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Re: [abinit-forum] Ultrasoft Pseudopotentials, Vanderbilts USPP, Elements: Ge, In, Sn, Sb, Te


Chronological Thread 
  • From: David Vanderbilt <dhv@physics.rutgers.edu>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] Ultrasoft Pseudopotentials, Vanderbilts USPP, Elements: Ge, In, Sn, Sb, Te
  • Date: Sun, 20 Aug 2006 16:54:40 -0400 (EDT)

Pascal,

There are ultrasoft potentials available for some of these at the CAMPOS
site. I am looking at

http://oldwww.fysik.dtu.dk/CAMPOS/Documentation/Dacapo/PseudoPotentialOverView/index.html

although I am not sure this is the most up-to-date page.

(As you probably know, if you want to use these with ABINIT, you will
have to PAW-ize them -- see http://www.abinit.org/PAW/ .)

David Vanderbilt


On Thu, 17 Aug 2006, Pascal Rausch wrote:

Dear Abinit Users,

has anybody already generated Ultrasoft Pseudopotentials for Ge, In, Sn, Sb, Te, using Vanderbilt's USPP? If so, is it possible to obtain them?

Yours sincerely,


Pascal Rausch





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