[Wien] Constructing lattice harmonics from "real" spherical harmonics

[Peter Blaha]

> >Just have a look e.g. into   SRC_lapw5/sum.f
> >
> >This lists clearly the coefficients for the "cubic harmonics" and you can
> >also see how they are combined.
>
> How about for the non-cubic cases? I poked around but couldn't figure out
> where they were.

SRC_lapw5/charge.f

If IATNR is a "negative" number, then it's non-cubic and the four cases
are checked.
Otherwise subroutine sum is called.

Regards
                                      P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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