Page 1 of 1

ISMEAR parameter

Posted: Fri Apr 05, 2013 10:00 am
by nimy
When we calculated the frequency dependent dielectric function of graphene, we found that if we chose ISMEAR=-5, the YY component of elision is very large around E=0, about more than 100000. Obviously, I think it is wrong,However, if we chose ISMEAR=0, the YY component of epsilon is almost equal to XX component, but the data are not correct. I do not know why? Anybody meets such problem?

Re: ISMEAR parameter

Posted: Thu Sep 12, 2024 8:26 am
by support_vasp

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