Hello Does anybody know if there is a tool to convert pseudopotentials from the abinit format to siesta format?
Thanks Huan On Tue, Nov 15, 2011 at 2:53 PM, Diana Otalvaro <[email protected]>wrote: > Hello, > > Does someone have at hand some siesta-readable LDA TM2 pseudopotentials > for Boron and Nitrogen? Since the siesta database is down, I cannot > download them. > > Also, is there a tool to convert pseudopotentials in Abinit format to > siesta format? I read in the siesta manual that it is possible to convert > from XML format to psf format using Util/pseudo-xml. Is there a similar > tool to convert from the standard Abinit format to psf? Otherwise, where do > I get the pseudopotentials in XML format? > > I greatly appreciate anybody's help with this. > > All the best, > > Diana > > > > Diana Otálvaro > [email protected] > Computational Material Science > MESA+ Institute for Nanotechnology > University of Twente > Carre 4049 > Postbus 217 > NL-7500 AE Enschede > tel: +31-53-489-2986 > > > > > > > > > > -- Regards Huan Tran Department of Physics University of Basel, Switzerland Email: [email protected]
