How to edit main.F

Bader charge density analysis

Moderator: moderators

Post Reply
Site Admin
Posts: 1999
Joined: Tue Apr 26, 2005 4:25 am

Re: How to edit main.F

Post by graeme »

I don't think that it's important to modify the vasp code for the Bader analysis. This can all be done by analyzing the CHGCAR file(s) that are written by vasp 4.x or 5.x.
Post Reply