Is it possible to continue a self-consistent run that has the tag "lwannier90=true" to write the files for a wannier90 run?
If not, how should the self-consistent run prior to the Wannier90 calculation be formulated if it must be done in multiple steps?
Continuation Run with Wannier90
Moderators: Global Moderator, Moderator
-
- Administrator
- Posts: 282
- Joined: Mon Sep 24, 2018 9:39 am
Re: Continuation Run with Wannier90
Dear James,
as far as I know, one needs the "mmn" and "amn" matrices. They are writen if your INCAR contains a line with LWRITE_MMN_AMN=.TRUE..
as far as I know, one needs the "mmn" and "amn" matrices. They are writen if your INCAR contains a line with LWRITE_MMN_AMN=.TRUE..