[Pw_forum] Default values used in Quantum espresso manuals
Shaptrishi Sharma
sh.shapt at gmail.com
Mon Aug 31 11:49:23 CEST 2009
Hi There,
I am a new user in quantum espresso , thus I would like to ask one question
how do the default values in the quantum espresso manuals have been choosed?
I mean to say that in quantum espresso manuals we find
forc_conv_thr =1.0D-3
conv_thr =1.0D-6
etot_conv_thr=1.0D-4
How did the values calculated?
Thanks
Shaptarishi
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.democritos.it/pipermail/pw_forum/attachments/20090831/23296440/attachment.htm
More information about the Pw_forum
mailing list