85 |
|
Stats::title_[IMPROPER_POTENTIAL] = "Improper Potential"; |
86 |
|
Stats::title_[VRAW] = "Raw Potential"; |
87 |
|
Stats::title_[VHARM] = "Harmonic Potential"; |
88 |
+ |
Stats::title_[PRESSURE_TENSOR_X] = "presure tensor x"; |
89 |
+ |
Stats::title_[PRESSURE_TENSOR_Y] = "presure tensor y"; |
90 |
+ |
Stats::title_[PRESSURE_TENSOR_Z] = "presure tensor z"; |
91 |
+ |
|
92 |
|
|
93 |
|
Stats::units_[TIME] = "fs"; |
94 |
|
Stats::units_[TOTAL_ENERGY] = "kcal/mol"; |
109 |
|
Stats::units_[IMPROPER_POTENTIAL] = "kcal/mol"; |
110 |
|
Stats::units_[VRAW] = "kcal/mol"; |
111 |
|
Stats::units_[VHARM] = "kcal/mol"; |
112 |
+ |
Stats::units_[PRESSURE_TENSOR_X] = "amu*fs^-2*Ang^-1"; |
113 |
+ |
Stats::units_[PRESSURE_TENSOR_Y] = "amu*fs^-2*Ang^-1"; |
114 |
+ |
Stats::units_[PRESSURE_TENSOR_Z] = "amu*fs^-2*Ang^-1"; |
115 |
+ |
|
116 |
|
} |
117 |
|
|
118 |
|
} |