problem regarding kpoints
Moderators: Global Moderator, Moderator
-
- Newbie
- Posts: 3
- Joined: Wed Apr 20, 2011 10:27 am
problem regarding kpoints
Hi!
This is in regard to the band structure simulation using GW approximation. Initially when i tried to run the simulation for a bulk silicon it showed an error that the kpoints are not correct so i just removed the NKRED from the incar file and it showed some iterations and now it shows that the weight of one kpoint do not sum up to one.
<span class='smallblacktext'>[ Edited ]</span>
This is in regard to the band structure simulation using GW approximation. Initially when i tried to run the simulation for a bulk silicon it showed an error that the kpoints are not correct so i just removed the NKRED from the incar file and it showed some iterations and now it shows that the weight of one kpoint do not sum up to one.
<span class='smallblacktext'>[ Edited ]</span>
Last edited by nikila on Wed Nov 30, 2011 4:15 pm, edited 1 time in total.
-
- Global Moderator
- Posts: 1817
- Joined: Mon Nov 18, 2019 11:00 am
Re: problem regarding kpoints
Hi,
We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.
Best wishes,
VASP