[QE-users] L-ACE

[Michal Krompiec]

Thank you very much!

On Mon, 4 Mar 2019 at 15:58, Paolo Giannozzi <p.giannozzi at gmail.com> wrote:

> It is sufficient to specify a nonzero localization threshold
> ("localization_thr"). ACE is the default.
>
> Paolo
>
> On Mon, Mar 4, 2019 at 4:30 PM Michal Krompiec <michal.krompiec at gmail.com>
> 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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>
>
>
> --
> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
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