Page 1 of 1

ZBRENT: accuracy reached

Posted: Thu Oct 22, 2020 7:48 pm
by xiaohan_bie1
Dear all,

For my VASP simulation of metal phase boundaries, between each ionic step, I got the "ZBRENT: accuracy reached" notice in my output file. However, my results are not convergent after many notices. What is the problem here?

Thanks,
Erica

Re: ZBRENT: accuracy reached

Posted: Fri Oct 23, 2020 10:28 am
by ferenc_karsai
Please read the posting guidelines. That means please send the necessary files described in the guideline.