| 35 |
|
* |
| 36 |
|
* [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). |
| 37 |
|
* [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). |
| 38 |
< |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). |
| 39 |
< |
* [4] Vardeman & Gezelter, in progress (2009). |
| 38 |
> |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008). |
| 39 |
> |
* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010). |
| 40 |
> |
* [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). |
| 41 |
|
*/ |
| 42 |
|
|
| 43 |
|
/** |
| 62 |
|
: Bend(atom1, ghostAtom, ghostAtom, bt) { |
| 63 |
|
} |
| 64 |
|
|
| 65 |
< |
virtual void calcForce(RealType& angle); |
| 65 |
> |
virtual void calcForce(RealType& angle, bool doParticlePot); |
| 66 |
|
}; |
| 67 |
|
} //end namespace OpenMD |
| 68 |
|
#endif //PRIMITIVES_GHOSTBEND_HPP |
