I must publicize my own; there are INP and psf files on a freely downloadable zip file. The description of the process is also free for download at an accompanying paper.
-Salvador http://www.sciencedirect.com/science/article/pii/S2352340914000353 From: [email protected] <[email protected]> on behalf of I. Camps <[email protected]> Sent: Saturday, June 11, 2016 7:29 AM To: [email protected] Subject: Re: [SIESTA-L] siesta pseudo potential 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<https://urldefense.proofpoint.com/v2/url?u=http-3A__www.nnin.org_research-2Dsupport_computation_nnin-2Dcomputation-2Dnanotechnology-2Dresources_virtual-2Dvaults&d=CwMFaQ&c=JL-fUnQvtjNLb7dA39cQUcqmjBVITE8MbOdX7Lx6ge8&r=n_Y76F1vumEs9EYNHN2gzA5FD9jzyPhrzl3eOzxCHIQ&m=_S1mFlgSFvrlrW520D2XGGAs6nEl67g5Sd-lpvAX1zE&s=0C0aa0GdDJ_CWZ4aAzXL-Cqn-ERVYTllGbQa08lZkOI&e=> 2-) Octopus pseudopotential generator http://www.tddft.org/programs/octopus/pseudo.php<https://urldefense.proofpoint.com/v2/url?u=http-3A__www.tddft.org_programs_octopus_pseudo.php&d=CwMFaQ&c=JL-fUnQvtjNLb7dA39cQUcqmjBVITE8MbOdX7Lx6ge8&r=n_Y76F1vumEs9EYNHN2gzA5FD9jzyPhrzl3eOzxCHIQ&m=_S1mFlgSFvrlrW520D2XGGAs6nEl67g5Sd-lpvAX1zE&s=tB_Ut1LIdQI8LZ6_5giTVG01ILLjxCnryd1lg62KQUA&e=> []'s, Camps On Sat, Jun 11, 2016 at 4:52 AM, ZARA NBSH <[email protected]<mailto:[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<https://urldefense.proofpoint.com/v2/url?u=http-3A__departments.icmab.es_leem_siesta_Databases_Pseudopotentials_periodictable-2Dintro.html&d=CwMFaQ&c=JL-fUnQvtjNLb7dA39cQUcqmjBVITE8MbOdX7Lx6ge8&r=n_Y76F1vumEs9EYNHN2gzA5FD9jzyPhrzl3eOzxCHIQ&m=_S1mFlgSFvrlrW520D2XGGAs6nEl67g5Sd-lpvAX1zE&s=X6OShl1L3jtmQsMpmqMgkAks9AFFOBvHWN5UoYzd0Eg&e=>, there is only one PP example for each atom. WBR Zara
