that.
Now I change my script as "runsp_lapw -p -ec 0.001"
Please let me know whether that is correct?
Thank you for your attention
Chami
On Tue, 2/28/17, Gavin Abo <gs...@crimson.ua.edu> wrote:
Subject: Re: [Wien] Wien2k-paralle
u for your attention
Chami
On Tue, 2/28/17, Gavin Abo <gs...@crimson.ua.edu> wrote:
Subject: Re: [Wien] Wien2k-parallel calculation
To: "A Mailing list for WIEN2k users" <wien@zeus.theochem.tuwien.ac.at>
Date: Tuesday, February 2
I'm doubtful that anyone can help with the information that you have
provided.
I assume those scripts like qsub168h_1c are calling your optimize.job
file. If I remember correctly, the default optimize.job is generated
from a template for a serial calculation. The first thing to check
would
Dear developers
I am using WIEN2k module which I am using is in a supercomputer located
elseware and I remotely use it. I don't have a way to create my own machine
files, instead I use prepared machine files by them. They have linked those
scripts to my interface with different options. (such
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