The ABINIT Users Mailing List ( CLOSED )

[Jian ZHOU <zjspam@gmail.com>]

I think it is said in th FAQ:

- Tips to use ABINIT : Bandstructure: why my output includes fewer
k-points than I expected ?
The default value is limited to 50. Set prtvol as 10 (and prteig as 1
for v.4.3.3, v.4.4.x and the newer versions). (e-mail).


On 8/11/05, Steven Homolya <steven.homolya@sci.monash.edu.au> wrote:
> Dear fellow Abinitioners,
> 
> I have iscf=-2, and lots of k-points for a bandstructure calculation but the
> output stops at 50 k-points. After printing the eigenvalues for 50 k-points,
> output file says:
> 
> prteigrs : prtvol=0 or 1, do not print more k-points.
> 
> This appears contradictory to documentation, i.e. prtvol variable 
> description:
> 
> prtvol=0 or 1: ... if iscf=-2, the eigenvalues for all the k points are
> printed anyway.
> 
> I'll try again with prtvol=2.
> 
> --
> Steven Homolya
> School of Physics
> Monash University, VIC 3800
> Australia
> Tel: +61 3 9905 3646
> Fax: +61 3 9905 3637
> 
>