Skip to content
Snippets Groups Projects
Commit e1046737 authored by Gareth Tribello's avatar Gareth Tribello
Browse files

Added dynamic lists for central atom derivatives

This should make the code a bit faster as we don't have to loop over all the atoms
any more when using the position of a central atom.  We only have to loop over the
positions of atoms that have a central derivative (for most things 1 atom).  Also
changed DynamicList so we aren't doing lots of vector.push_backs
parent 928a2724
No related branches found
No related tags found
No related merge requests found
Loading
0% Loading or .
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment