[Wien] I still have problem with wienk in parallel mode
Nilton
nilton.dantas at gmail.com
Tue Dec 27 16:43:10 CET 2011
Dear P. Blaha,
sorry but I still have problem with wien in parallel mode.
I try set up the parallel options as you suggested and I got the error
message:
------------------------------------------------------message from
console------------------------------
[nilton at bodesking case]$ run_lapw -p
LAPW0 END
cat: No match.
----------------------------------------------------------------------------------------------------
this is the content of my parallel_options file:
--------------------------------------------------------------------------------------------------------------------
setenv USE_REMOTE 1
setenv WIEN_GRANULARITY 3
setenv WIEN_MPIRUN "mpirun -np _NP_ -machinefile _HOSTS_ _EXEC_"
--------------------------------------------------------------------------------------------------------------------
you can see below that after lapw0 the lapw1c para is running. After this
the run_lapw stop.
-------------------------------------------------from top
---------------------------------------------------------------
PID USER PR NI VIRT RES SHR S %CPU %MEM TIME+
COMMAND
3957 root 15 0 393m 23m 7820 S 1.3 0.2 9:23.18
Xorg
11099 nilton 21 0 66468 1344 884 S 0.7 0.0 0:00.02
lapw1cpara
11038 nilton 15 0 12772 1184 828 R 0.3 0.0 0:00.04
top
11039 nilton 19 0 68684 1448 968 S 0.3 0.0 0:00.02
run_lapw
11090
--------------------------------------------------------------------------------------------------------------------------
----------------------------------------------from
case.dayfile--------------------------------------------------------------------------
Calculating case in
/home/nilton/pesquisa/dftCalc/calWien/gaxtl1-xas/050/case/case
on bodesking.uefs.br with PID 25425
start (Tue Dec 27 12:29:12 BRT 2011) with lapw0 (100/20 to go)
cycle 1 (Tue Dec 27 12:29:12 BRT 2011) (100/20 to go)
> lapw0 -p (12:29:12) starting parallel lapw0 at Tue Dec 27 12:29:12
BRT 2011
--------
running lapw0 in single mode
9.775u 0.276s 0:10.06 99.8% 0+0k 0+0io 0pf+0w
> lapw1 -c -p (12:29:22) starting parallel lapw1 at Tue Dec 27
12:29:22 BRT 2011
-> starting parallel LAPW1 jobs at Tue Dec 27 12:29:22 BRT 2011
running LAPW1 in parallel mode (using .machines)
5 number_of_parallel_jobs
** LAPW1 crashed!
0.643u 0.849s 0:22.63 6.5% 0+0k 0+0io 0pf+0w
error: command /home/nilton/wien2k/lapw1cpara -c lapw1.def failed
> stop error
------------------------------------------------------------------------------------------------------------------
----------------------------from .machines
file-----------------------------------------------------
1:bodesking.uefs.br:4
1:compute-0-0.local:4
1:compute-0-0.local:4
1:compute-0-1.local:4
1:compute-0-1.local:4
Thanks in advance.
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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