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Re: [abinit-forum] does abinit can do a L(S)DA+U calculation?


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  • From: Xavier Gonze <gonze@pcpm.ucl.ac.be>
  • To: zjspam@gmail.com, "'forum@abinit.org'" <forum@abinit.org>
  • Subject: Re: [abinit-forum] does abinit can do a L(S)DA+U calculation?
  • Date: Sat, 10 Sep 2005 22:11:16 +0200

Jian ZHOU wrote:
Dear all,

Does abinit can do a L(S)DA+U calculation? I searched in the Mailing List and found no answers there.

L(S)DA+U is not possible with ABINIT at present.
Sorry ...

Xavier

NB : It should not be very difficult to implement it on top of the
existing PAW methodology... You might try !




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