Parsing of magnetic moments and penalty energies from OSZICARs #4066
JonathanSchmidt1
started this conversation in
General
Replies: 1 comment
-
sounds like an excellent addition! PR would be much appreciated! 👍 |
Beta Was this translation helpful? Give feedback.
0 replies
Sign up for free
to join this conversation on GitHub.
Already have an account?
Sign in to comment
-
Hi,
For some personal project I added some extra parsing capabilities for magnetic moments and penalty energies to the OSZICAR
class I was wondering whether there is some general interest to add this to pymatgen. In that case I could add a test and open a pull request.
Beta Was this translation helpful? Give feedback.
All reactions