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root/OpenMD/trunk/src/brains/Stats.cpp
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Comparing trunk/src/brains/Stats.cpp (file contents):
Revision 1390 by gezelter, Wed Nov 25 20:02:06 2009 UTC vs.
Revision 1402 by chuckv, Fri Jan 8 17:15:27 2010 UTC

# Line 1 | Line 1
1   /*
2 < * Copyright (c) 2005 The University of Notre Dame. All Rights Reserved.
2 > * Copyright (c) 2005, 2009 The University of Notre Dame. All Rights Reserved.
3   *
4   * The University of Notre Dame grants you ("Licensee") a
5   * non-exclusive, royalty free, license to use, modify and
# Line 88 | Line 88 | namespace OpenMD {
88      Stats::title_[INVERSION_POTENTIAL] = "Inversion Potential";
89      Stats::title_[VRAW] = "Raw Potential";
90      Stats::title_[VHARM] = "Harmonic Potential";
91 +    Stats::title_[SHADOWH] = "Shadow Hamiltonian";
92      Stats::title_[PRESSURE_TENSOR_XX] = "P_xx";
93      Stats::title_[PRESSURE_TENSOR_XY] = "P_xy";
94      Stats::title_[PRESSURE_TENSOR_XZ] = "P_xz";
# Line 125 | Line 126 | namespace OpenMD {
126      Stats::units_[INVERSION_POTENTIAL] = "kcal/mol";
127      Stats::units_[VRAW] = "kcal/mol";
128      Stats::units_[VHARM] = "kcal/mol";
129 +    Stats::units_[SHADOWH] = "kcal/mol";
130      Stats::units_[PRESSURE_TENSOR_XX] = "amu*fs^-2*Ang^-1";
131      Stats::units_[PRESSURE_TENSOR_XY] = "amu*fs^-2*Ang^-1";
132      Stats::units_[PRESSURE_TENSOR_XZ] = "amu*fs^-2*Ang^-1";
# Line 176 | Line 178 | namespace OpenMD {
178      Stats::statsMap.insert(StatsMapType::value_type("BOX_DIPOLE_Z", BOX_DIPOLE_Z));    
179      Stats::statsMap.insert(StatsMapType::value_type("TAGGED_PAIR_DISTANCE", TAGGED_PAIR_DISTANCE));    
180      Stats::statsMap.insert(StatsMapType::value_type("RNEMD_EXCHANGE_TOTAL", RNEMD_EXCHANGE_TOTAL));    
181 +    Stats::statsMap.insert(StatsMapType::value_type("SHADOWH", SHADOWH));    
182    }
183  
184   }

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