| # | Line 166 | Line 166 | void Molecule::getCOMvel( double mtot, double COMvel[3 | |
|---|---|---|
| 166 | ||
| 167 | } | |
| 168 | ||
| 169 | < | void Molecule::getCOMvel( double mtot, double COMvel[3] ) { |
| 169 | > | double Molecule::getCOMvel( double COMvel[3] ) { |
| 170 | ||
| 171 | < | double mass; |
| 171 | > | double mass, mtot; |
| 172 | int i; | |
| 173 | ||
| 174 | COMvel[0] = 0.0; | |
| # | Line 178 | Line 178 | void Molecule::getCOMvel( double mtot, double COMvel[3 | |
| 178 | ||
| 179 | for (i=0; i < nAtoms; i++) { | |
| 180 | if (myAtoms[i] != NULL) { | |
| 181 | < | |
| 181 | > | |
| 182 | mass = myAtoms[i]->getMass(); | |
| 183 | mtot += mass; | |
| 184 | COMvel[0] += myAtoms[i]->get_vx() * mass; | |
| # | Line 192 | Line 192 | void Molecule::getCOMvel( double mtot, double COMvel[3 | |
| 192 | COMvel[1] /= mtot; | |
| 193 | COMvel[2] /= mtot; | |
| 194 | ||
| 195 | + | return mtot; |
| 196 | + | |
| 197 | } | |
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