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Re: [abinit-forum] Problem with Ni-Ti Alloys


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  • From: Masayoshi Mikami <mmikami@rc.m-kagaku.co.jp>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] Problem with Ni-Ti Alloys
  • Date: Mon, 4 Jul 2005 19:19:14 +0900

Dear Sestak,

"Dobry den." (in Czech)
Please look into your pseudopotential files,
in particular, the header part.
You might want to refer to the related documents
(~ABINIT/Infos/Psp_infos/* ). Kindly also consult
with relevant papers cited in ~Infos/bibliography.html,
or http://www.abinit.org/ABINIT/Infos/bibliography.html.

Good continuation,
Masayoshi

On 2005/07/04, at 17:27, ysesta00@stud.fme.vutbr.cz wrote:

I am using pseudopotencials from the web site of Abinit and I don't know, how these pseudopotencials have been generated, especialy which corrections were included. I am trying to generate my own files of pseudopotentials now.

Peter Sestak





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