[Pw_forum] LDA Ultrasoft pseudopotential for Mg

[Jonathan Breeze]

Hi Derek,

Have you tried converting a Vanderbilt pseudopotential to UPF format
using the upftools?

Jonathan Breeze
Research Fellow

Department of Materials
Imperial College London
Exhibition Road
London SW7 2AZ


On Fri, 2007-06-08 at 10:17 -0400, stewart at cnf.cornell.edu wrote:
> Hi all, 
> 
> I was wondering if anyone had a reliable ultrasoft pseudopotential for Mg in 
> the local density approximation.  The periodic table on the PWscf site has 
> only norm-conserving and a GGA ultrasoft. 
> 
> Thanks, 
> 
> Derek 
> 
> 
> ################################
> Derek Stewart, Ph. D.
> Scientific Computation Associate
> 250 Duffield Hall
> Cornell Nanoscale Facility (CNF)
> Ithaca, NY 14853
> stewart (at) cnf.cornell.edu
> (607) 255-2856
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