[Pw_forum] Help for a NC PS for Zn

[Nicola Marzari]

On 6/25/11 12:47 PM, Mahdi Mirnezhad wrote:
> Dear Users,
> I need a NC PS for ZN,
> any suggestion appreciated,
> Thanks in advance,


You can download FHI98PP (google it), generate the Troullier-Martins
pseudo there, and convert it to UPF using the QE upftools program
fhi2upf.

			nicola

-- 
----------------------------------------------------------------------
Prof Nicola Marzari    Department of Materials    University of Oxford
Chair of Materials Modelling  Director, Materials Modelling Laboratory
nicola.marzari at materials.ox.ac.uk     http://mml.materials.ox.ac.uk/NM