Teoroo-CMC / CCS

Curvature Constrained Splines
GNU General Public License v3.0
8 stars 11 forks source link

Forces #20

Closed jollactic closed 1 year ago

jollactic commented 1 year ago

FIX: Updated functionality in the scripts so they use argsparser. Force fitting is implemented and partially check, seems to work well for monoatomic systems.