| # | Line 284 | Line 284 | namespace OpenMD { | |
|---|---|---|
| 284 | myDerivC)*sigmai; | |
| 285 | ||
| 286 | (*(idat.pot))[VANDERWAALS_FAMILY] += *(idat.sw) * pot_temp; | |
| 287 | < | *(idat.f1) = *(idat.d) * dudr / *(idat.rij); |
| 287 | > | *(idat.f1) += *(idat.d) * dudr / *(idat.rij); |
| 288 | } | |
| 289 | return; | |
| 290 | } | |
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