| 241 |
|
|
| 242 |
|
//store the tau and long range potential |
| 243 |
|
curSnapshot->statData[Stats::LONG_RANGE_POTENTIAL] = lrPot; |
| 244 |
< |
// curSnapshot->statData[Stats::LONG_RANGE_POTENTIAL] = longRangePotential; |
| 245 |
< |
curSnapshot->statData[Stats::VANDERWAALS_POTENTIAL] = longRangePotential[VDW_POT]; |
| 244 |
> |
// curSnapshot->statData[Stats::LONG_RANGE_POTENTIAL] = longRangePotential; |
| 245 |
> |
curSnapshot->statData[Stats::VANDERWAALS_POTENTIAL] = longRangePotential[VDW_POT]; |
| 246 |
|
curSnapshot->statData[Stats::ELECTROSTATIC_POTENTIAL] = longRangePotential[ELECTROSTATIC_POT]; |
| 247 |
|
|
| 248 |
|
curSnapshot->statData.setTau(tau); |