[Wien] Hybrid funtional

tran at theochem.tuwien.ac.at tran at theochem.tuwien.ac.at
Sun Jun 11 08:43:37 CEST 2017


LDA+U, onsite hybrid, and full hybrid are all supposed to be
better than normal LDA/GGA for correlated systems.
It would not really make sense to mix them together.

On Sunday 2017-06-11 04:33, karima Physique wrote:

>Date: Sun, 11 Jun 2017 04:33:38
>From: karima Physique <physique.karima at gmail.com>
>Reply-To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
>To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
>Subject: [Wien] Hybrid funtional
>
>Dear wien2k users;
>
>Are the full hybrid funtional sufficient for the treatment of highly correlated systems (use of full hybrid functional without the need to add the hubbard
>term).
>
>


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