Dear Marcos, I am not familiar with the upf format,and try to find the rc's，but failed.
Thank you all the same. 2010-09-28 Guangping Zhang 发件人: Marcos_Veríssimo_Alves <[email protected]> 发送时间: 2010-09-28 21:09 主 题: Re: [SIESTA-L] How to convert pseudopotential file in upf format used in ATK to psf format used in siesta 收件人: [email protected] Hi Guangping, I'm not aware of any conversion tool UPF -> Siesta psf. Maybe the best way would be to take the cutoff radii and generate a pseudo with these cutoff radii with ATOM. Good luck, Marcos On Tue, Sep 28, 2010 at 2:48 PM, Guangping Zhang <[email protected]> wrote: Deat siesta users: Now I have to convert pseudopotential file in *.upf format used in ATK to *.psf format used in siesta. I google for a whole day, and have no result. Anyone can solve this question? ANY ADVICE IS WELLCOME! Thank in advance! 2010-09-28 Guangping Zhang
