| # | Line 72 | Line 72 | int main(int argc, char *argv []) { | |
|---|---|---|
| 72 | ||
| 73 | int main(int argc, char *argv []) { | |
| 74 | ||
| 75 | – | //register force fields |
| 76 | – | registerForceFields(); |
| 75 | registerLattice(); | |
| 76 | ||
| 77 | gengetopt_args_info args_info; | |
| # | Line 127 | Line 125 | int main(int argc, char *argv []) { | |
| 125 | /* Build a lattice and get lattice points for this lattice constant */ | |
| 126 | vector<Vector3d> sites = nanoParticle.getSites(); | |
| 127 | vector<Vector3d> orientations = nanoParticle.getOrientations(); | |
| 128 | + | |
| 129 | + | |
| 130 | std::vector<int> vacancyTargets; | |
| 131 | vector<bool> isVacancy; | |
| 132 | ||
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |