The ABINIT Users Mailing List ( CLOSED )

[Geneste Gregory <geneste@cemes.fr>]

Hi !
I have a little program to visualize the states from the _WFK file, either
on a line, a plane or a volume. My program creates files that can be read
by gnuplot, dataexplorer or vaspview.
I can send it to you if you want.
If you are interested in the way the c(G) coefficients are stored and to
which G-vector they are related, you can look in the corresponding part of
the program (I only took this part from ABINIT, but I don't remember
in which routine it is...)
probably someone can tell us???

best regards
Gregory
>
> It's probably of general interest to anybody who wants to use the
> wavefunction from ABINIT to either set istwfk = 1 or be careful
> reconstructing the coefficients. The latter would probably require
> quite a bit of searching through the G-vector list (kg) to find the
> index corresponding to -G. Does anybody have any code to share that
> does this? (It never hurts to ask.. :)