[Wien] L -4

[Peter Blaha]

No.

We expand the density in "real" spherical harmonics, which are linear 
combinations of    Y_44 +/- Y_4-4  and these two combinations are 
labeled that way.

There are papers by Kurki-Suonio, or see the UG (lapw2).


On 09/12/2013 04:05 PM, John Rundgren wrote:
> Dear WIEN2k team,
> In case.clmsum and case.vcoul one finds designations like
>     CLM(R) FOR L  4   M= 4
>     CLM(R) FOR L -4   M= 4
> Does the second line mean
>     CLM(R) FOR L  4   M= -4 ?
> John Rundgren / KTH
>
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> SEARCH the MAILING-LIST at:  http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
>

-- 

                                       P.Blaha
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300             FAX: +43-1-58801-165982
Email: blaha at theochem.tuwien.ac.at    WWW: 
http://info.tuwien.ac.at/theochem/
--------------------------------------------------------------------------