[Wien] parameters in LDA+U

Stefaan Cottenier Stefaan.Cottenier at fys.kuleuven.be
Tue Feb 28 11:16:33 CET 2006


>       I have see the NiO example for LDA+U .The example file is write below:
>NiO.inorb
>     But I don't quite understand what are nlorb and lorb stand for.Can anyone tell me?
>NiO.indm
>     Another question is the last raw (r-index, (l,s)index) stands for?
>Thank you in advance!
>
>  
>
Be sure to check the userguide -- the meaning and use of these 
parameters is described there in the section on orb and lapwdm.

Stefaan



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