Back to Marketplace
harmonic bonds harmonic angles opls dihedrals cvff impropers

TraPPE-UA

Free
Force Field Class 1 by Jungular

Transferable Potentials for Phase Equilibria — United Atom. Coarse-grained force field optimized for vapor-liquid equilibria of hydrocarbons.

Class 1
arithmetic mixing
1-4 LJ: 0
1-4 Coul: 0
1 downloads