[Wien] lapwso crash

[Peter Blaha]

Wrong case.inso file ???

Am 08.02.2012 20:49, schrieb Nilton:
> Dear wien users,
>
> I am calculating band structure of PbS with SO coupling. When I run
> lapwso I got the error mensage
> ----------------------------------------------------------------------------------------------------------------------
> [nilton at bodesking case]$ x lapwso
> forrtl: severe (174): SIGSEGV, segmentation fault occurred
> Image              PC                Routine            Line        Source
> lapwso             000000000040E8DF  Unknown               Unknown  Unknown
> lapwso             0000000000422B14  Unknown               Unknown  Unknown
> lapwso             00000000004002EC  Unknown               Unknown  Unknown
> lapwso             0000000000E7A840  Unknown               Unknown  Unknown
> lapwso             00000000004001B9  Unknown               Unknown  Unknown
> 0.005u 0.000s 0:00.00 0.0%      0+0k 0+0io 0pf+0w
> error: command   /home/nilton/wien2k/lapwso lapwso.def   failed
>
>
> My sistem is an xeon quadcore PC. The lapwso was compiled with intel
> fortran composerxe-2011.2.137 and the OPTIONS is
>
> -------------------------------------------------------------------------------------------------------------
> current: FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML
> -traceback -I$(MKLROOT)/include/intel64/lp64 -I$(MKLROOT)/include
> current: FPOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback
> current: LDFLAGS:$(FOPT) -L$(MKLROOT)/lib/intel64 -static -pthread
> current: DPARALLEL:'-DParallel'
> current: R_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_cdft_core.a
> $(MKLROOT)/lib/intel64/libmkl_intel_lp64.a
> $(MKLROOT)/lib/intel64/libmkl_intel_thread.a
> $(MKLROOT)/lib/intel64/libmkl_core.a
> $(MKLROOT)/lib/intel64/libmkl_blacs_lp64.a -Wl,--end-group -openmp
> -lpthread -lm
> current: RP_LIBS:/usr/local/fftw/lib/libfftw_mpi.a
> /usr/local/fftw/lib/libfftw.a /home/nilton/mpich-1.2.7p1/lib/libmpich.a
> $(R_LIBS)
> current: MPIRUN:mpirun -np _NP_ -machinefile _HOSTS_ _EXEC_
> ------------------------------------------------------------------------------------------------------
>
> I have tried to recompile with dynamic libraries and the crash still remain.
> Thanks in advance for any help.
> Nilton
> --
> Nilton S. Dantas
> Universidade Estadual de Feira de Santana
> Departamento de Ciências Exatas
> Área de Informática
> Av. Transnordestina, S/N, Bairro Novo Horizonte
> CEP 44036900 - Feira de Santana, Bahia, Brasil
> Tel./Fax +55 75 31618086
> http://www2.ecomp.uefs.br/ <http://www.uefs.br/portal>
>
>
>
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-- 
Peter Blaha
Inst.Materials Chemistry
TU Vienna
Getreidemarkt 9
A-1060 Vienna
Austria
+43-1-5880115671