Many thanks,
Zara

On Sat, Jun 11, 2016 at 4:59 PM, I. Camps <[email protected]> wrote:

> Dear,
>
> You always can use the programs ATOM that comes with the SIESTA distro
> (you have to compile separately) and generate your own pseudos.
>
> Also, there are websites that can helps you:
>
> 1-) Virtual Vault for Pseudopotentials and PAW Datasets
>
> http://www.nnin.org/research-support/computation/nnin-computation-nanotechnology-resources/virtual-vaults
>
> 2-) Octopus pseudopotential generator
> http://www.tddft.org/programs/octopus/pseudo.php
>
>
> []'s,
>
> Camps
>
> On Sat, Jun 11, 2016 at 4:52 AM, ZARA NBSH <[email protected]> wrote:
>
>> Dear all,
>> Is there any collection and database of siesta pseudopotentials? or any
>> program to convert other PP to *.psf file ?
>> In the siesta page
>> <http://departments.icmab.es/leem/siesta/Databases/Pseudopotentials/periodictable-intro.html>,
>> there is only one PP example for each atom.
>>
>> WBR
>> Zara
>>
>
>

Responder a