[Wannier] not generating lead.wout after modification
Zeina Al-Dolami
zaldolam at email.uark.edu
Mon Nov 3 22:06:09 CET 2014
Dear Giovanni,
Thanks so much for your quick response. I followed what you mentioned, but
the file lead.wout was not generated. The job script is shown below. What
is the problem? Is it installation issue or something else? Please let me
know if you have any idea or suggestions. Many thanks in advance. Thanks to
everyone who is willing to help
Zeina Al-Dolami
PhD Candidate in MEPH
University of Arkansas
Fayetteville, AR 72703
#/bin/sh
#PBS -N serialjob
#PBS -q serial8core
#PBS -j oe
#PBS -m abe
#PBS -M zaldolam at uark.edu
#PBS -o wannier.$PBS_JOBID.serial8core
#PBS -l nodes=1:ppn=1
#PBS -l walltime=01:00:00
#submitted from
cd $PBS_O_WORKDIR
#run program
/share/apps/espresso/espresso-5.1/bin/wannier90.x lead.win
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