The ABINIT Users Mailing List ( CLOSED )

[Katalin Gaal-Nagy <katalin.gaal-nagy@physik.uni-regensburg.de>]

Dear Chun Li,

the way to receive "good" k-points which are not breaking the symmetry of 
your 
system is given by the use of the parameters
 prtkpt 1
 kptopt 1
 kptrlen [some number, default 20.0d0]
Then the code gives you some sets of k-points which fit to your system. You 
can 
check the input variables in the net. Besides in the output all possible 
k-point 
grids are given, even if the final list contains just the "most effective" 
ones.

Good luck,
Katalin



 
> Dear Hamann,
> 
> Thank you for your reply. But do you know if there exists some variable
> that can suppress this kind of stop? 
> 
> Have a good weekend.
> 
> Chun Li
>