[Wien] core dumped

[Gavin Abo]

Hi Susanta,

It looks like you are using update 7 of composer xe:

l_fcompxe_intel64_2011.*7*.256

First, try compiling with -O1 instead of -O2.

If you still get an error, it is probably another broken version 12 of 
the ifort compiler for Wien2k.

Update 3 seems to be stable,

l_fcompxe_intel64_2011.3.174

If you want to save time, try compiling with update 3 and the -O1.

Gavin

On 11/10/2011 6:05 AM, susanta mohanta wrote:
> Dear Prof. Blaha and wien2k users,
>
> I have successfully compiled wien2k 11.1 (current) version with Fedora 
> 15 in intel i7 (6 cores, 12 processors) machine.
> While running a test case in lapw1 its showing core dumped and 
> lapw1.def failed. My compiler options are as below
>
> current:FOPT:-FR -w -mp1 -prec_div -pad -ip -O2 -DINTEL_VML -traceback
>
> current:FPOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback
>
> current:LDFLAGS:$(FOPT) -L/opt/intel/composer_xe_2011_sp1/lib/intel64 
> -lsvml -openmp -lpthread
>
> current:DPARALLEL:'-DParallel'
>
> current:R_LIBS:-L/opt/intel/composer_xe_2011_sp1/mkl/lib/intel64 
> -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -openmp -lpthread
>
>
> error: command   /home/surendra/wien2k/lapw1 uplapw1.def   failed
> 56.313u 1.337s 0:16.06 358.9%	0+0k 0+2296io 0pf+0w
> >    lapw1  -up    	(17:20:45) Abort (core dumped)
> >    lapw0 	(17:20:13) 31.238u 0.175s 0:31.57 99.4%	0+0k 0+7400io 0pf+0w
>
>      cycle 1 	(Thu Nov 10 17:20:13 IST 2011) 	(400/99 to go)
>
>      start 	(Thu Nov 10 17:20:13 IST 2011) with lapw0 (400/99 to go)
>
>
> using WIEN2k_11.1 (Release 14/6/2011) in /home/surendra/wien2k
> on mishra with PID 4120
> Calculating Sm_Cr in /root/wien_simuls/Sm_Cr
>
>
>
> I am using the current ifort i.e. composer_xe_2011_sp1 
> (l_fcompxe_intel64_2011.7.256).
> can anyone suggest what can be the problem ?
>
> thanking in advance
> with regards
> susanta
>
>
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