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root/group/trunk/OOPSE-4/forceFields/DUFF2.frc
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Comparing trunk/OOPSE-4/forceFields/DUFF2.frc (file contents):
Revision 2247 by chrisfen, Sun May 29 21:14:38 2005 UTC vs.
Revision 2292 by chrisfen, Thu Sep 15 00:10:58 2005 UTC

# Line 46 | Line 46 | Ar             39.948          
46   Ne              20.1797        
47   S               32.066          
48   Cl              35.4527        
49 + Cl-             35.4527
50 + Na+             22.98977
51   Ar              39.948          
52   Br              79.904          
53   Kr              83.80
# Line 102 | Line 104 | Ar             0.238068461226  3.41
104   Ne              0.09339914589   2.72
105   S               0.36366050421   3.52
106   Cl              0.344781953445  3.35
107 + Cl-             0.100           4.445
108 + Na+             0.118           2.579
109   Ar              0.238068461226  3.41
110   Br              0.511111921764  3.54
111   Kr              0.32590340268   3.83
# Line 123 | Line 127 | end ChargeAtomTypes
127   EP_TIP4P-Ew     -1.04844
128   EP_TIP5P        -0.241
129   Cl              -1.0
130 + Cl-             -1.0
131 + Na+             1.0
132   end ChargeAtomTypes
133  
134   begin MultipoleAtomTypes

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