The ABINIT Users Mailing List ( CLOSED )

[Xavier Gonze <gonze@pcpm.ucl.ac.be>]

On 27 Oct 2006, at 12:05, J Rufinus wrote:

>  Hello all,
>
>  I was wondering whether ABINIT could do LDA+U calculations?
>  If yes, how? Helps are appreciated. Thank you.

LDA+U is present in ABINITv5.2.3 (with PAW - however it is not fully  
documented,
and not considered in production). See paragraph D1 of the release_notes
for v5.2 :
http://www.abinit.org/Infos_v5.2/release_notes/release_notes.html .
Likely available in  production v5.3 (beginning of 2007).

Xavier