Re: [SIESTA-L] psf of Boron

2015-02-27 Por tôpico Jean-Joseph Adjizian
There are some already available on the website for LDA and GGA. http://departments.icmab.es/leem/siesta/Databases/Pseudopotentials/periodictable-intro.html And if you dont want to use these ones, you can generate one using the ATOM program. Cheers, Jean-Jo Dr Jean-Joseph Adjizian

[SIESTA-L] psf of Boron

2015-02-27 Por tôpico aouchenni boudjemaa
Hi siesta users,                    Is some one has the psf optimised of Boron (B). thanks in advanceB. Aouchenni

[SIESTA-L] Psf of Boron

2015-01-23 Por tôpico aouchenni boudjemaa
Hi siesta users,  is there some one who has the optimized psf of Boron to shear with me ? thanks in advanceB. Aouchenni