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root/OpenMD/branches/development/src/io/ForceFieldOptions.hpp
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Comparing branches/development/src/io/ForceFieldOptions.hpp (file contents):
Revision 1465 by chuckv, Fri Jul 9 23:08:25 2010 UTC vs.
Revision 1479 by gezelter, Mon Jul 26 19:00:48 2010 UTC

# Line 70 | Line 70 | namespace OpenMD {
70      DeclareParameter(electrostatic14scale, RealType);
71      DeclareParameter(GayBerneMu, RealType);
72      DeclareParameter(GayBerneNu, RealType);
73 +    DeclareParameter(EAMMixingMethod, std::string);
74      
75    public:
76      ForceFieldOptions();
# Line 83 | Line 84 | namespace OpenMD {
84        CheckParameter(EnergyMixingRule, isEqualIgnoreCase(std::string("arithmetic")) || isEqualIgnoreCase(std::string("geometric")) || isEqualIgnoreCase(std::string("hhg")));
85        CheckParameter(TorsionAngleConvention, isEqualIgnoreCase(std::string("180 is trans")) || isEqualIgnoreCase(std::string("0 is trans")));
86        CheckParameter(CutoffPolicy, isEqualIgnoreCase(std::string("MIX")) || isEqualIgnoreCase(std::string("MAX")) || isEqualIgnoreCase(std::string("TRADITIONAL")));
87 +      CheckParameter(EAMMixingMethod, isEqualIgnoreCase(std::string("JOHNSON")) || isEqualIgnoreCase(std::string("DAW")));
88     }
89      
90      bool setData(const std::string& keyword, const std::string& value) {

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