[Pw_forum] Geometry Optimization
Lorenzo Paulatto
paulatto at sissa.it
Thu Aug 6 12:24:48 CEST 2009
In data 06 agosto 2009 alle ore 12:22:50, xirainbow
<nkxirainbow at gmail.com> ha scritto:
> I think vc-relax tries to minimize stress, energy and force at the same
> time.
> And there is a parameter "*forc_conv_thr*".
> Am I wrong?
You are right, there are also etot_conv_thr and press_conv_thr, although
the latter is not in the same namelist as the others.
cheers
--
Lorenzo Paulatto
SISSA & DEMOCRITOS (Trieste)
phone: +39 040 3787 511
skype: paulatz
www: http://people.sissa.it/~paulatto/
*** save italian brains ***
http://saveitalianbrains.wordpress.com/
More information about the Pw_forum
mailing list