[Wien] GGA+U and case. ineece

[ali ghafari]

Dear Prof. Tran
Thank you very much for your replay.

what about mbj+U? should I use case.  ineece ?
Best Regards
Ali



________________________________
 From: "tran at theochem.tuwien.ac.at" <tran at theochem.tuwien.ac.at>
To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at> 
Sent: Monday, July 9, 2012 9:10 AM
Subject: Re: [Wien] GGA+U and case. ineece
 
case. ineece is only for hybrid functionals. For GGA+U you need
case.indm and case.inorb.

On Sun, 8 Jul 2012, ali ghafari wrote:

> Dear Prof. Blaha and users
> 
> 
> Is it necessary to use 'case. ineece' in all functionals in the GGA+U method, or it should be used only for Hybrid functional in the GGA+U method?
> Best Regards
> Ali
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