[Wien] [WIEN]about the file case.radwf

[tran at theochem.tuwien.ac.at]

This file is generated in the subroutine $WIENROOT/SRC_lapw2/l2main.F.
You can find where exactly by searching for "write(23)"
(23 is the unit number if this file).
RRAD1 and a1lo are the large component of the relativistic
radial functions, and RRAD2 and b1lo are the samll component.

F. Tran

On Tue, 31 Mar 2015, ???????? wrote:

> Hello,
> my question is about the radial function in the Bloch eigenfunction, 
> as I know, the information of the radial function is saved in the file:
> case.radwf,
> and the first line is about the function:
> r(n)=r0*exp[(n-1)*x]
> 
> Thus I'd like to know the meaning of the other data in the file.
> Think you!
> 
> X.Y.Bo,NJU,China
> 
>