Revision: | 1334 |
Committed: | Fri Jul 16 18:58:03 2004 UTC (20 years, 1 month ago) by gezelter |
File size: | 311 byte(s) |
Log Message: | Initial import of OOPSE-1.0 source tree |
# | Content |
---|---|
1 | ! This is the forcefield file for the TraPPE force field. |
2 | ! the sections are divided into AtomTypes, BondTypes, BendTypes, |
3 | ! and TorsionTypes. |
4 | |
5 | |
6 | #AtomTypes |
7 | !Atom isDipole mass LJ epsilon ( kcal/mol) LJ sigma (Angstroms) Dipole Moment (Debye) |
8 | |
9 | SSD 1 18.03 0.152 3.051 2.35 |
10 | Ar 0 39.95 0.226 3.41 |