[Wien] Segmentation fault in LAPW1

[swati chaudhury]

Hi,
  Error is due to compilation problem. It is better to you to use ifort 10 and mkl 9 combination.
  Wish you best of luck.
  Regards.
  swati

Dimitris Kechrakos <dkehrakos at ims.demokritos.gr> wrote:
  Dear all,

I have installed Wien2K_8.2 on an Intel(R) Core(TM)2 Quad Q6600 @ 2.40GHz, 4GB RAM using 

system = K [ ie Linux (Intel ifort 10.1 compiler + mkl 10.0 )] (installed ifort 10.1.012, mkl 10.0.1.0.14)
and options :
O Compiler options: -FR -w -O3 -traceback
L Linker Flags: -L/opt/intel/fc/10.1.012/lib -lguide -lpthread
P Preprocessor flags ' '
R R_LIB (LAPACK+BLAS): -L/opt/intel/mkl/10.0.1.014/lib/32 
-I/opt/intel/mkl/10.0.1.014/include -lmkl_lapack -lmkl_ia32 -lmkl_core -lm

No error message appeared during compilation and linking. (Checked all */compile.msg files !)

I tried the example TiC , but I get the following message:

-------------------------------------------------------------------------------

cd /home/dimitris/Research/lapw/TiC;run_lapw -cc 0.001 -NI 
LAPW0 END
forrtl: severe (174): SIGSEGV, segmentation fault occurred
Image PC Routine Line Source 
lapw1 085AECDD Unknown Unknown Unknown
. FFFFE440 Unknown Unknown Unknown
lapw1 0805935B calkpt_ 154 calkpt_tmp_.F
lapw1 080780E6 MAIN__ 52 lapw1_tmp_.F
lapw1 08053751 Unknown Unknown Unknown
libc.so.6 40846FE0 Unknown Unknown Unknown
lapw1 080536B1 Unknown Unknown Unknown

> stop error

-------------------------------------------------------------------------------

Any suggestions appreciated !

DK


----------------------------------------------------------

Dr Dimitris Kechrakos
Institute of Materials Science 
National Center of Scientific Research "Demokritos"
153 10 - Agia Paraskevi
Athens, GR
tel: +30-210-650 3337 
fax: +30-210-653 3872
email: dkehrakos at ims.demokritos.gr, physengin at gmail.com

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