My Community

Good day,

I have been learning how to perform calculations using VASP for some research on graphene and I had a question regarding doping materials in general. How does one represent doping within VASP? For example, how can we create the POSCAR files to show atom substitution or application on a metal substrate?

Also, is anyone acquainted with plotting 3D band structures? I have been using p4vasp for creating diagrams, but I have seen a few plots in 3D.

Any hints or references would be appreciated.

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