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root/OpenMD/branches/development/src/brains/Stats.hpp
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Comparing branches/development/src/brains/Stats.hpp (file contents):
Revision 1710 by gezelter, Fri May 18 21:44:02 2012 UTC vs.
Revision 1760 by gezelter, Thu Jun 21 19:26:46 2012 UTC

# Line 77 | Line 77 | namespace OpenMD {
77        TRANSLATIONAL_KINETIC,
78        ROTATIONAL_KINETIC,
79        LONG_RANGE_POTENTIAL,  
80 –      SHORT_RANGE_POTENTIAL,
80        VANDERWAALS_POTENTIAL,
81        ELECTROSTATIC_POTENTIAL,
82 +      METALLIC_POTENTIAL,
83 +      HYDROGENBONDING_POTENTIAL,
84 +      SHORT_RANGE_POTENTIAL,
85        BOND_POTENTIAL,
86        BEND_POTENTIAL,
87        DIHEDRAL_POTENTIAL,
88        INVERSION_POTENTIAL,
89 <      VRAW,
90 <      VHARM,
89 >      RAW_POTENTIAL,
90 >      RESTRAINT_POTENTIAL,
91        PRESSURE_TENSOR_XX,
92        PRESSURE_TENSOR_XY,
93        PRESSURE_TENSOR_XZ,
# Line 101 | Line 103 | namespace OpenMD {
103        TAGGED_PAIR_DISTANCE,
104        RNEMD_EXCHANGE_TOTAL,
105        SHADOWH,
106 +      THERMAL_HELFANDMOMENT_X,
107 +      THERMAL_HELFANDMOMENT_Y,
108 +      THERMAL_HELFANDMOMENT_Z,
109 +      HEATFLUX_X,
110 +      HEATFLUX_Y,
111 +      HEATFLUX_Z,  
112        ENDINDEX  //internal use
113      };
114  

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