Questions tagged [interatomic-potentials]

Questions related to the various types of interatomic potentials that are used in materials modeling.

1 question with no upvoted or accepted answers
Filter by
Sorted by
Tagged with
8 votes
0 answers
99 views

DIY molecular dynamics for Xenes on crystal surfaces; where can I get applicable open-source force field parameters that I can use in my scripts?

The linked question(s) below describes a DIY project to simulate how Xenes (honeycomb nets of atoms like graphehe) behave on single crystal surfaces. Behaviors include rotation, strain, and heigh ...
uhoh's user avatar
  • 1,894