[molpro-user] The optimal number of helper processes in parallel Molpro runs

Manhui Wang wangm9 at cardiff.ac.uk
Wed May 22 13:09:28 BST 2013


Dear Evgeniy,

The default setting, i.e., one helper process per SMP node (option 
*--node-helper-server*), is generally good.
More details can be seen at
http://www.molpro.net/info/2012.1/doc/manual/node9.html

Best regards,
Manhui

On 22/05/13 10:45, Evgeniy Gromov wrote:
> Dear Developers and Users of Molpro,
>
> I have a question concerning the helper processes used in parallel
> runs of Molpro. What would be the optimal number of such processes
> (perhaps one per each main processes)?
>
> Best regards,
> Evgeniy
>

-- 
-----------
Manhui  Wang
School of Chemistry, Cardiff University,
Main Building, Park Place,
Cardiff CF10 3AT, UK

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