| 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). |
| 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 |
|
*/ |
| 156 |
|
const static int y = atomproperty | dynamic | 3; |
| 157 |
|
const static int z = atomproperty | dynamic | 4; |
| 158 |
|
const static int r = atomproperty | dynamic | 5; |
| 159 |
+ |
const static int wrappedX = atomproperty | dynamic | 6; |
| 160 |
+ |
const static int wrappedY = atomproperty | dynamic | 7; |
| 161 |
+ |
const static int wrappedZ = atomproperty | dynamic | 8; |
| 162 |
|
|
| 163 |
|
const static int opGT = comparator | dynamic | 0; |
| 164 |
|
const static int opGE = comparator | dynamic | 1; |