[Pw_forum] Convergence threshold

Paolo Giannozzi giannozz at nest.sns.it
Sat Apr 9 17:36:29 CEST 2005


On Thursday 07 April 2005 20:03, Carlo Sbraccia wrote:

> when you do a structural relaxation (as, I think, you are doing) the
> convergence threshold is set automatically by the algorithm according 
> to the level of convergence achieved in the structural relaxation

I just noticed that once upon a time the (updated) convergence threshold 
was printed at each scf step, but it isn't any longer

Paolo 




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