bahia
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