| # | Line 123 | Line 123 | namespace OpenMD { | |
|---|---|---|
| 123 | cfrc = atom->getFlucQFrc(); | |
| 124 | cmass = atom->getChargeMass(); | |
| 125 | ||
| 126 | + | cerr << cpos << "\t" << cvel << "\t" << cfrc << "\t" << instTemp << "\t" <<chi << "\t" << integralOfChidt << "\n"; |
| 127 | // velocity half step | |
| 128 | cvel += dt2_ * cfrc / cmass - dt2_*chi*cvel; | |
| 129 | // position whole step | |
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