Re: [SIESTA-L] a request

2012-11-30 Por tôpico Zahra Talebi
hi dear sara as you know in this site which I tried before we need the ascii pseudo-potential output but when I do calculate for lantanium it gave  nothings in the ascii pseudo-potential output so I have no out put. I don`t know what is the problem. I checked the output file and it show it stop

Re : [SIESTA-L] a request

2012-11-30 Por tôpico karim rezouali
Dear Zara, http://icmab.cat/leem/siesta/Databases/BasisSets/La/ Yours, Karim hi every body I am trying to work on a structure which have lantanium, with sithe help of siesta code so I needed Lantanium psf file. As you know siesta site doesn`t have it, I tried to generate it but I couldn`t. i

[SIESTA-L] a request

2012-11-30 Por tôpico Zahra Talebi
hi every body I am trying to work on a structure which have lantanium, with sithe help of siesta code so I needed Lantanium psf file. As you know siesta site doesn`t have it, I tried to generate it but I couldn`t. if any body can generat it or have it, I would be so thanksfull to have that. tha

Re: Re: [SIESTA-L] seeing structure

2012-11-30 Por tôpico Jose a Torres
(sorry! I just sent  by accident an unfinished message by touching the wrong button I complete it here) Dear Zahra Talebi You can directly load an visualize any fdf using "deneb", it is a new software for windows and linux that  you can freely download from the webpage of atelgraphics, they hav

Re: Re: [SIESTA-L] seeing structure

2012-11-30 Por tôpico Jose a Torres
Dear Zahra Talebi You can directly load an visualize any fdf using "deneb", it is a new software for windows and linux that  you can freely download from the webpage of atelgraphics, they have also some demonstration videos  in their youtube channel (search for "atelgraphics" in youtube). It wo