1; Argon force field and topology
2;
3; Lennard-Jones parameters for liquid argon taken from
4; White, J.A., Lennard-Jones as a model for argon and test of extended
5; renormalization group calculations. J. Chem. Phys. 111, 9352 (1999)
6;
7
8[ defaults ]
9; nbfunc  comb-rule
10  1       3
11
12[ atomtypes ]
13; full atom descriptions are available in ffoplsaa.atp
14; name  bond_type    mass    charge   ptype     sigma      epsilon
15AR      AR           39.948  0.0      A         0.3345     1.045128
16
17[ molecule_type ]
18Argon  1
19
20[ atoms ]
21;   nr   type  resnr residue  atom   cgnr   charge
22    1    AR    1     AR       AR     1      0
23
24
25[ system ]
26; Name
27Argon
28
29[ molecules ]
30; Compound        #mols
31  Argon           5832
32