| # | Line 111 | Line 111 | namespace OpenMD { | |
|---|---|---|
| 111 | cerr << atom->getType() << "\tQ Pos: " << atom->getFlucQPos() << "\n"; | |
| 112 | } | |
| 113 | } | |
| 114 | + | // std::cerr << "after minim\n"; |
| 115 | + | // for (mol = info_->beginMolecule(i); mol != NULL; |
| 116 | + | // mol = info_->nextMolecule(i)) { |
| 117 | + | // for (atom = mol->beginFluctuatingCharge(j); atom != NULL; |
| 118 | + | // atom = mol->nextFluctuatingCharge(j)) { |
| 119 | + | // cerr << "q = " << atom->getFlucQPos(0.0) << "\n"; |
| 120 | + | // } |
| 121 | + | // } |
| 122 | + | |
| 123 | + | |
| 124 | } | |
| 125 | ||
| 126 | ||
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