[Pw_forum] Spin orbit coupling with hybrid functional
Lorenzo Paulatto
lorenzo.paulatto at impmc.upmc.fr
Fri Dec 4 20:38:04 CET 2015
On Friday, December 04, 2015 05:44:59 PM Prasenjit Ghosh wrote:
> Dear all,
>
> Is it possible to do spin-orbit calculations with hybrid functionals in QE?
>
> With regards,
>
> Prasenjit
Yes, but only norm-conserving pseudpotentials
--
Dr. Lorenzo Paulatto
IdR @ IMPMC -- CNRS & Université Paris 6
+33 (0)1 44 275 084 / skype: paulatz
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