<p dir="ltr">If you know how to edit the optimize.job script, just use the -NI option for your run???</p>
<div class="gmail_quote">On Apr 19, 2014 1:16 PM, "<a href="mailto:leithron@gmail.com">leithron@gmail.com</a>" <<a href="mailto:leithron@gmail.com">leithron@gmail.com</a>> wrote:<br type="attribution"><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
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<span style="font-family:Arial">Dear users:<br>
I am doing an optimization with -5 -2 0 2 5 volume change. Now I have finished -5 -2 calculation and the 0 calculation have run 5 cycles, but the electric power will be cut in a few hours so I have to stop it by .stop. My question is can we continue with
the scf from where it stoped(the fifth iteration of 0 volume change calculation) later or do we have to remove the files case.broyd and rerun the optimization of 0 2 5 volume change from beginning again.<br>
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