[QE-users] L-ACE
Pietro Delugas
pdelugas at sissa.it
Mon Mar 4 16:58:15 CET 2019
Hi
Yes
ACE is the default, so no need to activate it. As for the localization
it is enough to specify localization_thr > 0.
Pietro
On 04/03/19 16:30, Michal Krompiec wrote:
> Hello,
> How do I activate L-ACE in QE 6.4? Just by using ACE and specifying
> non-zero localization_thr, for example 0.004 as in the paper
> https://doi.org/10.1088/2516-1075/aaf7d4 ?
> Thanks,
> Michal Krompiec
>
> Adjunct Professor
>
> School of Chemistry, University of Southampton
>
> Highfield, Southampton SO17 1BJ, UK
>
>
> and
>
> Head of Computational Modelling | Performance Materials | Early
> Research and Business Development
>
> Merck
>
>
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