[Wien] error in parallel lapw2
BUSHRA SABIR
b_sabir437 at yahoo.com
Sat Oct 20 09:58:28 CEST 2018
Dear Peter Blaha and wien2k users
I am facing one problem in parallel execution of job script. I am working on LaXO3 materials. initialization is ok but when i submitted job file on cluster for parallel execution with command line runsp_lapw -cc 0.001 -ec 0.0001 -i 40 -p .
following error apears.cat *.error
'LAPW2' - can't open unit: 18
'LAPW2' - filename: LAO.vspup
'LAPW2' - status: old form: formatted
** testerror: Error in Parallel LAPW2
file LAO.vspup is missing, i think it automatically generated during parallel lapw2
i checked testpara1_lapw#####################################################
# TESTPARA1 #
#####################################################
Sat Oct 20 00:22:39 PDT 2018
lapw1para has finished
for testpara2_lapw#####################################################
# TESTPARA1 #
#####################################################
Sat Oct 20 00:22:39 PDT 2018
lapw1para has finished
At the end of day file following error is shown
0.088u 0.060s 0:05.14 2.7% 0+0k 0+288io 0pf+0w
> lapw2 -up -p (23:56:15) running LAPW2 in parallel mode
** LAPW2 crashed!
0.048u 0.312s 0:00.72 48.6% 0+0k 11386+96io 36pf+0w
error: command /global/common/sw/cray/cnl6/haswell/wien2k/17.1/intel/17.0.2.174/wkteycp/lapw2para -up uplapw2.def failed
i go through mailing list but could not find solution.
BushraPhD student
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