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root/OpenMD/branches/development/forceFields/SuttonChen.SC.frc
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Comparing:
trunk/forceFields/SuttonChen.SC.frc (file contents), Revision 830 by chuckv, Thu Dec 29 20:19:23 2005 UTC vs.
branches/development/forceFields/SuttonChen.SC.frc (file contents), Revision 1465 by chuckv, Fri Jul 9 23:08:25 2010 UTC

# Line 2 | Line 2 | begin Options
2   // See Rafii-Tabar and Chen Phil. Mag. Letters. 63(1991), 217-224 for alloy formulation for SC varient
3  
4   begin Options
5 <      Name                  "SC"
6 <      DistanceMixingRule    "Geometric"
7 <      EnergyMixingRule      "Geometric"
5 >      Name                  SC
6 >      DistanceMixingRule    Geometric
7 >      EnergyMixingRule      Geometric
8   //  energy unit are eV. Convert to kcal/mol
9        EnergyUnitScaling     0.02306054
10   end Options
11  
12 < begin AtomTypes
12 > begin BaseAtomTypes
13   //Name        mass(amu)
14   Ni      58.710
15   Cu      63.550
# Line 21 | Line 21 | Al     26.981538
21   Au      196.97
22   Pb      207.2
23   Al      26.981538
24 < end AtomTypes
24 > end BaseAtomTypes
25  
26  
27   begin SCAtomTypes

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