[Pw_forum] Did the wfc file must output during the calculation?
Paolo Giannozzi
giannozz at democritos.it
Wed Jun 4 14:56:25 CEST 2008
r95222066 at ntu.edu.tw wrote:
> I had a little question about the wfc file. We all know during the
> igk.* file companyed with the calculation.
do we?
> Because the output
> wfc file was too big to disk space about 100G. That situation cost a
> lot of disk space. So I wondering to know that is there any parameter
> to control the output wfc file.
there are several parameters controlling disk space requirements:
http://www.quantum-espresso.org/wiki/index.php/Performance_issues
This will also be useful:
http://www.quantum-espresso.org/wiki/index.php/Running_on_parallel_machines#Understanding_parallel_I.2FO
Note that if your wavefunction file is 100Gb, you will need at least
100Gb RAM (total, i.e. summed over the processors)
Paolo
--
Paolo Giannozzi, Democritos and University of Udine, Italy
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