| # | Line 951 | Line 951 | namespace OpenMD { | |
|---|---|---|
| 951 | } | |
| 952 | ||
| 953 | #else | |
| 954 | + | |
| 955 | ||
| 956 | + | // cerr << "atoms = " << atom1 << " " << atom2 << "\n"; |
| 957 | + | // cerr << "pos1 = " << snap_->atomData.position[atom1] << "\n"; |
| 958 | + | // cerr << "pos2 = " << snap_->atomData.position[atom2] << "\n"; |
| 959 | + | |
| 960 | idat.atypes = make_pair( atypesLocal[atom1], atypesLocal[atom2]); | |
| 961 | //idat.atypes = make_pair( ff_->getAtomType(idents[atom1]), | |
| 962 | // ff_->getAtomType(idents[atom2]) ); | |
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