ase calculator #23
Answered
by
Linux-cpp-lisp
chen-jialan
asked this question in
Q&A
ase calculator
#23
-
|
Hi, |
Beta Was this translation helpful? Give feedback.
Answered by
Linux-cpp-lisp
Feb 9, 2023
Replies: 1 comment
-
|
Hi @chen-jialan , See mir-group/nequip#115 for an example of using |
Beta Was this translation helpful? Give feedback.
0 replies
Answer selected by
Linux-cpp-lisp
Sign up for free
to join this conversation on GitHub.
Already have an account?
Sign in to comment
Hi @chen-jialan ,
See mir-group/nequip#115 for an example of using
nequip.ase.NequIPCalculator, which works with Allegro in the exact same way.